diff --git a/user-doc/tutorials/others/isdb-1.txt b/user-doc/tutorials/others/isdb-1.txt
index 2d202ea623a5940b1e8781f0bd2afcc317137c03..a4726543b9ae9b38f8355b8a6303237c979b45a8 100644
--- a/user-doc/tutorials/others/isdb-1.txt
+++ b/user-doc/tutorials/others/isdb-1.txt
@@ -15,6 +15,7 @@ Once this tutorial is completed students will be able to:
\section isdb-1-resources Resources
The \tarball{isdb-1} for this project contains the following files:
+- charmm36-eef1sb.ff: the force-field files for gromacs (not needed)
- system: a folder with reference files for gromacs (not needed)
- reference-impl: a folder to perform a simple implicit solvent simulation
- reference-impl-pbmetad: a folder to perform a pbmetad implicit solvent simulation
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/atomtypes.atp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/atomtypes.atp
new file mode 100644
index 0000000000000000000000000000000000000000..19136e8eea636832b521a5c9742063aa74689ddb
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/atomtypes.atp
@@ -0,0 +1,386 @@
+; This force field generated by charmm2gmx.py from
+; multiple charmm parameter files
+; and multiple charmm topology files
+ ALG1 26.98154 ; Aluminum, for ALF4, AlF4-
+ BAR 137.32700 ; Barium Ion
+ BRGA1 79.90400 ; BRET, bromoethane
+ BRGA2 79.90400 ; DBRE, 1,1-dibromoethane
+ BRGA3 79.90400 ; TBRE, 1,1,1-dibromoethane
+ BRGR1 79.90400 ; BROB, bromobenzene
+ C 12.01100 ; carbonyl C, peptide backbone
+ CA 12.01100 ; aromatic C
+ CAD 112.41100 ; cadmium (II) cation
+ CAI 12.01100 ; aromatic C next to CPT in trp
+ CAL 40.08000 ; Calcium Ion
+ CC 12.01100 ; carbonyl C, asn,asp,gln,glu,cter,ct2
+ CC2O1 12.01100 ; sp2 carbon in amides, aldoses
+ CC2O2 12.01100 ; sp2 carbon in carboxylates
+ CC2O3 12.01100 ; sp2 carbon in acetone, ketoses
+ CC2O4 12.01100 ; c22 CD
+ CC301 12.01100 ; aliphatic C, no H's
+CC3051 12.01100 ; furan ring carbon; C2 fructose
+CC3062 12.01100 ; C2 on NE5AC
+ CC30A 12.01100 ; -C(sp3) Carbon (eq. CT)
+ CC311 12.01100 ; generic acyclic CH carbon
+CC311C 12.01100 ; patch C1 in model compound
+CC311D 12.01100 ; patch C1 in model compound
+ CC312 12.01100 ; CH carbon in linear polyols
+CC312C 12.01100 ; tf2m CH1
+CC312D 12.01100 ; from CC322C; THF anomeric carbon
+CC3151 12.01100 ; furan ring carbon
+CC3152 12.01100 ; furan ring carbon
+CC3153 12.01100 ; furan ring carbon
+CC3161 12.01100 ; C2, C3, C4 CH bound to OH
+CC3162 12.01100 ; C1 (anomeric) CH bound to OH
+CC3163 12.01100 ; C5 CH bound to exocylic CH2OH
+ CC31A 12.01100 ; -C(sp3)H Carbon (eq. CT1)
+ CC321 12.01100 ; generic acyclic CH2 carbon (hexopyranose C6)
+CC321C 12.01100 ; cyclohexane, thp CH2
+CC321D 12.01100 ; cyclohexane, thp CH2 model for 1-1 linkage
+ CC322 12.01100 ; CH2 carbon in linear polyols erh
+CC322C 12.01100 ; cyclopentane, thf CH2
+CC3251 12.01100 ; furan ring carbon; C2 deoxy
+CC325A 12.01100 ; -C(sp3)H2 Carbon in 5-membered ring
+CC325B 12.01100 ; -C(sp3)H2 Carbon in THF (tetrahydrofuran)
+CC3261 12.01100 ; C3 on NE5AC
+CC3263 12.01100 ; C5 in xylose
+CC326A 12.01100 ; -C(sp3)H2 Carbon in THP (tetrahydropyran)
+ CC32A 12.01100 ; -C(sp3)H2 Carbon (eq. CT2)
+ CC331 12.01100 ; generic acyclic CH3 carbon (xyl C6, glcna/galna CT)
+ CC33A 12.01100 ; -C(sp3)H3 Carbon (eq. CT3)
+ CCL 12.01100 ; for POPS
+ CD 12.01100 ; carbonyl C, pres aspp,glup,ct1
+ CE1 12.01100 ; for alkene; RHC=CR
+ CE2 12.01100 ; for alkene; H2C=CR
+ CEL1 12.01100 ; for alkene; RHC=CR
+ CEL2 12.01100 ; for alkene; H2C=CR. Currently unused.
+ CES 132.90545 ; Cesium Ion
+ CG1N1 12.01100 ; C for cyano group
+ CG1T1 12.01100 ; internal alkyne R-C#C
+ CG1T2 12.01100 ; terminal alkyne H-C#C
+CG251O 12.01100 ; same as CG2D1O but in 5-membered ring with exocyclic double bond
+CG252O 12.01100 ; same as CG2D2O but in 5-membered ring with exocyclic double bond
+CG25C1 12.01100 ; same as CG2DC1 but in 5-membered ring with exocyclic double bond
+CG25C2 12.01100 ; same as CG2DC2 but in 5-membered ring with exocyclic double bond
+ CG2D1 12.01100 ; alkene; RHC= ; imine C
+CG2D1O 12.01100 ; double bond carbon adjacent to heteroatom. In conjugated systems, the atom to which it is double bonded must be CG2DC1.
+ CG2D2 12.01100 ; alkene; H2C=
+CG2D2O 12.01100 ; double bond carbon adjacent to heteroatom. In conjugated systems, the atom to which it is double bonded must be CG2DC2.
+CG2DC1 12.01100 ; conjugated alkenes, R2C=CR2
+CG2DC2 12.01100 ; conjugated alkenes, R2C=CR2
+CG2DC3 12.01100 ; conjugated alkenes, H2C=
+ CG2N1 12.01100 ; conjugated C in guanidine/guanidinium
+ CG2N2 12.01100 ; conjugated C in amidinium cation
+ CG2O1 12.01100 ; carbonyl C: amides
+ CG2O2 12.01100 ; carbonyl C: esters, [neutral] carboxylic acids
+ CG2O3 12.01100 ; carbonyl C: [negative] carboxylates
+ CG2O4 12.01100 ; carbonyl C: aldehydes
+ CG2O5 12.01100 ; carbonyl C: ketones
+ CG2O6 12.01100 ; carbonyl C: urea, carbonate
+ CG2O7 12.01100 ; CO2 carbon
+CG2R51 12.01100 ; 5-mem ring, his CG, CD2(0), trp
+CG2R52 12.01100 ; 5-mem ring, double bound to N, PYRZ, pyrazole
+CG2R53 12.01100 ; 5-mem ring, double bound to N and adjacent to another heteroatom, purine C8, his CE1 (0,+1), 2PDO, kevo
+CG2R57 12.01100 ; 5-mem ring, bipyrroles
+CG2R61 12.01100 ; 6-mem aromatic C
+CG2R62 12.01100 ; 6-mem aromatic C for protonated pyridine (NIC) and rings containing carbonyls (see CG2R63) (NA)
+CG2R63 12.01100 ; 6-mem aromatic amide carbon (NA) (and other 6-mem aromatic carbonyls?)
+CG2R64 12.01100 ; 6-mem aromatic amidine and guanidine carbon (between 2 or 3 Ns and double-bound to one of them), NA, PYRM
+CG2R66 12.01100 ; 6-mem aromatic carbon bound to F
+CG2R67 12.01100 ; 6-mem aromatic carbon of biphenyl
+CG2R71 12.01100 ; 7-mem ring arom C, AZUL, azulene, kevo
+CG2RC0 12.01100 ; 6/5-mem ring bridging C, guanine C4,C5, trp
+CG2RC7 12.01100 ; sp2 ring connection with single bond(!), AZUL, azulene, kevo
+ CG301 12.01100 ; aliphatic C, no hydrogens, neopentane
+ CG302 12.01100 ; aliphatic C, no hydrogens, trifluoromethyl
+ CG311 12.01100 ; aliphatic C with 1 H, CH
+ CG312 12.01100 ; aliphatic C with 1 H, difluoromethyl
+ CG314 12.01100 ; aliphatic C with 1 H, adjacent to positive N (PROT NTER) (+)
+ CG321 12.01100 ; aliphatic C for CH2
+ CG322 12.01100 ; aliphatic C for CH2, monofluoromethyl
+ CG323 12.01100 ; aliphatic C for CH2, thiolate carbon
+ CG324 12.01100 ; aliphatic C for CH2, adjacent to positive N (piperidine) (+)
+ CG331 12.01100 ; aliphatic C for methyl group (-CH3)
+ CG334 12.01100 ; aliphatic C for methyl group (-CH3), adjacent to positive N (PROT NTER) (+)
+CG3AM0 12.01100 ; aliphatic C for CH3, NEUTRAL trimethylamine methyl carbon (#)
+CG3AM1 12.01100 ; aliphatic C for CH3, NEUTRAL dimethylamine methyl carbon (#)
+CG3AM2 12.01100 ; aliphatic C for CH3, NEUTRAL methylamine methyl carbon (#)
+CG3C31 12.01100 ; cyclopropyl carbon
+CG3C41 12.01100 ; cyclobutyl carbon
+CG3C50 12.01100 ; 5-mem ring aliphatic quaternary C (cholesterol, bile acids)
+CG3C51 12.01100 ; 5-mem ring aliphatic CH (proline CA, furanoses)
+CG3C52 12.01100 ; 5-mem ring aliphatic CH2 (proline CB/CG/CD, THF, deoxyribose)
+CG3C53 12.01100 ; 5-mem ring aliphatic CH adjacent to positive N (proline.H+ CA) (+)
+CG3C54 12.01100 ; 5-mem ring aliphatic CH2 adjacent to positive N (proline.H+ CD) (+)
+CG3RC1 12.01100 ; bridgehead in bicyclic systems containing at least one 5-membered or smaller ring
+ CL 12.01100 ; carbonyl C (acetic acid/methyl acetate)
+ CLA 35.45000 ; Chloride Ion
+ CLGA1 35.45300 ; CLET, DCLE, chloroethane, 1,1-dichloroethane
+ CLGA3 35.45300 ; TCLE, 1,1,1-trichloroethane
+ CLGR1 35.45300 ; CHLB, chlorobenzene
+ CM 12.01100 ; heme CO carbon
+ CN1 12.01100 ; Nucleic acid carbonyl carbon
+ CN1T 12.01100 ; Nucleic acid carbonyl carbon (T/U C2)
+ CN2 12.01100 ; Nucleic acid aromatic carbon to amide
+ CN3 12.01100 ; Nucleic acid aromatic carbon
+ CN3T 12.01100 ; Nucleic acid aromatic carbon, Thy C5
+ CN4 12.01100 ; Nucleic acid purine C8 and ADE C2
+ CN5 12.01100 ; Nucleic acid purine C4 and C5
+ CN5G 12.01100 ; Nucleic acid guanine C5
+ CN7 12.01100 ; Nucleic acid carbon (equivalent to protein CT1)
+ CN7B 12.01100 ; Nucleic acid aliphatic carbon for C1'
+ CN8 12.01100 ; Nucleic acid carbon (equivalent to protein CT2)
+ CN8B 12.01100 ; Nucleic acid carbon (equivalent to protein CT2)
+ CN9 12.01100 ; Nucleic acid carbon (equivalent to protein CT3)
+ CP1 12.01100 ; tetrahedral C (proline CA)
+ CP2 12.01100 ; tetrahedral C (proline CB/CG)
+ CP3 12.01100 ; tetrahedral C (proline CD)
+ CPA 12.01100 ; heme alpha-C
+ CPB 12.01100 ; heme beta-C
+ CPH1 12.01100 ; his CG and CD2 carbons
+ CPH2 12.01100 ; his CE1 carbon
+ CPM 12.01100 ; heme meso-C
+ CPT 12.01100 ; trp C between rings
+ CRL1 12.01100 ; sp3 carbon with 1 H on a ring (-CH1-) for sterols
+ CRL2 12.01100 ; carbon of methylene group on a ring (-CH2-) for sterols
+ CS 12.01100 ; thiolate carbon
+ CST 12.01100 ; CO2 carbon
+ CT 12.01100 ; aliphatic sp3 C, new LJ params, no hydrogens
+ CT1 12.01100 ; aliphatic sp3 C for CH
+ CT2 12.01100 ; aliphatic sp3 C for CH2
+ CT2A 12.01100 ; from CT2 (asp, glu, hsp chi1/chi2 fitting)
+ CT3 12.01100 ; aliphatic sp3 C for CH3
+ CTL1 12.01100 ; sp3 carbon with 1 H (-CH1-)
+ CTL2 12.01100 ; carbon of methylene group (-CH2-)
+ CTL3 12.01100 ; carbon of methyl group (-CH3)
+ CTL5 12.01100 ; carbon of methyl group (-CH3) for tetramethylammonium
+ CY 12.01100 ; TRP C in pyrrole ring
+ FE 55.84700 ; heme iron 56
+ FGA1 18.99800 ; aliphatic fluorine, monofluoro
+ FGA2 18.99800 ; aliphatic fluorine, difluoro
+ FGA3 18.99800 ; aliphatic fluorine, trifluoro
+ FGP1 18.99800 ; anionic F, for ALF4 AlF4-
+ FGR1 18.99800 ; aromatic flourine
+ H 1.00800 ; polar H
+ HA 1.00800 ; nonpolar H
+ HA1 1.00800 ; alkane, CH, new LJ params (see toppar_all22_prot_aliphatic_c27.str)
+ HA2 1.00800 ; alkane, CH2, new LJ params (see toppar_all22_prot_aliphatic_c27.str)
+ HA3 1.00800 ; alkane, CH3, new LJ params (see toppar_all22_prot_aliphatic_c27.str)
+ HAL1 1.00800 ; alphatic proton
+ HAL2 1.00800 ; alphatic proton
+ HAL3 1.00800 ; alphatic proton
+ HB1 1.00800 ; backbone H
+ HB2 1.00800 ; aliphatic backbone H, to CT2
+ HBL 1.00800 ; POPS SER backbone H
+ HC 1.00800 ; N-ter H
+ HCA1 1.00800 ; aliphatic proton, CH
+ HCA1A 1.00800 ; Alkane H attached to C(sp3)H (eq. HA1)
+HCA1C2 1.00800 ; tf2m aliphatic proton, CH1
+ HCA2 1.00800 ; aliphatic proton, CH2
+HCA25A 1.00800 ; Alkane H attached to C(sp3)H2 in 5-membered ring
+ HCA2A 1.00800 ; Alkane H attached to C(sp3)H2 (eq. HA2)
+HCA2C2 1.00800 ; cyclopentane, thp aliphatic proton, CH2
+ HCA3 1.00800 ; aliphatic proton, CH3
+ HCA3A 1.00800 ; Alkane H attached to C(sp3)H3 (eq. HA3)
+ HCA3M 1.00800 ; alcohol aliphatic proton, CH3
+ HCL 1.00800 ; charged H for PE (equivalent to protein HC)
+ HCP1 1.00800 ; polar H
+ HCP1M 1.00800 ; EGLY hydroxyl H
+ HCR1 1.00800 ; c22 HR1
+ HE1 1.00800 ; for alkene; RHC=CR
+ HE2 1.00800 ; for alkene; H2C=CR
+ HEL1 1.00800 ; for alkene; RHC=CR
+ HEL2 1.00800 ; for alkene; H2C=CR. Currently unused.
+ HGA1 1.00800 ; alphatic proton, CH
+ HGA2 1.00800 ; alphatic proton, CH2
+ HGA3 1.00800 ; alphatic proton, CH3
+ HGA4 1.00800 ; alkene proton; RHC=
+ HGA5 1.00800 ; alkene proton; H2C=CR
+ HGA6 1.00800 ; aliphatic H on fluorinated C, monofluoro
+ HGA7 1.00800 ; aliphatic H on fluorinated C, difluoro
+HGAAM0 1.00800 ; aliphatic H, NEUTRAL trimethylamine (#)
+HGAAM1 1.00800 ; aliphatic H, NEUTRAL dimethylamine (#)
+HGAAM2 1.00800 ; aliphatic H, NEUTRAL methylamine (#)
+ HGP1 1.00800 ; polar H
+ HGP2 1.00800 ; polar H, +ve charge
+ HGP3 1.00800 ; polar H, thiol
+ HGP4 1.00800 ; polar H, neutral conjugated -NH2 group (NA bases)
+ HGP5 1.00800 ; polar H on quarternary ammonium salt (choline)
+HGPAM1 1.00800 ; polar H, NEUTRAL dimethylamine (#), terminal alkyne H
+HGPAM2 1.00800 ; polar H, NEUTRAL methylamine (#)
+HGPAM3 1.00800 ; polar H, NEUTRAL ammonia (#)
+ HGR51 1.00800 ; nonpolar H, neutral 5-mem planar ring C, LJ based on benzene
+ HGR52 1.00800 ; Aldehyde H, formamide H (RCOH); nonpolar H, neutral 5-mem planar ring C adjacent to heteroatom or + charge
+ HGR53 1.00800 ; nonpolar H, +ve charge HIS he1(+1)
+ HGR61 1.00800 ; aromatic H
+ HGR62 1.00800 ; nonpolar H, neutral 6-mem planar ring C adjacent to heteroatom
+ HGR63 1.00800 ; nonpolar H, NAD+ nicotineamide all ring CH hydrogens
+ HGR71 1.00800 ; nonpolar H, neutral 7-mem arom ring, AZUL, azulene, kevo
+ HL 1.00800 ; polar H (equivalent to protein H)
+ HN1 1.00800 ; Nucleic acid amine proton
+ HN2 1.00800 ; Nucleic acid ring nitrogen proton
+ HN3 1.00800 ; Nucleic acid aromatic carbon proton
+ HN4 1.00800 ; Nucleic acid phosphate hydroxyl proton
+ HN5 1.00800 ; Nucleic acid ribose hydroxyl proton
+ HN6 1.00800 ; Nucleic acid ribose aliphatic proton
+ HN7 1.00800 ; Nucleic acid proton (equivalent to protein HA)
+ HN8 1.00800 ; Bound to CN8 in nucleic acids/model compounds
+ HN9 1.00800 ; Bound to CN9 in nucleic acids/model compounds
+ HOL 1.00800 ; Nucleic acid phosphate hydroxyl proton
+ HP 1.00800 ; aromatic H
+ HR1 1.00800 ; his he1, (+) his HG,HD2
+ HR2 1.00800 ; (+) his HE1
+ HR3 1.00800 ; neutral his HG, HD2
+ HS 1.00800 ; thiol hydrogen
+ HT 1.00800 ; TIPS3P WATER HYDROGEN
+ HX 1.00800 ; hydroxide hydrogen
+ IGR1 126.90447 ; IODB, iodobenzene
+ LIT 6.94100 ; Lithium ion
+ MG 24.30500 ; Magnesium Ion
+ N 14.00700 ; proline N
+ NC2 14.00700 ; guanidinium nitrogen
+ NC2D1 14.00700 ; peptide, NMA, IPAA nitrogen (C=NHR)
+ NG1T1 14.00700 ; N for cyano group
+ NG2D1 14.00700 ; N for neutral imine/Schiff's base (C=N-R, acyclic amidine, gunaidine)
+ NG2O1 14.00700 ; NITB, nitrobenzene
+ NG2P1 14.00700 ; N for protonated imine/Schiff's base (C=N(+)H-R, acyclic amidinium, guanidinium)
+NG2R43 14.00700 ; amide in 4-memebered ring (planar), AZDO, lsk
+NG2R50 14.00700 ; double bound neutral 5-mem planar ring, purine N7
+NG2R51 14.00700 ; single bound neutral 5-mem planar (all atom types sp2) ring, his, trp pyrrole (fused)
+NG2R52 14.00700 ; protonated schiff base, amidinium, guanidinium in 5-membered ring, HIS, 2HPP, kevo
+NG2R53 14.00700 ; amide in 5-memebered NON-SP2 ring (slightly pyramidized), 2PDO, kevo
+NG2R57 14.00700 ; 5-mem ring, bipyrroles
+NG2R60 14.00700 ; double bound neutral 6-mem planar ring, pyr1, pyzn
+NG2R61 14.00700 ; single bound neutral 6-mem planar ring imino nitrogen; glycosyl linkage
+NG2R62 14.00700 ; double bound 6-mem planar ring with heteroatoms in o or m, pyrd, pyrm
+NG2R67 14.00700 ; 6-mem planar ring substituted with 6-mem planar ring (N-phenyl pyridinones etc.)
+NG2RC0 14.00700 ; 6/5-mem ring bridging N, indolizine, INDZ, kevo
+ NG2S0 14.00700 ; N,N-disubstituted amide, proline N (CO=NRR')
+ NG2S1 14.00700 ; peptide nitrogen (CO=NHR)
+ NG2S2 14.00700 ; terminal amide nitrogen (CO=NH2)
+ NG2S3 14.00700 ; external amine ring nitrogen (planar/aniline), phosphoramidate
+ NG301 14.00700 ; neutral trimethylamine nitrogen
+ NG311 14.00700 ; neutral dimethylamine nitrogen
+ NG321 14.00700 ; neutral methylamine nitrogen
+ NG331 14.00700 ; neutral ammonia nitrogen
+NG3C51 14.00700 ; secondary sp3 amine in 5-membered ring
+ NG3N1 14.00700 ; N in hydrazine, HDZN
+ NG3P0 14.00700 ; quarternary N+, choline
+ NG3P1 14.00700 ; tertiary NH+ (PIP)
+ NG3P2 14.00700 ; secondary NH2+ (proline)
+ NG3P3 14.00700 ; primary NH3+, phosphatidylethanolamine
+ NH1 14.00700 ; peptide nitrogen
+ NH2 14.00700 ; amide nitrogen
+ NH3 14.00700 ; ammonium nitrogen
+ NH3L 14.00700 ; nitrogen phosphatidylethanolamine
+ NN1 14.00700 ; Nucleic acid amide nitrogen
+ NN2 14.00700 ; Nucleic acid protonated ring nitrogen
+ NN2B 14.00700 ; From NN2, for N9 in GUA different from ADE
+ NN2G 14.00700 ; Nucleic acid protonated ring nitrogen, gua N1
+ NN2U 14.00700 ; Nucleic acid protonated ring nitrogen, ura N3
+ NN3 14.00700 ; Nucleic acid unprotonated ring nitrogen
+ NN3A 14.00700 ; Nucleic acid unprotonated ring nitrogen, ade N1 and N3
+ NN3G 14.00700 ; Nucleic acid unprotonated ring nitrogen, gua N3
+ NN4 14.00700 ; Nucleic acid purine N7
+ NN6 14.00700 ; Nucleic acid sp3 amine nitrogen (equiv to protein nh3)
+ NP 14.00700 ; Proline ring NH2+ (N-terminal)
+ NPH 14.00700 ; heme pyrrole N
+ NR1 14.00700 ; neutral his protonated ring nitrogen
+ NR2 14.00700 ; neutral his unprotonated ring nitrogen
+ NR3 14.00700 ; charged his ring nitrogen
+ NTL 14.00700 ; ammonium nitrogen
+ NY 14.00700 ; TRP N in pyrrole ring
+ O 15.99900 ; carbonyl oxygen
+ O2L 15.99940 ; Nucleic acid =O in phosphate or sulfate
+ OB 15.99900 ; carbonyl oxygen in acetic acid
+ OBL 15.99940 ; acetic acid carboxyl oxygen (e. to protein OB)
+ OC 15.99900 ; carboxylate oxygen
+ OC2D1 15.99940 ; sp2 oxygen in amides, aldoses
+ OC2D2 15.99940 ; sp2 oxygen in carboxylates
+ OC2D3 15.99940 ; sp2 oxygen in acetone, ketoses
+ OC2D4 15.99940 ; par22 O
+ OC2DP 15.99940 ; =0 in P03H (phosphate) || O2L in top_all27_lipid.rtf
+ OC301 15.99940 ; generic linear ether
+ OC302 15.99940 ; linear ether in 1-1 glycosidic linkage
+ OC303 15.99940 ; from OC301; linear ether in P1->F3 pyranose-furanose glycosidic linkage
+OC305A 15.99940 ; Ether Oxygen in THF
+ OC30A 15.99940 ; Ether Oxygen
+ OC30P 15.99940 ; ester O in PO3H (phosphate) || OSL in top_all27_lipid.rtf
+ OC311 15.99940 ; hydroxyl oxygen
+OC311M 15.99940 ; MEOH, ETOH, PRO2, EGLY hydroxyl O
+ OC312 15.99940 ; OH in PO3H (phosphate) || OHL in top_all27_lipid.rtf
+OC3C51 15.99940 ; furan ring oxygen
+OC3C5M 15.99940 ; thf ring oxygen
+OC3C61 15.99940 ; ether in six membered ring
+ OCL 15.99940 ; acetate oxygen
+ OG2D1 15.99940 ; carbonyl O: amides, esters, [neutral] carboxylic acids, aldehydes, uera
+ OG2D2 15.99940 ; carbonyl O: negative groups: carboxylates, carbonate
+ OG2D3 15.99940 ; carbonyl O: ketones
+ OG2D4 15.99940 ; 6-mem aromatic carbonyl oxygen (nucleic bases)
+ OG2D5 15.99940 ; CO2 oxygen
+ OG2N1 15.99940 ; NITB, nitrobenzene
+ OG2P1 15.99940 ; =O in phosphate or sulfate
+OG2R50 15.99940 ; FURA, furan
+ OG301 15.99940 ; ether -O- O !SHOULD WE HAVE A SEPARATE ENOL ETHER??? IF YES, SHOULD WE MERGE IT WITH OG3R60???
+ OG302 15.99940 ; ester -O-
+ OG303 15.99940 ; phosphate/sulfate ester oxygen
+ OG304 15.99940 ; linkage oxygen in pyrophosphate/pyrosulphate
+ OG311 15.99940 ; hydroxyl oxygen
+ OG312 15.99940 ; ionized alcohol oxygen
+OG3C31 15.99940 ; epoxide oxygen, 1EOX, 1BOX, sc
+OG3C51 15.99940 ; 5-mem furanose ring oxygen (ether)
+OG3C61 15.99940 ; DIOX, dioxane, ether in 6-membered ring O !SHOULD WE MERGE THIS WITH OG3R60???
+OG3R60 15.99940 ; O in 6-mem cyclic enol ether (PY01, PY02) or ester
+ OH1 15.99900 ; hydroxyl oxygen
+ OHL 15.99940 ; Nucleic acid phosphate hydroxyl oxygen
+ OM 15.99900 ; heme CO/O2 oxygen
+ ON1 15.99940 ; Nucleic acid carbonyl oxygen
+ ON1C 15.99940 ; Nucleic acid carbonyl oxygen, cyt O2
+ ON2 15.99940 ; Nucleic acid phosphate ester oxygen
+ ON3 15.99940 ; Nucleic acid =O in phosphate
+ ON4 15.99940 ; Nucleic acid phosphate hydroxyl oxygen
+ ON5 15.99940 ; Nucleic acid ribose hydroxyl oxygen
+ ON6 15.99940 ; Nucleic acid deoxyribose ring oxygen
+ ON6B 15.99940 ; Nucleic acid ribose ring oxygen
+ OS 15.99940 ; ester oxygen
+ OSL 15.99940 ; ester oxygen
+ OSLP 15.99940 ; Phosphate oxygen, to avoid conflict with methylacetate type O
+ OST 15.99900 ; CO2 oxygen
+ OT 15.99940 ; TIPS3P WATER OXYGEN
+ OX 15.99940 ; hydroxide oxygen
+ P 30.97400 ; phosphorus
+ P2 30.97400 ; phosphorus, adm, 2011 DNA update
+ PC 30.97400 ; phosphorus || PL in top_all27_lipid.rtf
+ PG0 30.97380 ; neutral phosphate
+ PG1 30.97380 ; phosphate -1
+ PG2 30.97380 ; phosphate -2
+ PL 30.97400 ; phosphorus
+ POT 39.09830 ; Potassium Ion
+ RUB 85.46780 ; Rubidium Ion
+ S 32.06000 ; sulphur
+ SC 32.06000 ; Sulfate sulfur
+ SG2D1 32.06000 ; thiocarbonyl S
+SG2R50 32.06000 ; THIP, thiophene
+ SG301 32.06000 ; sulfur C-S-S-C type
+ SG302 32.06000 ; thiolate sulfur (-1)
+ SG311 32.06000 ; sulphur, SH, -S-
+ SG3O1 32.06000 ; sulfate -1 sulfur
+ SG3O2 32.06000 ; neutral sulfone/sulfonamide sulfur
+ SG3O3 32.06000 ; neutral sulfoxide sulfur
+ SL 32.06000 ; Sulfate sulfur
+ SM 32.06000 ; sulfur C-S-S-C type
+ SOD 22.98977 ; Sodium Ion
+ SS 32.06000 ; thiolate sulfur
+ ZN 65.37000 ; zinc (II) cation
+ MGA 24.30500 ; Updated Mg2+
+ HT0 1.00800 ; TIP3P WATER HYDROGEN
+ OWT4 15.99940 ; TIP4P
+ HWT4 1.00800 ; TIP4P
+ MWT4 0.00000 ; TIP4P
+ MNH3 0.00000 ; vsite (rigid tetrahedrical NH3 group)
+ MNH2 0.00000 ; vsite
+ MCH3 0.00000 ; vsite (rigid CH3 group)
+ MCH3S 0.00000 ; vsite
+ MW 0.00000 ; vsite
+ ON2B 15.99940 ; for phospho residues
+ SP 32.06000 ; for S-adenosyl methionine
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/cmap.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/cmap.itp
new file mode 100644
index 0000000000000000000000000000000000000000..6fde62afa28d2cfdd7d28edc7191a0b9f8c28790
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/cmap.itp
@@ -0,0 +1,365 @@
+; This force field generated by charmm2gmx.py from
+; multiple charmm parameter files
+; and multiple charmm topology files
+[ cmaptypes ]
+
+C NH1 CT1 C NH1 1 24 24\
+0.53048936 3.21624080 4.06375184 5.23405848 8.87430584 11.38227912 8.74221696 7.48848136 3.26716008 -2.88057522\
+4.18872792 -9.20697568 -20.19897128 -20.17293425 -20.55692503 -15.02518750 -11.57481006 -11.64909280 -10.27000038 -9.81981034\
+-9.77110440 -6.37079270 -3.98125173 -0.15334360 -0.53192447 5.76174456 6.59825168 7.83366136 10.03737416 10.40405992\
+10.19537874 8.07122888 4.54573190 2.69198560 1.08230038 -11.71704096 -16.77565177 -17.30212030 -14.30965656 -10.88735376\
+-9.61955155 -6.28119234 -4.60984752 -3.60423986 -2.67846291 -0.86902098 -4.50342330 -4.69457352 0.35174470 5.94260633\
+6.79628040 8.56548480 11.10395944 11.36545944 9.71280454 8.30713954 6.51643774 10.30641791 -0.94441248 -7.59766702\
+-10.80834310 -12.57774834 -10.67754708 -7.91061767 -5.66603556 -3.04278471 0.28665421 -0.94146694 -3.20276414 -5.36992970\
+-5.41085758 -3.41541175 3.88271853 6.36541208 9.38144011 10.65374012 13.01803066 12.21062744 10.29604159 9.15446648\
+8.61198578 7.74993115 0.48507204 -4.95342505 -8.34908414 -9.53252854 -8.19702502 -5.60851393 -3.90345862 0.09116936\
+1.31262540 -2.16462587 -4.82369594 -4.11406444 -2.37031131 -1.85169196 5.67964611 8.19712544 11.29217250 12.71039369\
+15.47644864 14.88856735 11.04281446 11.60580095 11.37907418 6.81153945 2.95251073 -3.28710521 -8.86283331 -10.99759798\
+-7.54422479 -1.78225430 -0.26074688 1.83694336 3.81142317 -2.28862290 -4.05060571 -3.58481354 -1.04648534 1.87990886\
+8.55630510 10.64587002 11.79063752 12.92262709 14.10267408 14.85976051 12.85960768 12.14947410 12.37055666 8.88999166\
+3.79274161 -3.44605955 -8.74798670 -9.37876654 -6.09409642 0.86257344 0.34390388 3.22883464 4.35236834 -0.52152305\
+-1.32444520 -0.68756927 1.31575922 3.06999745 6.07405924 11.49964450 11.45656604 13.20803446 14.43491715 13.99195289\
+13.30595680 16.31226122 13.95376552 10.21138254 3.81861546 -2.53760437 -6.32525405 -6.78169498 -4.02834683 -0.08641215\
+1.73700015 3.80011800 1.92226767 0.61048744 -0.29728994 0.07373045 1.17503038 3.13307543 5.76622144 13.99948827\
+9.84254202 12.81786391 15.95806888 15.48413046 14.98001704 17.62423391 14.79640220 7.08689686 0.39819965 -2.85537917\
+-0.51720098 -1.78976876 -2.50357171 0.94705677 1.77112067 1.26356382 2.30910776 0.80215230 -1.06099964 -0.79725283\
+-1.06027581 1.96196965 0.99476274 5.14623632 7.18376064 13.25729688 17.60706696 18.37554224 17.89111872 15.36827969\
+9.50728228 -2.01998918 -1.70161188 -0.16283710 -1.49619840 -3.44485874 -0.72444286 0.58494830 1.12045846 1.34900528\
+1.29563418 -2.78821342 -3.96907210 -6.41978316 -6.19218611 -0.85464058 -4.95735801 0.32660304 9.82156344 17.62028840\
+22.49318400 22.55150896 18.32675680 10.29894110 4.70161519 0.44775494 0.03168962 -0.62526951 -3.33561032 -2.43596664\
+0.34689544 1.13629072 -0.19066488 1.58753512 1.03666968 -3.72775990 -6.62088712 -8.17776189 -8.28835756 -8.36981167\
+-4.91502848 4.46445352 17.49104464 28.20689624 25.40010168 20.11027048 11.64549456 5.52625230 3.20485195 -0.03534643\
+1.15838224 -2.95867376 5.49928224 6.37051656 8.01466120 9.30308216 0.81290936 2.23425600 1.38816752 -6.67409505\
+-11.92080594 -14.85514556 -13.71251190 -11.10908484 1.22838056 23.38048488 15.61728208 13.46252208 13.69193080 10.53246688\
+6.64712080 5.78128384 3.58321944 2.74123128 6.76540248 3.54351328 2.13831688 3.09933984 4.27194768 6.76377072\
+-1.43260160 0.76052568 -2.56864128 -10.70282681 -15.84413438 -15.92984780 -13.20196766 -7.31866954 11.85038504 3.29695016\
+1.35260352 2.00509832 2.63006240 4.08496472 5.18293000 6.99543880 6.88468832 10.54510256 6.72356248 3.24824840\
+0.50115952 0.29451176 0.50697528 -6.56565832 -5.07523384 -7.72517024 -11.48302984 -15.86794552 -16.46353792 -15.12905112\
+-11.19533800 -3.86672728 -3.25657456 -8.00265312 -8.58615376 -7.72483552 -4.38244712 0.76734560 7.04146280 9.30312400\
+5.68342008 10.24519344 6.01207328 2.83913688 -0.99185904 -2.23977888 -3.30694992 -9.13191472 -13.60276976 -17.55234024\
+-17.86262568 -16.35195064 -14.45831408 -11.60629048 7.34446808 1.31130744 -12.40058104 -14.57592632 -14.40052886 -10.04306022\
+-4.70734727 1.40666080 5.97663480 5.83513192 4.06002808 10.30402048 6.36984712 2.31634608 -1.70447792 -6.20466280\
+-15.12064128 -17.40464504 -19.70547266 -18.81239786 -15.75083536 -12.38104176 -8.21674840 -4.48215184 -6.69264272 -10.23121888\
+-16.82593926 -16.05212102 -14.08052817 -9.76703337 -4.12008940 1.51460800 3.40736592 3.15519624 2.10191608 7.96390928\
+3.22260048 -1.74230128 -13.74992104 -16.21412968 -19.29472520 -22.12489577 -21.53186398 -16.89761537 -11.98904280 -9.90842328\
+-11.96829016 -14.29488704 -15.34059416 -15.04238793 -14.03180967 -12.48679654 -9.69605181 -5.18875831 -1.07901176 3.02340024\
+2.79520488 1.83313592 10.02206072 6.83025448 -8.54142680 -13.46453040 -16.38069472 -19.11491362 -21.32491078 -23.12477972\
+-20.94222541 -15.80664574 -11.88539675 -14.68090288 -15.71690312 -15.23314904 -14.44251948 -13.98631704 -9.40869887 -6.86627872\
+-4.22827927 0.16592070 2.66128759 3.44640264 2.16371376 -0.05489408 -1.55188744 -4.99071286 -9.64683960 -14.31170672\
+-18.76507264 -23.41883961 -23.43568858 -23.96485998 -19.83435660 -15.98027755 -15.41866760 -17.36929024 -17.45037198 -15.58786438\
+-15.63448669 -10.96489583 -7.19999456 -4.92804072 -1.79255112 1.16202232 3.38025360 3.36083984 2.01882184 -1.40958960\
+-3.28975368 -7.42270888 -11.68683248 -16.01869504 -21.80617120 -26.33546835 -27.68645266 -24.11637935 -21.22541108 -16.36550680\
+-17.39835230 -18.71675999 -17.15157580 -15.77293525 -13.21014320 -11.09468770 -7.74307776 -4.57068528 -1.86196368 0.53760216\
+4.20709568 3.70208688 2.03279640 -0.91407848 -3.58849128 -7.03886872 -12.61224960 -18.74896424 -25.32788584 -28.72483360\
+-28.74880792 -23.96695616 -16.36877032 -20.09202824 -21.06493376 -19.73170216 -19.24871794 -17.09884066 -13.70105192 -10.08737296\
+-8.23925832 -4.67206360 -2.26040600 -0.62898072 3.19456768 4.34671576 3.17348032 1.31180952 -1.39348120 -7.83566968\
+-14.08447368 -20.95455984 -25.62620504 -29.43372872 -28.13455488 -15.48163680 -18.87243408 -21.69675960 -22.43301808 -20.28189816\
+-18.59503488 -16.75382384 -14.29137248 -11.51114632 -8.83347000 -4.89092864 -1.35055336 -0.02895328 1.32490544 4.54495368\
+3.92948728 2.61642256 -0.69605024 -7.65801704 -14.51626248 -20.69418952 -25.57495104 -8.01478672 -16.93394504 -20.90636016\
+-20.90631832 -20.26181496 -20.44561808 -17.99345936 -18.80549008 -18.58620664 -17.42037688 -13.31980584 -7.35375656 -1.68874608\
+0.10008128 1.51623976 2.65483168 5.29242528 5.69593024 3.96818928 -0.30827712 -6.20721504 -13.19139888 7.67814208\
+-7.37580624 -21.31187344 -24.03636872 -22.55205288 -20.01596312 -17.53359592 -17.21891728 -16.91289952 -17.26138488 -16.85545320\
+-16.84520240 -12.29221544 -3.39150856 -0.29915600 1.58527576 2.27320904 5.34664992 6.86724104 7.10794656 6.35947080\
+2.64407880 -4.55499528 -11.44964152 -3.07624416 -19.09506472 -26.81253640 -24.64145880 -21.51308200 -17.55175448 -15.34059416\
+-16.08099480 -14.87412000 -14.84785285 -13.58542708 -11.51139318 -7.59131571
+
+C NH1 CT1 C N 1 24 24\
+0.53048936 3.21624080 4.06375184 5.23405848 8.87430584 11.38227912 8.74221696 7.48848136 3.26716008 -2.88057522\
+4.18872792 -9.20697568 -20.19897128 -20.17293425 -20.55692503 -15.02518750 -11.57481006 -11.64909280 -10.27000038 -9.81981034\
+-9.77110440 -6.37079270 -3.98125173 -0.15334360 -0.53192447 5.76174456 6.59825168 7.83366136 10.03737416 10.40405992\
+10.19537874 8.07122888 4.54573190 2.69198560 1.08230038 -11.71704096 -16.77565177 -17.30212030 -14.30965656 -10.88735376\
+-9.61955155 -6.28119234 -4.60984752 -3.60423986 -2.67846291 -0.86902098 -4.50342330 -4.69457352 0.35174470 5.94260633\
+6.79628040 8.56548480 11.10395944 11.36545944 9.71280454 8.30713954 6.51643774 10.30641791 -0.94441248 -7.59766702\
+-10.80834310 -12.57774834 -10.67754708 -7.91061767 -5.66603556 -3.04278471 0.28665421 -0.94146694 -3.20276414 -5.36992970\
+-5.41085758 -3.41541175 3.88271853 6.36541208 9.38144011 10.65374012 13.01803066 12.21062744 10.29604159 9.15446648\
+8.61198578 7.74993115 0.48507204 -4.95342505 -8.34908414 -9.53252854 -8.19702502 -5.60851393 -3.90345862 0.09116936\
+1.31262540 -2.16462587 -4.82369594 -4.11406444 -2.37031131 -1.85169196 5.67964611 8.19712544 11.29217250 12.71039369\
+15.47644864 14.88856735 11.04281446 11.60580095 11.37907418 6.81153945 2.95251073 -3.28710521 -8.86283331 -10.99759798\
+-7.54422479 -1.78225430 -0.26074688 1.83694336 3.81142317 -2.28862290 -4.05060571 -3.58481354 -1.04648534 1.87990886\
+8.55630510 10.64587002 11.79063752 12.92262709 14.10267408 14.85976051 12.85960768 12.14947410 12.37055666 8.88999166\
+3.79274161 -3.44605955 -8.74798670 -9.37876654 -6.09409642 0.86257344 0.34390388 3.22883464 4.35236834 -0.52152305\
+-1.32444520 -0.68756927 1.31575922 3.06999745 6.07405924 11.49964450 11.45656604 13.20803446 14.43491715 13.99195289\
+13.30595680 16.31226122 13.95376552 10.21138254 3.81861546 -2.53760437 -6.32525405 -6.78169498 -4.02834683 -0.08641215\
+1.73700015 3.80011800 1.92226767 0.61048744 -0.29728994 0.07373045 1.17503038 3.13307543 5.76622144 13.99948827\
+9.84254202 12.81786391 15.95806888 15.48413046 14.98001704 17.62423391 14.79640220 7.08689686 0.39819965 -2.85537917\
+-0.51720098 -1.78976876 -2.50357171 0.94705677 1.77112067 1.26356382 2.30910776 0.80215230 -1.06099964 -0.79725283\
+-1.06027581 1.96196965 0.99476274 5.14623632 7.18376064 13.25729688 17.60706696 18.37554224 17.89111872 15.36827969\
+9.50728228 -2.01998918 -1.70161188 -0.16283710 -1.49619840 -3.44485874 -0.72444286 0.58494830 1.12045846 1.34900528\
+1.29563418 -2.78821342 -3.96907210 -6.41978316 -6.19218611 -0.85464058 -4.95735801 0.32660304 9.82156344 17.62028840\
+22.49318400 22.55150896 18.32675680 10.29894110 4.70161519 0.44775494 0.03168962 -0.62526951 -3.33561032 -2.43596664\
+0.34689544 1.13629072 -0.19066488 1.58753512 1.03666968 -3.72775990 -6.62088712 -8.17776189 -8.28835756 -8.36981167\
+-4.91502848 4.46445352 17.49104464 28.20689624 25.40010168 20.11027048 11.64549456 5.52625230 3.20485195 -0.03534643\
+1.15838224 -2.95867376 5.49928224 6.37051656 8.01466120 9.30308216 0.81290936 2.23425600 1.38816752 -6.67409505\
+-11.92080594 -14.85514556 -13.71251190 -11.10908484 1.22838056 23.38048488 15.61728208 13.46252208 13.69193080 10.53246688\
+6.64712080 5.78128384 3.58321944 2.74123128 6.76540248 3.54351328 2.13831688 3.09933984 4.27194768 6.76377072\
+-1.43260160 0.76052568 -2.56864128 -10.70282681 -15.84413438 -15.92984780 -13.20196766 -7.31866954 11.85038504 3.29695016\
+1.35260352 2.00509832 2.63006240 4.08496472 5.18293000 6.99543880 6.88468832 10.54510256 6.72356248 3.24824840\
+0.50115952 0.29451176 0.50697528 -6.56565832 -5.07523384 -7.72517024 -11.48302984 -15.86794552 -16.46353792 -15.12905112\
+-11.19533800 -3.86672728 -3.25657456 -8.00265312 -8.58615376 -7.72483552 -4.38244712 0.76734560 7.04146280 9.30312400\
+5.68342008 10.24519344 6.01207328 2.83913688 -0.99185904 -2.23977888 -3.30694992 -9.13191472 -13.60276976 -17.55234024\
+-17.86262568 -16.35195064 -14.45831408 -11.60629048 7.34446808 1.31130744 -12.40058104 -14.57592632 -14.40052886 -10.04306022\
+-4.70734727 1.40666080 5.97663480 5.83513192 4.06002808 10.30402048 6.36984712 2.31634608 -1.70447792 -6.20466280\
+-15.12064128 -17.40464504 -19.70547266 -18.81239786 -15.75083536 -12.38104176 -8.21674840 -4.48215184 -6.69264272 -10.23121888\
+-16.82593926 -16.05212102 -14.08052817 -9.76703337 -4.12008940 1.51460800 3.40736592 3.15519624 2.10191608 7.96390928\
+3.22260048 -1.74230128 -13.74992104 -16.21412968 -19.29472520 -22.12489577 -21.53186398 -16.89761537 -11.98904280 -9.90842328\
+-11.96829016 -14.29488704 -15.34059416 -15.04238793 -14.03180967 -12.48679654 -9.69605181 -5.18875831 -1.07901176 3.02340024\
+2.79520488 1.83313592 10.02206072 6.83025448 -8.54142680 -13.46453040 -16.38069472 -19.11491362 -21.32491078 -23.12477972\
+-20.94222541 -15.80664574 -11.88539675 -14.68090288 -15.71690312 -15.23314904 -14.44251948 -13.98631704 -9.40869887 -6.86627872\
+-4.22827927 0.16592070 2.66128759 3.44640264 2.16371376 -0.05489408 -1.55188744 -4.99071286 -9.64683960 -14.31170672\
+-18.76507264 -23.41883961 -23.43568858 -23.96485998 -19.83435660 -15.98027755 -15.41866760 -17.36929024 -17.45037198 -15.58786438\
+-15.63448669 -10.96489583 -7.19999456 -4.92804072 -1.79255112 1.16202232 3.38025360 3.36083984 2.01882184 -1.40958960\
+-3.28975368 -7.42270888 -11.68683248 -16.01869504 -21.80617120 -26.33546835 -27.68645266 -24.11637935 -21.22541108 -16.36550680\
+-17.39835230 -18.71675999 -17.15157580 -15.77293525 -13.21014320 -11.09468770 -7.74307776 -4.57068528 -1.86196368 0.53760216\
+4.20709568 3.70208688 2.03279640 -0.91407848 -3.58849128 -7.03886872 -12.61224960 -18.74896424 -25.32788584 -28.72483360\
+-28.74880792 -23.96695616 -16.36877032 -20.09202824 -21.06493376 -19.73170216 -19.24871794 -17.09884066 -13.70105192 -10.08737296\
+-8.23925832 -4.67206360 -2.26040600 -0.62898072 3.19456768 4.34671576 3.17348032 1.31180952 -1.39348120 -7.83566968\
+-14.08447368 -20.95455984 -25.62620504 -29.43372872 -28.13455488 -15.48163680 -18.87243408 -21.69675960 -22.43301808 -20.28189816\
+-18.59503488 -16.75382384 -14.29137248 -11.51114632 -8.83347000 -4.89092864 -1.35055336 -0.02895328 1.32490544 4.54495368\
+3.92948728 2.61642256 -0.69605024 -7.65801704 -14.51626248 -20.69418952 -25.57495104 -8.01478672 -16.93394504 -20.90636016\
+-20.90631832 -20.26181496 -20.44561808 -17.99345936 -18.80549008 -18.58620664 -17.42037688 -13.31980584 -7.35375656 -1.68874608\
+0.10008128 1.51623976 2.65483168 5.29242528 5.69593024 3.96818928 -0.30827712 -6.20721504 -13.19139888 7.67814208\
+-7.37580624 -21.31187344 -24.03636872 -22.55205288 -20.01596312 -17.53359592 -17.21891728 -16.91289952 -17.26138488 -16.85545320\
+-16.84520240 -12.29221544 -3.39150856 -0.29915600 1.58527576 2.27320904 5.34664992 6.86724104 7.10794656 6.35947080\
+2.64407880 -4.55499528 -11.44964152 -3.07624416 -19.09506472 -26.81253640 -24.64145880 -21.51308200 -17.55175448 -15.34059416\
+-16.08099480 -14.87412000 -14.84785285 -13.58542708 -11.51139318 -7.59131571
+
+C N CP1 C NH1 1 24 24\
+12.44112400 14.00886880 12.81517360 8.84246560 4.35345200 3.22419040 3.28527680 1.10164720 -2.00413600 -2.43927200\
+-1.94053920 -1.22423840 0.00000000 1.08407440 0.74098640 -0.63262080 -0.72592400 0.88575280 1.45979760 -0.56735040\
+-3.97480000 -5.25761440 -1.22507520 6.52704000 23.74043440 25.15169760 23.27433680 18.69118320 14.18710720 12.58881920\
+11.91854240 9.67006080 6.95129760 6.14378560 4.78105680 6.01408160 8.84162880 11.71310800 12.50639440 12.00389600\
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+-11.48800880 -8.40649280 -5.69316880 -3.90492720 -2.22421440 -0.30668720 0.14602160 -1.87526880 -4.92540480 -7.23999360\
+-9.40521360 -12.12732400 -12.26790640 -8.90229680 -3.12210080 2.03886320 -0.87780320 -4.77143360 -9.42320480 -14.07790480\
+-17.19205600 -17.85814880 -11.94322800 -9.92946880 -7.28434400 -4.34550240 -1.83928640 -0.56944240 -0.40752160 0.00000000\
+-0.09497680 -1.78405760 -3.89446720 -6.61992480 -10.25205520 -12.00556960 -10.70601920 -6.15299040 -0.18953520 1.20541040\
+-1.99367600 -5.20029360 -8.59519120 -11.65369520 -13.38670800 -13.30972240 -9.39893760 -7.69897840 -5.17937360 -2.21668320\
+0.41128720 2.06689600 2.44471120 2.31584400 2.07526400 0.44768800 -3.01164320 -7.72826640 -11.16542240 -12.05912480\
+-9.61985280 -3.84216720 3.07105600 0.60542480 -1.79535440 -4.10283040 -6.60109680 -8.93535040 -10.34996080 -10.40560800\
+-7.48433920 -5.87559120 -3.44636080 -0.64391760 1.87526880 3.68945120 4.74298240 5.21033520 4.59445040 1.29160080\
+-4.01789520 -8.94497360 -11.91812400 -12.06330880 -8.27386000 4.08483920 2.65516640 1.34431920 -0.06317840 -1.67778400\
+-3.75095600 -6.05801360 -7.78516880 -8.22365200 -5.05803760 -3.44426880 -1.32005200 1.02926400 3.20201520 4.99527760\
+6.36511920 6.98016720 5.53124800 1.16984640 -4.45888880 -9.20103440 -11.83820960 -11.09262080 3.94760400 2.80453520\
+3.55681840 3.67899120 3.08611840 1.90120960 -0.47028160 -3.42042000 -5.51953280 -5.98060960 -2.23174560 -0.87445600\
+0.63011040 2.35224480 4.16559040 6.00487680 7.66969040 8.30440320 6.34712800 1.70665360 -3.91036640 -8.52113440\
+12.38254800 3.08988400 0.27488880 2.57357840 5.44840480 6.77013040 6.86594400 4.88691200 1.52841520 -1.58908320\
+-3.36644640 -3.37816160 0.08326160 0.76483520 1.45770560 2.60997920 4.29864160 6.40068320 8.47845760 9.22906720\
+7.16761040 2.48571440 -3.05473840 15.49753600 3.50535520 -2.94344400 -1.56356080 2.88068400 7.04543760 9.15542880\
+8.56130080 5.82580160 2.59742720 0.05941280 -1.12842480 -0.85269920
+
+C NH1 CT2 C N 1 24 24\
+0.98470440 0.76274320 0.74140480 1.66021120 3.59572960 6.23290480 8.75502000 9.61357680 7.56718240 2.91290080\
+-2.35684720 -5.99441680 -4.24717840 5.96763920 -2.36103120 2.91290080 7.56550880 9.63031280 8.75543840 6.23039440\
+3.59614800 1.66062960 0.74014960 0.76316160 0.08409840 -0.85269920 -1.12842480 0.05941280 2.59742720 5.82580160\
+8.56130080 9.15542880 7.04543760 2.88068400 -1.56356080 -2.94344400 3.50535520 15.49753600 -3.05473840 2.48571440\
+7.16761040 9.22906720 8.47845760 6.40068320 4.29864160 2.60997920 1.45770560 0.76483520 -2.23258240 -3.37816160\
+-3.36644640 -1.58908320 1.52841520 4.88691200 6.86594400 6.77013040 5.44840480 2.57357840 0.27488880 3.08988400\
+12.38254800 -8.52113440 -3.91036640 1.70665360 6.34712800 8.30440320 7.66969040 6.00487680 4.16559040 2.35224480\
+0.63011040 -0.87445600 -5.05636400 -5.98060960 -5.51953280 -3.42042000 -0.47028160 1.90120960 3.08611840 3.67899120\
+3.55681840 2.80453520 3.94760400 -11.09262080 -11.83820960 -9.20103440 -4.45888880 1.16984640 5.53124800 6.98016720\
+6.36511920 4.99527760 3.20201520 1.02926400 -1.32005200 -3.44426880 -7.48559440 -8.22365200 -7.78516880 -6.05801360\
+-3.75095600 -1.67778400 -0.06317840 1.34431920 2.65516640 4.08483920 -8.27386000 -12.06330880 -11.91812400 -8.94497360\
+-4.01789520 1.29160080 4.59445040 5.21033520 4.74298240 3.68945120 1.87526880 -0.64391760 -3.44636080 -5.87559120\
+-9.40019280 -10.40560800 -10.34996080 -8.93535040 -6.60109680 -4.10283040 -1.79535440 0.60542480 3.07105600 -3.84216720\
+-9.61985280 -12.05912480 -11.16542240 -7.72826640 -3.01164320 0.44768800 2.07526400 2.31584400 2.44471120 2.06689600\
+0.41128720 -2.21668320 -5.17937360 -7.69897840 -11.92900240 -13.30972240 -13.38670800 -11.65369520 -8.59519120 -5.20029360\
+-1.99367600 1.20541040 -0.18953520 -6.15299040 -10.70601920 -12.00556960 -10.25205520 -6.61992480 -3.89446720 -1.78405760\
+-0.09497680 0.00000000 -0.40752160 -0.56944240 -1.83928640 -4.34550240 -7.28434400 -9.92946880 -16.57617120 -17.85814880\
+-17.19205600 -14.07790480 -9.42320480 -4.77143360 -0.87780320 2.03886320 -3.12210080 -8.90229680 -12.26790640 -12.12732400\
+-9.40521360 -7.23999360 -4.92540480 -1.87526880 0.14602160 -0.30668720 -2.22421440 -3.90492720 -5.69316880 -8.40649280\
+-11.48800880 -14.32978160 -22.62707200 -22.40573840 -19.41417840 -13.73690880 -7.15547680 -1.77317920 1.48280960 -0.43388080\
+-6.60109680 -11.83360720 -13.18462080 -11.08425280 -9.13367200 -7.36886080 -4.10743280 -0.73094480 1.09871840 0.16401280\
+-2.77399200 -6.40444880 -10.36878880 -14.50007040 -18.13429280 -20.96686080 -25.49394880 -22.16850560 -15.96873808 -8.04386552\
+-0.82073344 3.21414880 2.37860400 -3.47815920 -9.80687760 -12.70722640 -11.14492080 -9.16756240 -8.46381360 -6.01868400\
+-2.71541600 0.32216800 1.84723600 1.07738000 -2.05476240 -7.61739040 -14.53145040 -20.48151680 -24.22828880 -25.96548560\
+-22.00041340 -15.37952628 -6.82456424 1.79947564 6.26123048 1.33134880 -2.32253840 -7.09397200 -10.18469280 -9.17383840\
+-7.07639920 -7.90776000 -7.14836400 -5.04715920 -2.37400160 0.22719120 2.08028480 2.50872640 -0.71546400 -8.94371840\
+-17.72760800 -23.36387440 -25.66925840 -25.38432800 -13.22905488 -3.77430272 5.99337080 -6.07887084 -6.53030352 -6.96887040\
+-7.46049040 -7.34333840 -5.56179120 -3.05892240 -5.51032800 -6.95715520 -6.69942080 -5.41786160 -3.41958320 -0.82466640\
+2.29910800 3.55807360 -2.88570480 -11.79846160 -18.38031200 -21.38651600 -21.78060696 -19.47562044 0.14240244 -9.83181424\
+-14.27607996 -15.14637288 -14.43877480 -12.03171960 -7.48015520 -2.26459000 1.71732280 -1.55854000 -4.71474040 -6.26951480\
+-6.73080080 -6.26951480 -4.71474040 -1.55854000 1.71732280 -2.26459000 -7.48015520 -12.03171960 -14.43877480 -15.14637288\
+-14.27607996 -9.83181424 -13.23125148 -19.47562044 -21.78060696 -21.38651600 -18.38031200 -11.79846160 -2.88570480 3.55807360\
+2.29910800 -0.82466640 -3.41958320 -5.41786160 -6.69942080 -6.95715520 -5.51032800 -3.05892240 -5.56179120 -7.34333840\
+-7.46049040 -6.96887040 -6.53030352 -6.07887084 5.99337080 -3.77430272 -22.00039248 -25.38432800 -25.66925840 -23.36387440\
+-17.72760800 -8.94371840 -0.71546400 2.50872640 2.08028480 0.22719120 -2.37400160 -5.04715920 -7.14836400 -7.90776000\
+-7.07639920 -9.17383840 -10.18469280 -7.09397200 -2.32253840 1.33134880 6.26123048 1.79947564 -6.82456424 -15.37952628\
+-25.49436720 -25.96548560 -24.22828880 -20.48151680 -14.53145040 -7.61739040 -2.05476240 1.07738000 1.84723600 0.32216800\
+-2.71541600 -6.01868400 -8.46381360 -9.16756240 -11.14492080 -12.70722640 -9.80687760 -3.47815920 2.37860400 3.21414880\
+-0.82073344 -8.04386552 -15.96873808 -22.16850560 -22.62498000 -20.96686080 -18.13429280 -14.50007040 -10.36878880 -6.40444880\
+-2.77399200 0.16401280 1.09871840 -0.73094480 -4.10743280 -7.36886080 -9.13367200 -11.08425280 -13.18462080 -11.83360720\
+-6.60109680 -0.43388080 1.48280960 -1.77317920 -7.15547680 -13.73690880 -19.41417840 -22.40573840 -16.57658960 -14.32978160\
+-11.48800880 -8.40649280 -5.69316880 -3.90492720 -2.22421440 -0.30668720 0.14602160 -1.87526880 -4.92540480 -7.23999360\
+-9.40521360 -12.12732400 -12.26790640 -8.90229680 -3.12210080 2.03886320 -0.87780320 -4.77143360 -9.42320480 -14.07790480\
+-17.19205600 -17.85814880 -11.94322800 -9.92946880 -7.28434400 -4.34550240 -1.83928640 -0.56944240 -0.40752160 0.00000000\
+-0.09497680 -1.78405760 -3.89446720 -6.61992480 -10.25205520 -12.00556960 -10.70601920 -6.15299040 -0.18953520 1.20541040\
+-1.99367600 -5.20029360 -8.59519120 -11.65369520 -13.38670800 -13.30972240 -9.39893760 -7.69897840 -5.17937360 -2.21668320\
+0.41128720 2.06689600 2.44471120 2.31584400 2.07526400 0.44768800 -3.01164320 -7.72826640 -11.16542240 -12.05912480\
+-9.61985280 -3.84216720 3.07105600 0.60542480 -1.79535440 -4.10283040 -6.60109680 -8.93535040 -10.34996080 -10.40560800\
+-7.48433920 -5.87559120 -3.44636080 -0.64391760 1.87526880 3.68945120 4.74298240 5.21033520 4.59445040 1.29160080\
+-4.01789520 -8.94497360 -11.91812400 -12.06330880 -8.27386000 4.08483920 2.65516640 1.34431920 -0.06317840 -1.67778400\
+-3.75095600 -6.05801360 -7.78516880 -8.22365200 -5.05803760 -3.44426880 -1.32005200 1.02926400 3.20201520 4.99527760\
+6.36511920 6.98016720 5.53124800 1.16984640 -4.45888880 -9.20103440 -11.83820960 -11.09262080 3.94760400 2.80453520\
+3.55681840 3.67899120 3.08611840 1.90120960 -0.47028160 -3.42042000 -5.51953280 -5.98060960 -2.23174560 -0.87445600\
+0.63011040 2.35224480 4.16559040 6.00487680 7.66969040 8.30440320 6.34712800 1.70665360 -3.91036640 -8.52113440\
+12.38254800 3.08988400 0.27488880 2.57357840 5.44840480 6.77013040 6.86594400 4.88691200 1.52841520 -1.58908320\
+-3.36644640 -3.37816160 0.08326160 0.76483520 1.45770560 2.60997920 4.29864160 6.40068320 8.47845760 9.22906720\
+7.16761040 2.48571440 -3.05473840 15.49753600 3.50535520 -2.94344400 -1.56356080 2.88068400 7.04543760 9.15542880\
+8.56130080 5.82580160 2.59742720 0.05941280 -1.12842480 -0.85269920
+
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/ffbonded.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/ffbonded.itp
new file mode 100644
index 0000000000000000000000000000000000000000..d41325fc39eadeaa9490e425b5807b9bb794acd2
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/ffbonded.itp
@@ -0,0 +1,11103 @@
+; This force field generated by charmm2gmx.py from
+; multiple charmm parameter files
+; and multiple charmm topology files
+[ bondtypes ]
+; i j func b0 kb
+ NH2 CT1 1 0.14550000 200832.00
+ CA CAI 1 0.13750000 255224.00
+ CAI CAI 1 0.13750000 255224.00
+ CPT CA 1 0.13600000 251040.00
+ CPT CAI 1 0.13600000 251040.00
+ CPT CPT 1 0.13850000 301248.00
+ CY CA 1 0.13650000 292880.00
+ CY CAI 1 0.13650000 292880.00
+ CY CPT 1 0.14300000 292880.00
+ CY CT3 1 0.14920000 313800.00
+ CY CT2 1 0.14920000 313800.00
+ HP CAI 1 0.10800000 284512.00
+ HP CY 1 0.10800000 292880.00
+ NY CA 1 0.13700000 225936.00
+ NY CPT 1 0.13700000 225936.00
+ NY H 1 0.09760000 449780.00
+ CA CA 1 0.13750000 255224.00
+ CE1 CE1 1 0.13400000 368192.00
+ CE1 CE2 1 0.13420000 418400.00
+ CE1 CT2 1 0.15020000 305432.00
+ CE1 CT3 1 0.15040000 320494.40
+ CE2 CE2 1 0.13300000 426768.00
+ CP1 C 1 0.14900000 209200.00
+ CP1 CC 1 0.14900000 209200.00
+ CP1 CD 1 0.14900000 167360.00
+ CP2 CP1 1 0.15270000 186188.00
+ CP2 CP2 1 0.15370000 186188.00
+ CP3 CP2 1 0.15370000 186188.00
+ CPH1 CPH1 1 0.13600000 343088.00
+ CT1 C 1 0.14900000 209200.00
+ CT1 CC 1 0.15220000 167360.00
+ CT1 CD 1 0.15220000 167360.00
+ CT1 CT1 1 0.15000000 186188.00
+ CT2 C 1 0.14900000 209200.00
+ CT2 CA 1 0.14900000 192464.00
+ CT2 CC 1 0.15220000 167360.00
+ CT2 CD 1 0.15220000 167360.00
+ CT2 CPH1 1 0.15000000 192154.38
+ CT2 CT1 1 0.15380000 186188.00
+ CT2 CT2 1 0.15300000 186188.00
+ CT3 C 1 0.14900000 209200.00
+ CT3 CA 1 0.14900000 192464.00
+ CT3 CC 1 0.15220000 167360.00
+ CT3 CD 1 0.15220000 167360.00
+ CT3 CPH1 1 0.15000000 192154.38
+ CT3 CS 1 0.15310000 158992.00
+ CT3 CT1 1 0.15380000 186188.00
+ CT3 CT2 1 0.15280000 186188.00
+ CT3 CT3 1 0.15300000 186188.00
+ H CD 1 0.11100000 276144.00
+ HA1 CC 1 0.11000000 265374.38
+ HA2 CP2 1 0.11110000 258571.20
+ HA2 CP3 1 0.11110000 258571.20
+ HA2 CS 1 0.11110000 251040.00
+ HA3 CS 1 0.11110000 251040.00
+ HA1 CT1 1 0.11110000 258571.20
+ HA2 CT2 1 0.11110000 258571.20
+ HA3 CT3 1 0.11110000 269449.60
+ HE1 CE1 1 0.11000000 301666.40
+ HE2 CE2 1 0.11000000 305432.00
+ HB1 CP1 1 0.10800000 276144.00
+ HB1 CT1 1 0.10800000 276144.00
+ HB2 CT2 1 0.10800000 276144.00
+ HP CA 1 0.10800000 284512.00
+ HR1 CPH1 1 0.10830000 313800.00
+ HR1 CPH2 1 0.10900000 284512.00
+ HR2 CPH2 1 0.10700000 278654.40
+ HR3 CPH1 1 0.10830000 305432.00
+ N C 1 0.13000000 217568.00
+ N CP1 1 0.14340000 267776.00
+ N CP3 1 0.14550000 267776.00
+ NC2 C 1 0.13650000 376560.00
+ NC2 CT2 1 0.14900000 326352.00
+ NC2 CT3 1 0.14900000 326352.00
+ NC2 HC 1 0.10000000 380744.00
+ NH1 C 1 0.13450000 309616.00
+ NH1 CT1 1 0.14300000 267776.00
+ NH1 CT2 1 0.14300000 267776.00
+ NH1 CT3 1 0.14300000 267776.00
+ NH1 H 1 0.09970000 368192.00
+ NH1 HC 1 0.09800000 338904.00
+ NH2 CC 1 0.13600000 359824.00
+ NH2 CT2 1 0.14550000 200832.00
+ NH2 CT3 1 0.14550000 200832.00
+ NH2 H 1 0.10000000 401664.00
+ NH2 HC 1 0.10000000 384928.00
+ NH3 CT1 1 0.14800000 167360.00
+ NH3 CT2 1 0.14800000 167360.00
+ NH3 CT3 1 0.14800000 167360.00
+ NH3 HC 1 0.10400000 337230.40
+ NP CP1 1 0.14850000 267776.00
+ NP CP3 1 0.15020000 267776.00
+ NP HC 1 0.10060000 384928.00
+ NR1 CPH1 1 0.13800000 334720.00
+ NR1 CPH2 1 0.13600000 334720.00
+ NR1 H 1 0.10000000 389948.80
+ NR2 CPH1 1 0.13800000 334720.00
+ NR2 CPH2 1 0.13200000 334720.00
+ NR3 CPH1 1 0.13700000 317984.00
+ NR3 CPH2 1 0.13200000 317984.00
+ NR3 H 1 0.10000000 379070.40
+ O C 1 0.12300000 518816.00
+ O CC 1 0.12300000 543920.00
+ OB CC 1 0.12200000 627600.00
+ OB CD 1 0.12200000 627600.00
+ OC CA 1 0.12600000 439320.00
+ OC CC 1 0.12600000 439320.00
+ OC CT2 1 0.13300000 376560.00
+ OC CT3 1 0.13300000 376560.00
+ OH1 CA 1 0.14110000 279742.24
+ OH1 CD 1 0.14000000 192464.00
+ OH1 CT1 1 0.14200000 358150.40
+ OH1 CT2 1 0.14200000 358150.40
+ OH1 CT3 1 0.14200000 358150.40
+ OH1 H 1 0.09600000 456056.00
+ OS CD 1 0.13340000 125520.00
+ OS CT3 1 0.14300000 284512.00
+ S CT2 1 0.18180000 165686.40
+ S CT3 1 0.18160000 200832.00
+ S HS 1 0.13250000 230120.00
+ SM CT2 1 0.18160000 179075.20
+ SM CT3 1 0.18160000 179075.20
+ SM SM 1 0.20290000 144766.40
+ SS CS 1 0.18360000 171544.00
+ HR1 CD 1 0.11100000 276144.00
+ O CD 1 0.12050000 602496.00
+ CT2A CT1 1 0.15380000 186188.00
+ CT2 CT2A 1 0.15300000 186188.00
+ CT2A HA2 1 0.11110000 258571.20
+ CT2A CPH1 1 0.15000000 192154.38
+ CT2A CC 1 0.15220000 167360.00
+ HT HT 1 0.15139000 0.00
+ HT OT 1 0.09572000 376560.00
+ OX HX 1 0.09700000 456056.00
+ CG1N1 CG2R61 1 0.14350000 288696.00
+ CG1N1 CG331 1 0.14700000 334720.00
+ CG1N1 NG1T1 1 0.11800000 881150.40
+ CG1T1 CG1T1 1 0.12200000 803328.00
+ CG1T1 CG1T2 1 0.12200000 820064.00
+ CG1T1 CG331 1 0.14650000 343088.00
+ CG1T2 HGPAM1 1 0.10700000 356476.80
+ CG251O CG25C1 1 0.13400000 368192.00
+ CG251O CG2DC3 1 0.13400000 476976.00
+ CG251O CG2R53 1 0.14800000 213384.00
+ CG251O NG2R53 1 0.14100000 167360.00
+ CG251O SG311 1 0.17700000 167360.00
+ CG252O CG25C2 1 0.13400000 368192.00
+ CG252O CG2DC3 1 0.13400000 476976.00
+ CG252O CG2R53 1 0.14800000 213384.00
+ CG252O NG2R53 1 0.14100000 167360.00
+ CG252O SG311 1 0.17700000 167360.00
+ CG25C1 CG2DC3 1 0.13420000 418400.00
+ CG25C1 CG2R53 1 0.14900000 206689.60
+ CG25C1 CG2RC0 1 0.14800000 242672.00
+ CG25C2 CG2DC3 1 0.13420000 418400.00
+ CG25C2 CG2R53 1 0.14900000 206689.60
+ CG25C2 CG2RC0 1 0.14800000 242672.00
+ CG2D1 CG2D1 1 0.13400000 368192.00
+ CG2D1 CG2D1O 1 0.13180000 368192.00
+ CG2D1 CG2D2 1 0.13420000 418400.00
+ CG2D1 CG2D2O 1 0.13180000 368192.00
+ CG2D1 CG301 1 0.15020000 200832.00
+ CG2D1 CG321 1 0.15020000 305432.00
+ CG2D1 CG331 1 0.15040000 320494.40
+ CG2D1 NG2D1 1 0.12760000 418400.00
+ CG2D1 NG2P1 1 0.12830000 393296.00
+ CG2D1 HGA4 1 0.11000000 301666.40
+ CG2D1 HGR52 1 0.11000000 301666.40
+ CG2D1O CG2D2 1 0.13400000 502080.00
+ CG2D1O CG2DC1 1 0.13400000 368192.00
+ CG2D1O NG301 1 0.13550000 351456.00
+ CG2D1O NG311 1 0.13550000 351456.00
+ CG2D1O NG321 1 0.14000000 351456.00
+ CG2D1O OG301 1 0.13600000 322168.00
+ CG2D1O OG3R60 1 0.13470000 418400.00
+ CG2D1O HGA4 1 0.11000000 301666.40
+ CG2D2 CG2D2 1 0.13300000 426768.00
+ CG2D2 CG2D2O 1 0.13400000 502080.00
+ CG2D2 HGA5 1 0.11000000 305432.00
+ CG2D2O CG2DC2 1 0.13400000 368192.00
+ CG2D2O NG301 1 0.13550000 351456.00
+ CG2D2O NG311 1 0.13550000 351456.00
+ CG2D2O NG321 1 0.14000000 351456.00
+ CG2D2O OG301 1 0.13600000 322168.00
+ CG2D2O OG3R60 1 0.13470000 418400.00
+ CG2D2O HGA4 1 0.11000000 301666.40
+ CG2DC1 CG2DC1 1 0.13400000 368192.00
+ CG2DC1 CG2DC2 1 0.14500000 251040.00
+ CG2DC1 CG2DC3 1 0.13420000 418400.00
+ CG2DC1 CG2O1 1 0.14890000 368192.00
+ CG2DC1 CG2O3 1 0.14890000 368192.00
+ CG2DC1 CG2O4 1 0.14798000 251040.00
+ CG2DC1 CG2O5 1 0.14800000 251040.00
+ CG2DC1 CG2R61 1 0.14500000 305432.00
+ CG2DC1 CG301 1 0.15020000 305432.00
+ CG2DC1 CG321 1 0.15020000 305432.00
+ CG2DC1 CG331 1 0.15040000 320494.40
+ CG2DC1 NG2D1 1 0.12760000 418400.00
+ CG2DC1 NG2P1 1 0.12830000 393296.00
+ CG2DC1 HGA4 1 0.11000000 301666.40
+ CG2DC1 HGR52 1 0.11000000 301666.40
+ CG2DC2 CG2DC2 1 0.13400000 368192.00
+ CG2DC2 CG2DC3 1 0.13420000 418400.00
+ CG2DC2 CG2O1 1 0.14890000 368192.00
+ CG2DC2 CG2O3 1 0.14890000 368192.00
+ CG2DC2 CG2O4 1 0.14798000 251040.00
+ CG2DC2 CG2O5 1 0.14800000 251040.00
+ CG2DC2 CG2R61 1 0.14500000 305432.00
+ CG2DC2 CG301 1 0.15020000 305432.00
+ CG2DC2 CG321 1 0.15020000 305432.00
+ CG2DC2 CG331 1 0.15040000 320494.40
+ CG2DC2 NG2D1 1 0.12760000 418400.00
+ CG2DC2 NG2P1 1 0.12830000 393296.00
+ CG2DC2 HGA4 1 0.11000000 301666.40
+ CG2DC2 HGR52 1 0.11000000 301666.40
+ CG2DC3 HGA5 1 0.11000000 305432.00
+ CG2N1 NG2D1 1 0.13100000 418400.00
+ CG2N1 NG2P1 1 0.13650000 387438.40
+ CG2N1 NG311 1 0.14400000 418400.00
+ CG2N1 NG321 1 0.14400000 376560.00
+ CG2N2 CG2R61 1 0.14400000 251040.00
+ CG2N2 CG331 1 0.15000000 234304.00
+ CG2N2 NG2P1 1 0.13200000 397480.00
+ CG2O1 CG2R61 1 0.14750000 251040.00
+ CG2O1 CG2R62 1 0.14800000 252713.60
+ CG2O1 CG311 1 0.14900000 209200.00
+ CG2O1 CG314 1 0.14900000 209200.00
+ CG2O1 CG321 1 0.14900000 209200.00
+ CG2O1 CG324 1 0.14900000 209200.00
+ CG2O1 CG331 1 0.14900000 209200.00
+ CG2O1 CG3C51 1 0.14900000 209200.00
+ CG2O1 CG3C53 1 0.14900000 209200.00
+ CG2O1 NG2S0 1 0.13500000 359824.00
+ CG2O1 NG2S1 1 0.13450000 309616.00
+ CG2O1 NG2S2 1 0.13600000 359824.00
+ CG2O1 OG2D1 1 0.12300000 518816.00
+ CG2O1 HGR52 1 0.11000000 265374.38
+ CG2O2 CG2R61 1 0.14800000 212547.20
+ CG2O2 CG311 1 0.15220000 167360.00
+ CG2O2 CG321 1 0.15220000 167360.00
+ CG2O2 CG331 1 0.15220000 167360.00
+ CG2O2 OG2D1 1 0.12200000 627600.00
+ CG2O2 OG302 1 0.13340000 125520.00
+ CG2O2 OG311 1 0.14000000 192464.00
+ CG2O2 HGR52 1 0.10960000 291206.40
+ CG2O3 CG2O5 1 0.15200000 209200.00
+ CG2O3 CG2R61 1 0.15000000 167360.00
+ CG2O3 CG301 1 0.15220000 167360.00
+ CG2O3 CG311 1 0.15220000 167360.00
+ CG2O3 CG314 1 0.15220000 167360.00
+ CG2O3 CG321 1 0.15220000 167360.00
+ CG2O3 CG324 1 0.15220000 167360.00
+ CG2O3 CG331 1 0.15220000 167360.00
+ CG2O3 CG3C51 1 0.14900000 209200.00
+ CG2O3 CG3C53 1 0.14900000 209200.00
+ CG2O3 OG2D2 1 0.12600000 439320.00
+ CG2O3 HGR52 1 0.11422000 199158.40
+ CG2O4 CG2R61 1 0.14798000 251040.00
+ CG2O4 CG321 1 0.15000000 209200.00
+ CG2O4 CG331 1 0.15000000 209200.00
+ CG2O4 OG2D1 1 0.12150000 585760.00
+ CG2O4 HGR52 1 0.11100000 276144.00
+ CG2O5 CG2R61 1 0.14600000 212547.20
+ CG2O5 CG311 1 0.15000000 276144.00
+ CG2O5 CG321 1 0.15000000 276144.00
+ CG2O5 CG331 1 0.15000000 276144.00
+ CG2O5 OG2D3 1 0.12300000 585760.00
+ CG2O6 NG2S1 1 0.13700000 426768.00
+ CG2O6 NG2S2 1 0.13600000 359824.00
+ CG2O6 OG2D1 1 0.12300000 543920.00
+ CG2O6 OG2D2 1 0.12940000 263173.60
+ CG2O6 OG302 1 0.13500000 292880.00
+ CG2O6 OG311 1 0.14800000 154808.00
+ CG2O6 SG2D1 1 0.16300000 251040.00
+ CG2O6 SG311 1 0.17500000 158992.00
+ CG2O7 NG2D1 1 0.11900000 769856.00
+ CG2O7 OG2D5 1 0.11700000 825084.80
+ CG2R51 CG2R51 1 0.13600000 343088.00
+ CG2R51 CG2R52 1 0.14000000 301248.00
+ CG2R51 CG2R53 1 0.15080000 220915.20
+ CG2R51 CG2R57 1 0.13600000 343088.00
+ CG2R51 CG2RC0 1 0.14300000 292880.00
+ CG2R51 CG2RC7 1 0.14050000 284512.00
+ CG2R51 CG321 1 0.15000000 192154.38
+ CG2R51 CG331 1 0.15000000 192154.38
+ CG2R51 CG3C52 1 0.15100000 292880.00
+ CG2R51 CG3C54 1 0.14960000 271960.00
+ CG2R51 NG2R50 1 0.13800000 334720.00
+ CG2R51 NG2R51 1 0.13800000 334720.00
+ CG2R51 NG2R52 1 0.13700000 317984.00
+ CG2R51 NG2R57 1 0.13800000 334720.00
+ CG2R51 NG2RC0 1 0.13710000 334720.00
+ CG2R51 NG3C51 1 0.14120000 301248.00
+ CG2R51 NG3P2 1 0.14800000 276144.00
+ CG2R51 OG2R50 1 0.13710000 376560.00
+ CG2R51 OG3C51 1 0.13700000 301248.00
+ CG2R51 SG2R50 1 0.17300000 251040.00
+ CG2R51 HGR51 1 0.10800000 292880.00
+ CG2R51 HGR52 1 0.10830000 313800.00
+ CG2R52 CG2R52 1 0.13800000 334720.00
+ CG2R52 CG2RC0 1 0.14200000 301248.00
+ CG2R52 CG3C52 1 0.15050000 292880.00
+ CG2R52 NG2R50 1 0.13150000 334720.00
+ CG2R52 NG2R52 1 0.13000000 410032.00
+ CG2R52 HGR52 1 0.10830000 313800.00
+ CG2R53 CG3C41 1 0.15600000 167360.00
+ CG2R53 CG3C52 1 0.15300000 251040.00
+ CG2R53 NG2R43 1 0.13800000 309616.00
+ CG2R53 NG2R50 1 0.13200000 334720.00
+ CG2R53 NG2R51 1 0.13740000 267776.00
+ CG2R53 NG2R52 1 0.13200000 317984.00
+ CG2R53 NG2R53 1 0.13800000 384928.00
+ CG2R53 NG3C51 1 0.14000000 317984.00
+ CG2R53 OG2D1 1 0.12350000 476976.00
+ CG2R53 OG2R50 1 0.13710000 376560.00
+ CG2R53 OG3C51 1 0.13570000 247274.40
+ CG2R53 SG2D1 1 0.16300000 334720.00
+ CG2R53 SG2R50 1 0.17300000 251040.00
+ CG2R53 SG311 1 0.17700000 142256.00
+ CG2R53 HGR52 1 0.10900000 284512.00
+ CG2R53 HGR53 1 0.10700000 278654.40
+ CG2R57 CG2R57 1 0.14500000 345598.40
+ CG2R57 NG2R57 1 0.13950000 326352.00
+ CG2R61 CG2R61 1 0.13750000 255224.00
+ CG2R61 CG2R62 1 0.13750000 329699.20
+ CG2R61 CG2R63 1 0.14270000 221752.00
+ CG2R61 CG2R64 1 0.13550000 209200.00
+ CG2R61 CG2R66 1 0.13700000 255224.00
+ CG2R61 CG2R67 1 0.13750000 255224.00
+ CG2R61 CG2RC0 1 0.13600000 251040.00
+ CG2R61 CG311 1 0.14900000 192464.00
+ CG2R61 CG312 1 0.14500000 165686.40
+ CG2R61 CG321 1 0.14900000 192464.00
+ CG2R61 CG324 1 0.14900000 192464.00
+ CG2R61 CG331 1 0.14900000 192464.00
+ CG2R61 NG2O1 1 0.14020000 192464.00
+ CG2R61 NG2R60 1 0.13050000 376560.00
+ CG2R61 NG2R61 1 0.13790000 317984.00
+ CG2R61 NG2R62 1 0.13050000 376560.00
+ CG2R61 NG2RC0 1 0.13790000 309616.00
+ CG2R61 NG2S1 1 0.14140000 255224.00
+ CG2R61 NG2S3 1 0.13900000 334720.00
+ CG2R61 NG311 1 0.14000000 276144.00
+ CG2R61 NG3N1 1 0.14100000 569024.00
+ CG2R61 OG301 1 0.13820000 192464.00
+ CG2R61 OG303 1 0.13800000 284512.00
+ CG2R61 OG311 1 0.14110000 279742.24
+ CG2R61 OG312 1 0.12600000 439320.00
+ CG2R61 OG3R60 1 0.13500000 234304.00
+ CG2R61 SG311 1 0.17500000 234304.00
+ CG2R61 SG3O1 1 0.17800000 192464.00
+ CG2R61 SG3O2 1 0.17300000 158992.00
+ CG2R61 CLGR1 1 0.17400000 292880.00
+ CG2R61 BRGR1 1 0.19030000 192464.00
+ CG2R61 IGR1 1 0.21150000 158992.00
+ CG2R61 HGR61 1 0.10800000 284512.00
+ CG2R61 HGR62 1 0.10800000 284512.00
+ CG2R62 CG2R62 1 0.13500000 351456.00
+ CG2R62 CG2R63 1 0.14030000 252713.60
+ CG2R62 CG2R64 1 0.14060000 267776.00
+ CG2R62 CG331 1 0.14780000 192464.00
+ CG2R62 NG2R61 1 0.13430000 252713.60
+ CG2R62 NG2R62 1 0.13650000 284512.00
+ CG2R62 NG2R67 1 0.13430000 252713.60
+ CG2R62 OG3R60 1 0.13700000 276144.00
+ CG2R62 HGR62 1 0.10900000 292880.00
+ CG2R62 HGR63 1 0.10900000 292880.00
+ CG2R63 CG2RC0 1 0.13600000 252713.60
+ CG2R63 NG2R61 1 0.13830000 284512.00
+ CG2R63 NG2R62 1 0.13350000 292880.00
+ CG2R63 NG2R67 1 0.13430000 252713.60
+ CG2R63 OG2D4 1 0.12340000 552288.00
+ CG2R63 OG3R60 1 0.14000000 196648.00
+ CG2R63 SG2D1 1 0.16550000 312126.40
+ CG2R64 CG2RC0 1 0.13580000 301248.00
+ CG2R64 NG2R60 1 0.13050000 376560.00
+ CG2R64 NG2R61 1 0.13920000 334720.00
+ CG2R64 NG2R62 1 0.13420000 334720.00
+ CG2R64 NG2R67 1 0.13920000 334720.00
+ CG2R64 NG2S1 1 0.14140000 255224.00
+ CG2R64 NG2S3 1 0.13660000 301248.00
+ CG2R64 SG311 1 0.17410000 219241.60
+ CG2R64 HGR62 1 0.10900000 317984.00
+ CG2R66 FGR1 1 0.13580000 334720.00
+ CG2R67 CG2R67 1 0.14900000 251040.00
+ CG2R67 CG2RC0 1 0.14200000 251040.00
+ CG2R67 NG2R60 1 0.13100000 376560.00
+ CG2R67 NG2R67 1 0.14110000 337230.40
+ CG2R71 CG2R71 1 0.13850000 301248.00
+ CG2R71 CG2RC7 1 0.13800000 334720.00
+ CG2R71 HGR71 1 0.10900000 297064.00
+ CG2RC0 CG2RC0 1 0.13850000 301248.00
+ CG2RC0 CG3C52 1 0.15200000 255224.00
+ CG2RC0 NG2R50 1 0.13650000 259408.00
+ CG2RC0 NG2R51 1 0.13750000 251040.00
+ CG2RC0 NG2R62 1 0.13150000 292880.00
+ CG2RC0 NG2RC0 1 0.14170000 205016.00
+ CG2RC0 NG3C51 1 0.14000000 276144.00
+ CG2RC0 OG2R50 1 0.13700000 376560.00
+ CG2RC0 OG3C51 1 0.13890000 276144.00
+ CG2RC0 SG2R50 1 0.17600000 251040.00
+ CG2RC7 CG2RC7 1 0.15200000 192464.00
+ CG301 CG311 1 0.15000000 186188.00
+ CG301 CG321 1 0.15380000 186188.00
+ CG301 CG331 1 0.15380000 186188.00
+ CG301 OG301 1 0.14150000 301248.00
+ CG301 OG302 1 0.14300000 284512.00
+ CG301 OG311 1 0.14200000 358150.40
+ CG301 CLGA3 1 0.17700000 158992.00
+ CG301 BRGA3 1 0.19540000 100416.00
+ CG302 CG321 1 0.15200000 209200.00
+ CG302 CG331 1 0.15200000 209200.00
+ CG302 FGA3 1 0.13400000 221752.00
+ CG311 CG311 1 0.15000000 186188.00
+ CG311 CG314 1 0.15000000 186188.00
+ CG311 CG321 1 0.15380000 186188.00
+ CG311 CG324 1 0.15300000 186188.00
+ CG311 CG331 1 0.15380000 186188.00
+ CG311 CG3C51 1 0.15280000 186188.00
+ CG311 CG3RC1 1 0.15240000 186188.00
+ CG311 NG2R53 1 0.14300000 267776.00
+ CG311 NG2S1 1 0.14300000 267776.00
+ CG311 OG301 1 0.14150000 301248.00
+ CG311 OG302 1 0.14300000 284512.00
+ CG311 OG303 1 0.14300000 284512.00
+ CG311 OG311 1 0.14200000 358150.40
+ CG311 OG312 1 0.13130000 299574.40
+ CG311 CLGA1 1 0.17768000 158992.00
+ CG311 BRGA2 1 0.19560000 117152.00
+ CG311 HGA1 1 0.11110000 258571.20
+ CG312 CG331 1 0.15200000 165686.40
+ CG312 PG1 1 0.18800000 225936.00
+ CG312 PG2 1 0.18800000 225936.00
+ CG312 FGA2 1 0.13530000 292043.20
+ CG312 HGA7 1 0.10828000 289532.80
+ CG314 CG321 1 0.15380000 186188.00
+ CG314 CG331 1 0.15380000 186188.00
+ CG314 NG3P2 1 0.14900000 167360.00
+ CG314 NG3P3 1 0.14800000 167360.00
+ CG314 HGA1 1 0.11110000 258571.20
+ CG321 CG321 1 0.15300000 186188.00
+ CG321 CG324 1 0.15300000 186188.00
+ CG321 CG331 1 0.15280000 186188.00
+ CG321 CG3C31 1 0.15000000 230120.00
+ CG321 CG3C51 1 0.15280000 186188.00
+ CG321 CG3RC1 1 0.15240000 186188.00
+ CG321 NG2R51 1 0.14580000 334720.00
+ CG321 NG2S1 1 0.14300000 267776.00
+ CG321 NG2S3 1 0.14400000 269449.60
+ CG321 NG311 1 0.14740000 220078.40
+ CG321 NG321 1 0.14740000 220078.40
+ CG321 OG301 1 0.14150000 301248.00
+ CG321 OG302 1 0.14400000 267776.00
+ CG321 OG303 1 0.14400000 267776.00
+ CG321 OG311 1 0.14200000 358150.40
+ CG321 OG312 1 0.13300000 376560.00
+ CG321 OG3C61 1 0.14150000 301248.00
+ CG321 OG3R60 1 0.14000000 234304.00
+ CG321 PG1 1 0.18900000 225936.00
+ CG321 PG2 1 0.18900000 225936.00
+ CG321 SG301 1 0.18160000 179075.20
+ CG321 SG311 1 0.18180000 165686.40
+ CG321 SG3O1 1 0.18070000 154808.00
+ CG321 SG3O2 1 0.17900000 154808.00
+ CG321 SG3O3 1 0.18100000 154808.00
+ CG321 CLGA1 1 0.17880000 184096.00
+ CG321 BRGA1 1 0.19660000 133888.00
+ CG321 HGA2 1 0.11110000 258571.20
+ CG322 CG331 1 0.15200000 142256.00
+ CG322 FGA1 1 0.13740000 351456.00
+ CG322 HGA6 1 0.10828000 286185.60
+ CG323 CG331 1 0.15310000 158992.00
+ CG323 SG302 1 0.18360000 171544.00
+ CG323 HGA2 1 0.11110000 251040.00
+ CG323 HGA3 1 0.11110000 251040.00
+ CG324 CG331 1 0.15280000 186188.00
+ CG324 CG3C31 1 0.15280000 186188.00
+ CG324 NG2O1 1 0.14900000 189116.80
+ CG324 NG2P1 1 0.14530000 251040.00
+ CG324 NG3P0 1 0.15100000 179912.00
+ CG324 NG3P1 1 0.14800000 167360.00
+ CG324 NG3P2 1 0.14900000 167360.00
+ CG324 NG3P3 1 0.14900000 167360.00
+ CG324 HGA2 1 0.11000000 238069.60
+ CG324 HGP5 1 0.10800000 251040.00
+ CG331 CG331 1 0.15300000 186188.00
+ CG331 CG3C51 1 0.15280000 186188.00
+ CG331 CG3RC1 1 0.15380000 186188.00
+ CG331 NG2D1 1 0.14400000 259408.00
+ CG331 NG2R51 1 0.14580000 334720.00
+ CG331 NG2R61 1 0.14560000 334720.00
+ CG331 NG2S0 1 0.14340000 263592.00
+ CG331 NG2S1 1 0.14300000 267776.00
+ CG331 NG2S3 1 0.14600000 222588.80
+ CG331 NG311 1 0.14630000 213384.00
+ CG331 OG301 1 0.14150000 301248.00
+ CG331 OG302 1 0.14300000 284512.00
+ CG331 OG303 1 0.14300000 284512.00
+ CG331 OG311 1 0.14200000 358150.40
+ CG331 OG312 1 0.13300000 376560.00
+ CG331 SG301 1 0.18160000 179075.20
+ CG331 SG311 1 0.18160000 200832.00
+ CG331 SG3O1 1 0.18370000 163176.00
+ CG331 SG3O2 1 0.17900000 175728.00
+ CG331 SG3O3 1 0.18000000 200832.00
+ CG331 HGA3 1 0.11110000 269449.60
+ CG334 NG2O1 1 0.14800000 209200.00
+ CG334 NG2P1 1 0.14530000 251040.00
+ CG334 NG3P0 1 0.15100000 179912.00
+ CG334 NG3P1 1 0.14800000 167360.00
+ CG334 NG3P3 1 0.14800000 167360.00
+ CG334 HGA3 1 0.11110000 269449.60
+ CG334 HGP5 1 0.10800000 251040.00
+ CG3AM0 NG301 1 0.14540000 196648.00
+ CG3AM0 HGAAM0 1 0.11110000 260244.80
+ CG3AM1 NG311 1 0.14630000 213384.00
+ CG3AM1 HGAAM1 1 0.10980000 262587.84
+ CG3AM2 NG321 1 0.14740000 220078.40
+ CG3AM2 HGAAM2 1 0.10856000 263173.60
+ CG3C31 CG3C31 1 0.15010000 200832.00
+ CG3C31 CG3RC1 1 0.15240000 186188.00
+ CG3C31 OG3C31 1 0.14500000 184096.00
+ CG3C31 HGA1 1 0.10830000 284512.00
+ CG3C31 HGA2 1 0.10830000 284512.00
+ CG3C41 CG3C41 1 0.15400000 225936.00
+ CG3C41 NG2R43 1 0.14500000 205016.00
+ CG3C41 HGA2 1 0.10930000 291206.40
+ CG3C51 CG3C51 1 0.15180000 163176.00
+ CG3C51 CG3C52 1 0.15180000 163176.00
+ CG3C51 CG3C53 1 0.15000000 186188.00
+ CG3C51 CG3RC1 1 0.15240000 186188.00
+ CG3C51 NG2R51 1 0.14580000 184096.00
+ CG3C51 NG2R61 1 0.14560000 184096.00
+ CG3C51 NG2S0 1 0.14340000 267776.00
+ CG3C51 NG2S3 1 0.14620000 301248.00
+ CG3C51 NG301 1 0.14560000 184096.00
+ CG3C51 NG321 1 0.14740000 220078.40
+ CG3C51 OG301 1 0.14110000 279742.24
+ CG3C51 OG303 1 0.14300000 284512.00
+ CG3C51 OG311 1 0.14200000 358150.40
+ CG3C51 OG3C51 1 0.14250000 292880.00
+ CG3C51 FGA1 1 0.13740000 351456.00
+ CG3C51 HGA1 1 0.11000000 256897.60
+ CG3C51 HGA6 1 0.10828000 286185.60
+ CG3C52 CG3C52 1 0.15300000 163176.00
+ CG3C52 CG3C53 1 0.15270000 186188.00
+ CG3C52 CG3C54 1 0.15370000 186188.00
+ CG3C52 CG3RC1 1 0.15240000 186188.00
+ CG3C52 NG2R50 1 0.14700000 334720.00
+ CG3C52 NG2R53 1 0.14500000 309616.00
+ CG3C52 NG2S0 1 0.14550000 267776.00
+ CG3C52 NG3C51 1 0.14780000 334720.00
+ CG3C52 OG3C51 1 0.14250000 292880.00
+ CG3C52 HGA2 1 0.11000000 256897.60
+ CG3C53 NG2R61 1 0.14560000 184096.00
+ CG3C53 NG3P2 1 0.14850000 267776.00
+ CG3C53 OG3C51 1 0.14460000 200832.00
+ CG3C53 HGA1 1 0.10800000 276144.00
+ CG3C54 CG3C54 1 0.15600000 175728.00
+ CG3C54 NG2R52 1 0.14600000 267776.00
+ CG3C54 NG3C51 1 0.14300000 196648.00
+ CG3C54 NG3P2 1 0.15150000 267776.00
+ CG3C54 HGA2 1 0.11110000 258571.20
+ CG3RC1 CG3RC1 1 0.15230000 186188.00
+ CG3RC1 NG2R51 1 0.14580000 184096.00
+ CG3RC1 NG2R61 1 0.14560000 184096.00
+ CG3RC1 OG3C51 1 0.14200000 217568.00
+ CG3RC1 HGA1 1 0.11110000 258571.20
+ NG2D1 NG2S1 1 0.13600000 460240.00
+ NG2D1 HGP1 1 0.10000000 380744.00
+ NG2O1 OG2N1 1 0.12250000 485344.00
+ NG2P1 HGP2 1 0.10000000 380744.00
+ NG2R43 HGP1 1 0.10150000 337230.40
+ NG2R50 NG2R50 1 0.12900000 284512.00
+ NG2R50 NG2R51 1 0.13550000 301248.00
+ NG2R50 NG3C51 1 0.14110000 351456.00
+ NG2R50 OG2R50 1 0.13950000 234304.00
+ NG2R50 SG2R50 1 0.17000000 225936.00
+ NG2R51 HGP1 1 0.10100000 396643.20
+ NG2R52 HGP2 1 0.10000000 379070.40
+ NG2R53 HGP1 1 0.10150000 393296.00
+ NG2R57 NG2R57 1 0.13650000 376560.00
+ NG2R61 HGP1 1 0.10100000 396643.20
+ NG2R61 HGP2 1 0.10100000 396643.20
+ NG2R62 NG2R62 1 0.13200000 351456.00
+ NG2S1 HGP1 1 0.09970000 368192.00
+ NG2S2 HGP1 1 0.10000000 401664.00
+ NG2S3 PG1 1 0.17920000 150624.00
+ NG2S3 SG3O1 1 0.17000000 187443.20
+ NG2S3 HGP1 1 0.10250000 361916.00
+ NG2S3 HGP4 1 0.10000000 408358.40
+ NG311 SG3O2 1 0.16500000 196648.00
+ NG311 HGP1 1 0.10210000 369865.60
+ NG311 HGPAM1 1 0.10190000 374719.04
+ NG321 SG3O2 1 0.16800000 200832.00
+ NG321 HGP1 1 0.10200000 379907.20
+ NG321 HGPAM2 1 0.10140000 379154.08
+ NG331 HGPAM3 1 0.10140000 381162.40
+ NG3C51 NG3P2 1 0.14400000 225936.00
+ NG3C51 HGP1 1 0.10180000 376560.00
+ NG3N1 NG3N1 1 0.14000000 297064.00
+ NG3N1 HGP1 1 0.10100000 365681.60
+ NG3P0 OG311 1 0.14000000 205016.00
+ NG3P0 OG312 1 0.14000000 259408.00
+ NG3P1 HGP2 1 0.10400000 337230.40
+ NG3P2 HGP2 1 0.10060000 384928.00
+ NG3P3 HGP2 1 0.10400000 337230.40
+ OG2P1 PG0 1 0.14800000 485344.00
+ OG2P1 PG1 1 0.15100000 418400.00
+ OG2P1 PG2 1 0.15200000 334720.00
+ OG2P1 SG3O1 1 0.14480000 451872.00
+ OG2P1 SG3O2 1 0.14400000 527184.00
+ OG2P1 SG3O3 1 0.15300000 451872.00
+ OG303 PG0 1 0.16100000 192464.00
+ OG303 PG1 1 0.16500000 158992.00
+ OG303 PG2 1 0.16550000 125520.00
+ OG303 SG3O1 1 0.15750000 209200.00
+ OG303 SG3O2 1 0.16000000 196648.00
+ OG304 PG1 1 0.16750000 276144.00
+ OG304 PG2 1 0.17150000 251040.00
+ OG311 PG0 1 0.15800000 198321.60
+ OG311 PG1 1 0.16100000 198321.60
+ OG311 HGP1 1 0.09600000 456056.00
+ SG301 SG301 1 0.20290000 144766.40
+ SG311 HGP3 1 0.13250000 230120.00
+ FGP1 ALG1 1 0.17260000 171544.00
+ OC2D3 CC2O3 1 0.12150000 585760.00
+ CC2O3 CC331 1 0.15000000 276144.00
+ CC2O3 CC312 1 0.15000000 276144.00
+ CC2O3 CC322 1 0.15000000 276144.00
+ OC2D4 CC2O4 1 0.12150000 585760.00
+ HCR1 CC2O4 1 0.11100000 276144.00
+ CC2O4 CC331 1 0.15000000 209200.00
+ CC2O4 CC312 1 0.15000000 209200.00
+ CC311 CC311 1 0.15000000 186188.00
+ CC312 CC312 1 0.14850000 186188.00
+ CC3161 CC3163 1 0.15000000 186188.00
+ CC3161 CC3263 1 0.15000000 186188.00
+ CC312 CC322 1 0.14850000 186188.00
+ CC301 CC331 1 0.15380000 186188.00
+ CC311 CC321 1 0.15380000 186188.00
+ CC311 CC331 1 0.15380000 186188.00
+ CC331 CC3163 1 0.15380000 186188.00
+ CC3161 CC3161 1 0.14800000 186188.00
+ CC3261 CC3161 1 0.14800000 186188.00
+ CC3161 CC3162 1 0.14800000 186188.00
+ CC3261 CC3062 1 0.15150000 186188.00
+ CC321 CC3163 1 0.14900000 186188.00
+ CC312 CC3163 1 0.14900000 186188.00
+ CC301 CC2O2 1 0.15220000 167360.00
+ CC311 CC2O2 1 0.15220000 167360.00
+ CC3163 CC2O2 1 0.14800000 167360.00
+ CC3062 CC2O2 1 0.14800000 167360.00
+ CC2O1 CC331 1 0.15200000 209200.00
+ CC321 CC331 1 0.15280000 186188.00
+ CC321 CC321 1 0.15300000 186188.00
+ CC321C CC321C 1 0.15300000 186188.00
+ CC321C CC321D 1 0.15300000 186188.00
+ CC321C CC311C 1 0.15380000 186188.00
+ CC321 CC311C 1 0.14900000 186188.00
+ CC321C CC311D 1 0.15380000 186188.00
+ CC321D CC311C 1 0.15380000 186188.00
+ CC321 CC2O2 1 0.15220000 167360.00
+ CC3161 OC311 1 0.14100000 343088.00
+ CC3162 OC311 1 0.14000000 358150.40
+ CC3062 OC311 1 0.14000000 358150.40
+ CC301 OC311 1 0.14200000 358150.40
+ CC311 OC311 1 0.14200000 358150.40
+ CC312 OC311 1 0.14200000 334720.00
+ CC311 OC311M 1 0.14200000 358150.40
+ CC321 OC311 1 0.14200000 358150.40
+ CC321 OC311M 1 0.14200000 358150.40
+ CC331 OC311M 1 0.14200000 358150.40
+ CC322 OC311 1 0.14200000 334720.00
+ CC2O1 OC2D1 1 0.12300000 518816.00
+ CC2O2 OC2D2 1 0.12600000 439320.00
+ CC301 OC301 1 0.14150000 301248.00
+ CC311 OC301 1 0.14150000 301248.00
+ CC321 OC301 1 0.14150000 301248.00
+ CC331 OC301 1 0.14150000 301248.00
+ CC311D OC301 1 0.13950000 301248.00
+ CC3162 OC301 1 0.13950000 301248.00
+ CC3062 OC301 1 0.13950000 301248.00
+ CC311D OC302 1 0.14150000 301248.00
+ CC3162 OC302 1 0.14150000 301248.00
+ CC311C OC301 1 0.14350000 301248.00
+ CC3161 OC301 1 0.14150000 301248.00
+ CC321D OC3C61 1 0.14150000 301248.00
+ CC311D OC3C61 1 0.14150000 301248.00
+ CC3162 OC3C61 1 0.14250000 301248.00
+ CC3062 OC3C61 1 0.14250000 301248.00
+ CC321C OC3C61 1 0.14150000 301248.00
+ CC311C OC3C61 1 0.14150000 301248.00
+ CC3163 OC3C61 1 0.14250000 301248.00
+ CC3263 OC3C61 1 0.14250000 301248.00
+ NC2D1 CC311 1 0.14300000 267776.00
+ NC2D1 CC3161 1 0.14300000 267776.00
+ NC2D1 CC331 1 0.14300000 267776.00
+ NC2D1 CC2O1 1 0.13450000 309616.00
+ CC311 HCA1 1 0.11110000 258571.20
+ CC312 HCA1 1 0.11110000 258571.20
+ CC3161 HCA1 1 0.11110000 258571.20
+ CC3162 HCA1 1 0.11110000 258571.20
+ CC3163 HCA1 1 0.11110000 258571.20
+ CC311C HCA1 1 0.11110000 258571.20
+ CC311D HCA1 1 0.11110000 258571.20
+ CC321 HCA2 1 0.11110000 258571.20
+ CC322 HCA2 1 0.11110000 258571.20
+ CC3263 HCA2 1 0.11110000 258571.20
+ CC331 HCA3 1 0.11110000 269449.60
+ CC321C HCA2 1 0.11110000 258571.20
+ CC321D HCA2 1 0.11110000 258571.20
+ CC3261 HCA2 1 0.11110000 258571.20
+ OC311 HCP1 1 0.09600000 456056.00
+ OC311M HCP1 1 0.09600000 456056.00
+ OC311M HCP1M 1 0.09600000 456056.00
+ NC2D1 HCP1 1 0.09970000 368192.00
+ CC322C OC3C5M 1 0.14250000 292880.00
+ CC322C CC322C 1 0.15180000 163176.00
+ CC322C HCA2C2 1 0.11000000 256897.60
+ CC312C CC331 1 0.15280000 186188.00
+ CC312C OC3C5M 1 0.14250000 292880.00
+ CC312C CC322C 1 0.15180000 163176.00
+ CC312C HCA1C2 1 0.11000000 256897.60
+ CC312C OC301 1 0.13950000 301248.00
+ OC3C51 CC3152 1 0.14250000 292880.00
+ OC3C51 CC3051 1 0.14250000 292880.00
+ OC3C51 CC3153 1 0.14250000 292880.00
+ OC311 CC3152 1 0.13950000 358150.40
+ OC311 CC3051 1 0.13950000 358150.40
+ OC311 CC3151 1 0.13950000 343088.00
+ CC3152 HCA1 1 0.11110000 258571.20
+ CC3251 HCA2 1 0.11000000 256897.60
+ CC3151 HCA1 1 0.11110000 258571.20
+ CC3153 HCA1 1 0.11110000 258571.20
+ CC3152 CC3251 1 0.15080000 163176.00
+ CC3051 CC3251 1 0.15080000 163176.00
+ CC3251 CC3151 1 0.15080000 163176.00
+ CC3151 CC3153 1 0.15080000 163176.00
+ CC3151 CC3152 1 0.15080000 163176.00
+ CC3151 CC3051 1 0.15080000 163176.00
+ CC3151 CC3151 1 0.15080000 163176.00
+ CC3153 CC321 1 0.14900000 186188.00
+ CC3051 CC321 1 0.14900000 186188.00
+ CC3152 OC301 1 0.13950000 301248.00
+ CC321D CC311D 1 0.15380000 186188.00
+ CC311D CC311D 1 0.15380000 186188.00
+ CC3161 OC30P 1 0.14250000 301248.00
+ CC311D OC30P 1 0.14250000 301248.00
+ CC3162 OC30P 1 0.14250000 301248.00
+ CC321 OC30P 1 0.14520000 301248.00
+ OC30P PC 1 0.16750000 225936.00
+ OC2DP PC 1 0.15250000 485344.00
+ OC312 PC 1 0.16100000 198321.60
+ OC312 HCP1 1 0.09600000 456056.00
+ SC OC2DP 1 0.14480000 451872.00
+ SC OC30P 1 0.16100000 209200.00
+ CC312D OC301 1 0.13950000 301248.00
+ CC312D OC3C5M 1 0.14250000 292880.00
+ CC312D CC322C 1 0.15180000 163176.00
+ CC312D HCA1 1 0.11000000 256897.60
+ CC312D OC302 1 0.14250000 301248.00
+ CC312C HCA1 1 0.11000000 256897.60
+ CC312C CC321 1 0.15000000 186188.00
+ CC331 OC303 1 0.14150000 301248.00
+ CC312C OC303 1 0.14250000 301248.00
+ CC311D OC303 1 0.13950000 301248.00
+ CC3051 OC302 1 0.14250000 301248.00
+ CC3162 OC303 1 0.13950000 301248.00
+ OC303 CC3151 1 0.14250000 301248.00
+ OC301 CC3051 1 0.13950000 301248.00
+ CN8 NN6 1 0.14800000 167360.00
+ NN6 HN1 1 0.10400000 337230.40
+ ON6 CN8B 1 0.14200000 217568.00
+ CN8 CN8B 1 0.15280000 186188.00
+ CN1 CN3 1 0.14090000 252713.60
+ CN1 CN3T 1 0.14030000 252713.60
+ CN1 CN5G 1 0.13600000 252713.60
+ CN1 NN2 1 0.13670000 317984.00
+ CN1T NN2B 1 0.13480000 252713.60
+ CN1 NN2G 1 0.13960000 284512.00
+ CN1 NN2U 1 0.13890000 284512.00
+ CN1T NN2U 1 0.13830000 284512.00
+ CN1 NN3 1 0.13350000 292880.00
+ CN1T ON1 1 0.12300000 719648.00
+ CN1 ON1 1 0.12340000 552288.00
+ CN1 ON1C 1 0.12450000 518816.00
+ CN2 CN3 1 0.14060000 267776.00
+ CN2 CN5 1 0.13580000 301248.00
+ CN2 NN1 1 0.13660000 301248.00
+ CN2 NN2G 1 0.13920000 334720.00
+ CN2 NN3 1 0.13430000 376560.00
+ CN2 NN3A 1 0.13420000 334720.00
+ CN2 NN3G 1 0.13260000 267776.00
+ CN3 CN3 1 0.13260000 418400.00
+ CN3 CN3T 1 0.13200000 468608.00
+ CN3T CN9 1 0.14780000 192464.00
+ CN3 HN3 1 0.10900000 292880.00
+ CN3T HN3 1 0.10900000 292880.00
+ CN3 NN2 1 0.13430000 252713.60
+ CN3 NN2B 1 0.13430000 267776.00
+ CN4 HN3 1 0.10900000 317984.00
+ CN4 NN2 1 0.13740000 267776.00
+ CN4 NN2B 1 0.13780000 251040.00
+ CN4 NN3A 1 0.13220000 351456.00
+ CN4 NN4 1 0.13050000 334720.00
+ CN5 CN5 1 0.13610000 259408.00
+ CN5 CN5G 1 0.13500000 267776.00
+ CN5 NN2 1 0.13750000 251040.00
+ CN5 NN2B 1 0.13750000 252713.60
+ CN5 NN3A 1 0.13120000 292880.00
+ CN5 NN3G 1 0.13150000 292880.00
+ CN5 NN4 1 0.13550000 259408.00
+ CN5G NN4 1 0.13650000 259408.00
+ CN8 CN8 1 0.15280000 186188.00
+ CN8 CN9 1 0.15280000 186188.00
+ CN8 NN2 1 0.14600000 334720.00
+ CN8 ON5 1 0.14200000 358150.40
+ CN9 HN9 1 0.11110000 269449.60
+ CN9 ON2 1 0.14300000 284512.00
+ HN1 NN1 1 0.10000000 408358.40
+ HN2 NN2 1 0.10100000 396643.20
+ HN2 NN2B 1 0.10100000 396643.20
+ HN2 NN2G 1 0.10100000 394132.80
+ HN2 NN2U 1 0.10100000 396643.20
+ HN4 ON4 1 0.09600000 456056.00
+ ON2 P 1 0.16000000 225936.00
+ ON2 P2 1 0.16000000 225936.00
+ ON3 P 1 0.14800000 485344.00
+ ON3 P2 1 0.14800000 485344.00
+ ON4 P 1 0.15800000 198321.60
+ ON4 P2 1 0.15800000 198321.60
+ CN7B ON6 1 0.14200000 217568.00
+ CN7B CN8 1 0.15180000 167360.00
+ CN7 ON6 1 0.14460000 200832.00
+ CN7 CN7 1 0.15290000 186188.00
+ CN7 CN8 1 0.15160000 186188.00
+ CN7 CN9 1 0.15160000 186188.00
+ CN7 HN7 1 0.11110000 258571.20
+ CN8 HN8 1 0.11110000 258571.20
+ CN7B HN7 1 0.11110000 258571.20
+ CN7B ON6B 1 0.14200000 217568.00
+ CN7 ON6B 1 0.14800000 200832.00
+ CN7B CN7B 1 0.14500000 167360.00
+ CN7 CN7B 1 0.14600000 186188.00
+ CN7 CN8B 1 0.15120000 186188.00
+ CN8B ON2 1 0.14400000 267776.00
+ CN8B ON5 1 0.14200000 358150.40
+ CN7 ON2 1 0.14330000 259408.00
+ CN7B ON2 1 0.14330000 259408.00
+ CN7 ON5 1 0.14200000 358150.40
+ CN9 NN2 1 0.14560000 334720.00
+ CN8 NN2B 1 0.14580000 334720.00
+ CN9 NN2B 1 0.14580000 334720.00
+ CN7B NN2 1 0.14560000 184096.00
+ CN7B NN2B 1 0.14580000 184096.00
+ CN8B HN8 1 0.11110000 258571.20
+ ON5 HN5 1 0.09600000 456056.00
+ CN7B ON5 1 0.14000000 358150.40
+ CN8 ON2 1 0.14400000 284512.00
+ CTL3 CL 1 0.15220000 167360.00
+ CTL2 CL 1 0.15220000 167360.00
+ CTL1 CL 1 0.15220000 167360.00
+ CTL1 CCL 1 0.15220000 167360.00
+ OBL CL 1 0.12200000 627600.00
+ OCL CL 1 0.12600000 439320.00
+ OCL CCL 1 0.12600000 439320.00
+ OSL CL 1 0.13340000 125520.00
+ OSLP CL 1 0.13340000 125520.00
+ OHL CL 1 0.14000000 192464.00
+ HOL OHL 1 0.09600000 456056.00
+ CTL1 HAL1 1 0.11110000 258571.20
+ CTL1 HBL 1 0.10800000 276144.00
+ CTL2 HAL2 1 0.11110000 258571.20
+ CTL3 HAL3 1 0.11110000 269449.60
+ CTL3 OSL 1 0.14300000 284512.00
+ CTL2 OSL 1 0.14300000 284512.00
+ CTL1 OSL 1 0.14300000 284512.00
+ CTL3 OSLP 1 0.14300000 284512.00
+ CTL2 OSLP 1 0.14300000 284512.00
+ CTL1 OSLP 1 0.14300000 284512.00
+ OSL PL 1 0.16000000 225936.00
+ OSLP PL 1 0.16000000 225936.00
+ O2L PL 1 0.14800000 485344.00
+ OHL PL 1 0.15900000 198321.60
+ NH3L HCL 1 0.10400000 343088.00
+ NH3L CTL1 1 0.14800000 167360.00
+ NH3L CTL2 1 0.15100000 218404.80
+ NTL CTL2 1 0.15100000 179912.00
+ NTL CTL5 1 0.15100000 179912.00
+ CTL5 HL 1 0.10800000 251040.00
+ CTL2 HL 1 0.10800000 251040.00
+ CTL1 CTL1 1 0.15000000 186188.00
+ CTL1 CTL2 1 0.15380000 186188.00
+ CTL1 CTL3 1 0.15380000 186188.00
+ CTL2 CTL2 1 0.15300000 186188.00
+ CTL2 CTL3 1 0.15280000 186188.00
+ CTL3 CTL3 1 0.15300000 186188.00
+ OHL CTL1 1 0.14200000 358150.40
+ OHL CTL2 1 0.14200000 358150.40
+ OHL CTL3 1 0.14200000 358150.40
+ SL O2L 1 0.14480000 451872.00
+ SL OSL 1 0.15750000 209200.00
+ CEL2 CEL2 1 0.13300000 426768.00
+ HEL2 CEL2 1 0.11000000 305432.00
+ CEL1 CTL3 1 0.15040000 320494.40
+ CEL1 CEL2 1 0.13420000 418400.00
+ HEL1 CEL1 1 0.11000000 301666.40
+ CEL1 CTL2 1 0.15020000 305432.00
+ CEL1 CEL1 1 0.13400000 368192.00
+ CC31A HCA1A 1 0.11110000 258571.20
+ CC32A HCA2A 1 0.11110000 258571.20
+ CC33A HCA3A 1 0.11110000 269449.60
+ CC30A CC32A 1 0.15380000 186188.00
+ CC30A CC33A 1 0.15380000 186188.00
+ CC31A CC31A 1 0.15000000 186188.00
+ CC31A CC32A 1 0.15380000 186188.00
+ CC31A CC33A 1 0.15380000 186188.00
+ CC32A CC32A 1 0.15300000 186188.00
+ CC32A CC33A 1 0.15280000 186188.00
+ CC33A CC33A 1 0.15300000 186188.00
+ CC325A CC325A 1 0.15480000 163176.00
+ CC325A HCA25A 1 0.11160000 256897.60
+ CC325B OC305A 1 0.14250000 292880.00
+ CC325B CC325B 1 0.15180000 163176.00
+ CC325B HCA25A 1 0.11000000 256897.60
+ CC325B CC33A 1 0.15280000 186188.00
+ CC32A OC30A 1 0.14150000 301248.00
+ CC33A OC30A 1 0.14150000 301248.00
+ CC326A HCA2A 1 0.11110000 258571.20
+ CC326A CC326A 1 0.15300000 186188.00
+ CC326A OC30A 1 0.14150000 301248.00
+ C C 1 0.13350000 502080.00
+ CST OST 1 0.11600000 784884.93
+ SS FE 1 0.23200000 209200.00
+ CPB CE1 1 0.13800000 376560.00
+ CPB CPA 1 0.14432000 250872.64
+ CPB CPB 1 0.13464000 285097.76
+ CPM CPA 1 0.13716000 301248.00
+ CT2 CPB 1 0.14900000 192464.00
+ CT3 CPB 1 0.14900000 192464.00
+ FE CM 1 0.19000000 215894.40
+ FE CPM 1 0.33814000 0.00
+ HA CPM 1 0.10900000 307607.68
+ NPH CPA 1 0.13757000 315640.96
+ NPH FE 1 0.19580000 226103.36
+ NR2 FE 1 0.22000000 54392.00
+ OM CM 1 0.11280000 933032.00
+ OM FE 1 0.18000000 209200.00
+ OM OM 1 0.12300000 502080.00
+ CEL1 CTL1 1 0.15020000 200832.00
+ CTL1 CRL1 1 0.15000000 186188.00
+ CRL1 CRL1 1 0.15000000 186188.00
+ CRL1 CTL2 1 0.15380000 186188.00
+ CRL1 CRL2 1 0.15380000 186188.00
+ CTL1 CRL2 1 0.15380000 186188.00
+ CRL2 CRL2 1 0.15300000 186188.00
+ CTL2 CRL2 1 0.15300000 186188.00
+ CRL1 HGA1 1 0.11110000 258571.20
+ CRL2 HGA2 1 0.11110000 258571.20
+ OHL CRL1 1 0.14200000 358150.40
+ CRL1 CTL3 1 0.15380000 186188.00
+ CEL1 CRL2 1 0.15020000 305432.00
+ CEL1 CRL1 1 0.15020000 200832.00
+ CTL2 CG3RC1 1 0.15300000 186188.00
+ CTL3 CG3RC1 1 0.15380000 186188.00
+ CTL3 CG3C31 1 0.15010000 200832.00
+ CTL2 CG3C31 1 0.15010000 200832.00
+ CA ON2B 1 0.13800000 284512.00
+ ON2B P 1 0.16100000 225936.00
+ CT2 P 1 0.18900000 225936.00
+ CT1 ON2 1 0.14330000 259408.00
+ CT2 ON2 1 0.14400000 267776.00
+ CN8B S 1 0.18160000 200832.00
+ CN8B SP 1 0.18160000 165686.40
+ CT2 SP 1 0.18160000 165686.40
+ CT3 SP 1 0.18160000 200832.00
+ CN7B NR1 1 0.14620000 184096.00
+ CC311D NC2D1 1 0.14300000 267776.00
+ CC3162 NC2D1 1 0.14300000 267776.00
+ CC321 CT1 1 0.15380000 186188.00
+ CC2O1 CC321 1 0.15220000 167360.00
+ OC301 CT2 1 0.14250000 301248.00
+ OC301 CT1 1 0.14250000 301248.00
+ OC30P PL 1 0.16750000 225936.00
+ OC2DP PL 1 0.15250000 485344.00
+ OC312 PL 1 0.16100000 198321.60
+ CTL2 OC301 1 0.14150000 301248.00
+
+
+[ constrainttypes ]
+; this section is copied from OPLS. In theory we could recalculate
+; optimal geometries from charmm values, but since pratical equilibrium
+; geometries do not correspond exactly to these values anyway it is not
+; worth the effort...
+#ifdef HEAVY_H
+; account for larger inertia with heavy hydrogens
+; constraints for the rigid NH3 groups
+MNH3 CT1 2 0.191406
+MNH3 CT2 2 0.191406
+MNH3 CT3 2 0.191406
+MNH3 MNH3 2 0.165238
+; constraints for rigid ch3
+MCH3 CT1 2 0.206892
+MCH3 CT2 2 0.206000
+MCH3 CT3 2 0.206179
+MCH3 MCH3 2 0.185689
+MCH3 S 2 0.233335
+#else
+; no heavy hydrogens.
+; constraints for the rigid NH3 groups
+MNH3 CT1 2 0.159603
+MNH3 CT2 2 0.159603
+MNH3 CT3 2 0.159603
+MNH3 MNH3 2 0.082619
+; constraints for rigid ch3
+MCH3 CT1 2 0.168122
+MCH3 CT2 2 0.167162
+MCH3 CT3 2 0.167354
+MCH3 MCH3 2 0.093582
+MCH3 S 2 0.195314
+#endif
+; angle-derived constraints for OH and SH groups in proteins
+; The constraint A-C is calculated from the angle A-B-C and bonds A-B, B-C.
+CA H 2 0.193641
+CD H 2 0.200439
+CT1 H 2 0.192081
+CT2 H 2 0.192081
+CT3 H 2 0.192081
+CT2 HS 2 0.234108
+CT3 HS 2 0.233942
+
+
+
+[ angletypes ]
+; i j k func theta0 ktheta ub0 kub
+ H NH2 CT1 5 111.000000 418.400000 0.00000000 0.00
+ H NH2 CT2 5 111.000000 418.400000 0.00000000 0.00
+ NH2 CT1 CT1 5 110.000000 566.513600 0.00000000 0.00
+ NH2 CT1 CT2 5 110.000000 566.513600 0.00000000 0.00
+ NH2 CT1 CT3 5 110.000000 566.513600 0.00000000 0.00
+ CT1 CD OH1 5 110.500000 460.240000 0.00000000 0.00
+ CT3 CT1 CD 5 108.000000 435.136000 0.00000000 0.00
+ NH2 CT1 HB1 5 109.500000 317.984000 0.21400000 41840.00
+ NH2 CT1 C 5 107.000000 418.400000 0.00000000 0.00
+ NH2 CT2 C 5 107.000000 418.400000 0.00000000 0.00
+ CAI CAI CA 5 120.000000 334.720000 0.24162000 29288.00
+ CAI CA CA 5 120.000000 334.720000 0.24162000 29288.00
+ CPT CA CA 5 113.200000 418.400000 0.00000000 0.00
+ CPT CPT CA 5 110.000000 418.400000 0.00000000 0.00
+ CPT CAI CA 5 113.200000 418.400000 0.00000000 0.00
+ CPT CPT CAI 5 110.000000 418.400000 0.00000000 0.00
+ CPT CY CA 5 106.400000 711.280000 0.22610000 20920.00
+ CPT NY CA 5 112.000000 711.280000 0.00000000 0.00
+ CT2 CY CA 5 127.000000 251.040000 0.00000000 0.00
+ CT2 CY CPT 5 126.700000 251.040000 0.00000000 0.00
+ CT3 CY CA 5 127.000000 251.040000 0.00000000 0.00
+ CT3 CY CPT 5 126.700000 251.040000 0.00000000 0.00
+ CY CPT CA 5 133.500000 1087.840000 0.00000000 0.00
+ CY CPT CAI 5 133.500000 1087.840000 0.00000000 0.00
+ CY CPT CPT 5 108.000000 711.280000 0.00000000 0.00
+ CY CT2 CT1 5 114.000000 488.272800 0.00000000 0.00
+ CY CT2 CT3 5 114.000000 488.272800 0.00000000 0.00
+ H NY CA 5 126.000000 234.304000 0.00000000 0.00
+ H NY CAI 5 126.000000 234.304000 0.00000000 0.00
+ H NY CPT 5 126.000000 234.304000 0.00000000 0.00
+ HA2 CT2 CY 5 109.500000 460.240000 0.00000000 0.00
+ HA3 CT3 CY 5 109.500000 460.240000 0.00000000 0.00
+ HP CA CAI 5 120.000000 251.040000 0.21525000 18409.60
+ HP CAI CA 5 120.000000 251.040000 0.21525000 18409.60
+ HP CA CPT 5 122.000000 251.040000 0.21460000 18409.60
+ HP CAI CPT 5 122.000000 251.040000 0.21460000 18409.60
+ HP CA CY 5 125.000000 267.776000 0.21730000 20920.00
+ HP CY CA 5 126.400000 267.776000 0.21860000 20920.00
+ HP CY CPT 5 126.400000 267.776000 0.22550000 20920.00
+ NY CA CY 5 110.500000 711.280000 0.22400000 20920.00
+ NY CA HP 5 125.000000 267.776000 0.21770000 20920.00
+ NY CPT CA 5 129.500000 1087.840000 0.00000000 0.00
+ NY CPT CAI 5 129.500000 1087.840000 0.00000000 0.00
+ NY CPT CPT 5 107.400000 794.960000 0.00000000 0.00
+ CA CA CA 5 120.000000 334.720000 0.24162000 29288.00
+ CE1 CE1 CT2 5 123.500000 401.664000 0.00000000 0.00
+ CE1 CE1 CT3 5 123.500000 401.664000 0.00000000 0.00
+ CE1 CT2 CT3 5 112.200000 267.776000 0.00000000 0.00
+ CE2 CE1 CT2 5 126.000000 401.664000 0.00000000 0.00
+ CE2 CE1 CT3 5 125.200000 393.296000 0.00000000 0.00
+ CP1 N C 5 117.000000 502.080000 0.00000000 0.00
+ CP2 CP1 C 5 112.300000 435.136000 0.00000000 0.00
+ CP2 CP1 CC 5 112.300000 435.136000 0.00000000 0.00
+ CP2 CP1 CD 5 112.300000 418.400000 0.00000000 0.00
+ CP2 CP2 CP1 5 108.500000 585.760000 0.00000000 0.00
+ CP3 CP2 CP2 5 108.500000 585.760000 0.00000000 0.00
+ CP3 N C 5 117.000000 502.080000 0.00000000 0.00
+ CP3 N CP1 5 114.200000 836.800000 0.00000000 0.00
+ CP3 NP CP1 5 111.000000 836.800000 0.00000000 0.00
+ CPH2 NR1 CPH1 5 107.500000 1087.840000 0.00000000 0.00
+ CPH2 NR2 CPH1 5 104.000000 1087.840000 0.00000000 0.00
+ CPH2 NR3 CPH1 5 108.000000 1213.360000 0.00000000 0.00
+ CT1 CT1 C 5 108.000000 435.136000 0.00000000 0.00
+ CT1 CT1 CC 5 108.000000 435.136000 0.00000000 0.00
+ CT1 CT1 CD 5 108.000000 435.136000 0.00000000 0.00
+ CT1 CT1 CT1 5 111.000000 446.432800 0.25610000 6694.40
+ CT1 CT2 CA 5 107.500000 433.462400 0.00000000 0.00
+ CT1 CT2 CC 5 108.000000 435.136000 0.00000000 0.00
+ CT1 CT2 CD 5 108.000000 435.136000 0.00000000 0.00
+ CT1 CT2 CPH1 5 113.000000 488.272800 0.00000000 0.00
+ CT1 CT2 CT1 5 113.500000 488.272800 0.25610000 9338.69
+ CT1 NH1 C 5 120.000000 418.400000 0.00000000 0.00
+ CT2 CA CA 5 122.300000 383.254400 0.00000000 0.00
+ CT2 CPH1 CPH1 5 130.000000 383.254400 0.00000000 0.00
+ CT2 CT1 C 5 108.000000 435.136000 0.00000000 0.00
+ CT2 CT1 CC 5 108.000000 435.136000 0.00000000 0.00
+ CT2A CT1 CC 5 108.000000 435.136000 0.00000000 0.00
+ CT2 CT1 CD 5 108.000000 435.136000 0.00000000 0.00
+ CT2 CT1 CT1 5 111.000000 446.432800 0.25610000 6694.40
+ CT2 CT2 C 5 108.000000 435.136000 0.00000000 0.00
+ CT2 CT2 CC 5 108.000000 435.136000 0.00000000 0.00
+ CT3 CT2 CC 5 108.000000 435.136000 0.00000000 0.00
+ CT2 CT2 CD 5 108.000000 435.136000 0.00000000 0.00
+ CT2A CT2 CD 5 108.000000 435.136000 0.00000000 0.00
+ CT2 CT2 CT1 5 113.500000 488.272800 0.25610000 9338.69
+ CT2 CT2 CT2 5 113.600000 488.272800 0.25610000 9338.69
+ CT2 CT3 CT1 5 113.500000 488.272800 0.25610000 9338.69
+ CT2 NC2 C 5 120.000000 521.326400 0.00000000 0.00
+ CT2 NH1 C 5 120.000000 418.400000 0.00000000 0.00
+ CT2 OS CD 5 109.600000 334.720000 0.22651000 25104.00
+ CT3 CA CA 5 122.300000 383.254400 0.00000000 0.00
+ CT3 CPH1 CPH1 5 130.000000 383.254400 0.00000000 0.00
+ CT3 CT1 C 5 108.000000 435.136000 0.00000000 0.00
+ CT3 CT1 CC 5 108.000000 435.136000 0.00000000 0.00
+ CT3 CT1 CT1 5 108.500000 446.432800 0.25610000 6694.40
+ CT3 CT1 CT2 5 114.000000 446.432800 0.25610000 6694.40
+ CT3 CT1 CT3 5 114.000000 446.432800 0.25610000 6694.40
+ CT3 CT2 CA 5 107.500000 433.462400 0.00000000 0.00
+ CT3 CT2 CPH1 5 113.000000 488.272800 0.00000000 0.00
+ CT3 CT2 CT1 5 113.500000 488.272800 0.25610000 9338.69
+ CT3 CT2 CT2 5 115.000000 485.344000 0.25610000 6694.40
+ CT3 CT2 CT3 5 114.000000 446.432800 0.25610000 6694.40
+ CT3 NC2 C 5 120.000000 521.326400 0.00000000 0.00
+ CT3 NH1 C 5 120.000000 418.400000 0.00000000 0.00
+ CT3 OS CD 5 109.600000 334.720000 0.22651000 25104.00
+ CT3 S CT2 5 95.000000 284.512000 0.00000000 0.00
+ H NH1 C 5 123.000000 284.512000 0.00000000 0.00
+ H NH1 CT1 5 117.000000 292.880000 0.00000000 0.00
+ H NH1 CT2 5 117.000000 292.880000 0.00000000 0.00
+ H NH1 CT3 5 117.000000 292.880000 0.00000000 0.00
+ H NH2 CC 5 120.000000 418.400000 0.00000000 0.00
+ H NH2 H 5 120.000000 192.464000 0.00000000 0.00
+ H NR1 CPH1 5 125.500000 251.040000 0.21500000 16736.00
+ H NR1 CPH2 5 127.000000 251.040000 0.21400000 16736.00
+ H NR3 CPH1 5 126.000000 209.200000 0.21300000 12552.00
+ H NR3 CPH2 5 126.000000 209.200000 0.20900000 12552.00
+ H OH1 CA 5 108.000000 543.920000 0.00000000 0.00
+ H OH1 CD 5 115.000000 460.240000 0.00000000 0.00
+ H OH1 CT1 5 106.000000 481.160000 0.00000000 0.00
+ H OH1 CT2 5 106.000000 481.160000 0.00000000 0.00
+ H OH1 CT3 5 106.000000 481.160000 0.00000000 0.00
+ HA2 CP2 CP1 5 110.100000 279.742240 0.21790000 18853.10
+ HA2 CP2 CP2 5 110.100000 221.752000 0.21790000 18853.10
+ HA2 CP2 CP3 5 110.100000 221.752000 0.21790000 18853.10
+ HA2 CP2 HA2 5 109.000000 297.064000 0.18020000 4518.72
+ HA2 CP3 CP2 5 110.100000 221.752000 0.21790000 18853.10
+ HA2 CP3 HA2 5 109.000000 297.064000 0.18020000 4518.72
+ HA2 CS CT3 5 110.100000 289.532800 0.21790000 18853.10
+ HA2 CS HA2 5 108.400000 297.064000 0.17750000 11715.20
+ HA3 CS HA3 5 108.400000 297.064000 0.17750000 11715.20
+ HA1 CT1 C 5 109.500000 276.144000 0.21630000 25104.00
+ HA1 CT1 CD 5 109.500000 276.144000 0.21630000 25104.00
+ HA1 CT1 CT1 5 110.100000 288.696000 0.21790000 18853.10
+ HA1 CT1 CT2 5 110.100000 288.696000 0.21790000 18853.10
+ HA1 CT1 CT3 5 110.100000 288.696000 0.21790000 18853.10
+ HA1 CT1 HA1 5 109.000000 297.064000 0.18020000 4518.72
+ HA2 CT2 C 5 109.500000 276.144000 0.21630000 25104.00
+ HA2 CT2 CA 5 107.500000 412.542400 0.00000000 0.00
+ HA2 CT2 CC 5 109.500000 276.144000 0.21630000 25104.00
+ HA2 CT2 CD 5 109.500000 276.144000 0.21630000 25104.00
+ HA2 CT2 CE1 5 111.500000 376.560000 0.00000000 0.00
+ HA2 CT2 CPH1 5 109.500000 279.742240 0.00000000 0.00
+ HA2 CT2 CT1 5 110.100000 221.752000 0.21790000 18853.10
+ HA2 CT2 CT2 5 110.100000 221.752000 0.21790000 18853.10
+ HA2 CT2 CT3 5 110.100000 289.532800 0.21790000 18853.10
+ HA2 CT2 HA2 5 109.000000 297.064000 0.18020000 4518.72
+ HA3 CT3 C 5 109.500000 276.144000 0.21630000 25104.00
+ HA3 CT3 CA 5 107.500000 412.542400 0.00000000 0.00
+ HA3 CT3 CC 5 109.500000 276.144000 0.21630000 25104.00
+ HA3 CT3 CD 5 109.500000 276.144000 0.21630000 25104.00
+ HA3 CT3 CE1 5 111.500000 351.456000 0.00000000 0.00
+ HA3 CT3 CPH1 5 109.500000 279.742240 0.00000000 0.00
+ HA3 CT3 CS 5 110.100000 289.532800 0.21790000 18853.10
+ HA3 CT3 CT1 5 110.100000 279.742240 0.21790000 18853.10
+ HA3 CT3 CT2 5 110.100000 289.532800 0.21790000 18853.10
+ HA3 CT3 CT3 5 110.100000 313.800000 0.21790000 18853.10
+ HA3 CT3 HA3 5 108.400000 297.064000 0.18020000 4518.72
+ HE1 CE1 CE1 5 119.500000 435.136000 0.00000000 0.00
+ HE1 CE1 CE2 5 118.000000 351.456000 0.00000000 0.00
+ HE1 CE1 CT2 5 116.000000 334.720000 0.00000000 0.00
+ HE1 CE1 CT3 5 117.000000 184.096000 0.00000000 0.00
+ HE2 CE2 CE1 5 120.500000 376.560000 0.00000000 0.00
+ HE2 CE2 CE2 5 120.500000 464.424000 0.00000000 0.00
+ HE2 CE2 HE2 5 119.000000 158.992000 0.00000000 0.00
+ HB1 CP1 C 5 112.000000 418.400000 0.00000000 0.00
+ HB1 CP1 CC 5 112.000000 418.400000 0.00000000 0.00
+ HB1 CP1 CD 5 112.000000 418.400000 0.00000000 0.00
+ HB1 CP1 CP2 5 118.000000 292.880000 0.00000000 0.00
+ HB1 CT1 C 5 109.500000 418.400000 0.00000000 0.00
+ HB1 CT1 CC 5 109.500000 418.400000 0.00000000 0.00
+ HB1 CT1 CD 5 109.500000 418.400000 0.00000000 0.00
+ HB1 CT1 CT1 5 111.000000 292.880000 0.00000000 0.00
+ HB1 CT1 CT2 5 111.000000 292.880000 0.00000000 0.00
+ HB1 CT1 CT3 5 111.000000 292.880000 0.00000000 0.00
+ HB2 CT2 C 5 109.500000 418.400000 0.00000000 0.00
+ HB2 CT2 CC 5 109.500000 418.400000 0.00000000 0.00
+ HB2 CT2 CD 5 109.500000 418.400000 0.00000000 0.00
+ HB2 CT2 HB2 5 115.000000 301.248000 0.00000000 0.00
+ HC NC2 C 5 120.000000 410.032000 0.00000000 0.00
+ HC NC2 CT2 5 120.000000 338.067200 0.00000000 0.00
+ HC NC2 CT3 5 120.000000 338.067200 0.00000000 0.00
+ HC NC2 HC 5 120.000000 209.200000 0.00000000 0.00
+ HC NH2 CT2 5 111.000000 418.400000 0.00000000 0.00
+ HC NH2 CT3 5 111.000000 418.400000 0.00000000 0.00
+ HC NH2 HC 5 106.500000 326.352000 0.00000000 0.00
+ HC NH3 CT1 5 109.500000 251.040000 0.20740000 16736.00
+ HC NH3 CT2 5 109.500000 251.040000 0.20740000 16736.00
+ HC NH3 CT3 5 109.500000 251.040000 0.20740000 16736.00
+ HC NH3 HC 5 109.500000 368.192000 0.00000000 0.00
+ HC NP CP1 5 109.500000 276.144000 0.20560000 3347.20
+ HC NP CP3 5 109.500000 276.144000 0.20560000 3347.20
+ HC NP HC 5 107.500000 426.768000 0.00000000 0.00
+ HP CA CA 5 120.000000 251.040000 0.21525000 18409.60
+ HR1 CPH1 CPH1 5 130.000000 184.096000 0.22150000 12552.00
+ HR3 CPH1 CPH1 5 130.000000 209.200000 0.22000000 16736.00
+ HS S CT2 5 95.000000 324.678400 0.00000000 0.00
+ HS S CT3 5 95.000000 359.824000 0.00000000 0.00
+ N C CP1 5 112.500000 167.360000 0.00000000 0.00
+ N C CT1 5 112.500000 167.360000 0.00000000 0.00
+ N C CT2 5 112.500000 167.360000 0.00000000 0.00
+ N C CT3 5 112.500000 167.360000 0.00000000 0.00
+ N CP1 C 5 108.200000 418.400000 0.00000000 0.00
+ N CP1 CC 5 108.200000 418.400000 0.00000000 0.00
+ N CP1 CD 5 108.200000 418.400000 0.00000000 0.00
+ N CP1 CP2 5 110.800000 585.760000 0.00000000 0.00
+ N CP1 HB1 5 112.000000 401.664000 0.00000000 0.00
+ N CP3 CP2 5 110.500000 585.760000 0.00000000 0.00
+ N CP3 HA2 5 108.000000 401.664000 0.00000000 0.00
+ NC2 C NC2 5 120.000000 334.720000 0.23100000 58576.00
+ NC2 CT2 CT2 5 107.500000 566.513600 0.00000000 0.00
+ NC2 CT2 HA2 5 107.500000 472.792000 0.00000000 0.00
+ NC2 CT3 HA3 5 107.500000 472.792000 0.00000000 0.00
+ NH1 C CP1 5 116.500000 669.440000 0.00000000 0.00
+ NH1 C CT1 5 116.500000 669.440000 0.00000000 0.00
+ NH1 C CT2 5 116.500000 669.440000 0.00000000 0.00
+ NH1 C CT3 5 116.500000 669.440000 0.00000000 0.00
+ NH1 CT1 C 5 107.000000 418.400000 0.00000000 0.00
+ NH1 CT1 CC 5 107.000000 418.400000 0.00000000 0.00
+ NH1 CT1 CD 5 107.000000 418.400000 0.00000000 0.00
+ NH1 CT1 CT1 5 113.500000 585.760000 0.00000000 0.00
+ NH1 CT1 CT2 5 113.500000 585.760000 0.00000000 0.00
+ NH1 CT1 CT3 5 113.500000 585.760000 0.00000000 0.00
+ NH1 CT1 HB1 5 108.000000 401.664000 0.00000000 0.00
+ NH1 CT2 C 5 107.000000 418.400000 0.00000000 0.00
+ NH1 CT2 CC 5 107.000000 418.400000 0.00000000 0.00
+ NH1 CT2 CD 5 107.000000 418.400000 0.00000000 0.00
+ NH1 CT2 CT2 5 113.500000 585.760000 0.00000000 0.00
+ NH1 CT2 HA2 5 109.500000 430.952000 0.00000000 0.00
+ NH1 CT2 HB2 5 108.000000 401.664000 0.00000000 0.00
+ NH1 CT3 HA3 5 109.500000 430.952000 0.00000000 0.00
+ NH2 CC CP1 5 112.500000 669.440000 0.00000000 0.00
+ NH2 CC CT1 5 116.500000 418.400000 0.24500000 41840.00
+ NH2 CC CT2 5 116.500000 418.400000 0.24500000 41840.00
+ NH2 CC CT3 5 116.500000 418.400000 0.24500000 41840.00
+ NH2 CC HA1 5 111.000000 368.192000 0.19800000 41840.00
+ NH2 CT2 HB2 5 109.500000 317.984000 0.21400000 41840.00
+ NH2 CT2 CD 5 108.000000 435.136000 0.00000000 0.00
+ NH2 CT2 CT2 5 110.000000 566.513600 0.00000000 0.00
+ NH2 CT2 HA2 5 109.500000 317.984000 0.21400000 41840.00
+ NH2 CT3 HA3 5 109.500000 317.984000 0.21400000 41840.00
+ NH3 CT1 C 5 110.000000 365.681600 0.00000000 0.00
+ NH3 CT1 CC 5 110.000000 365.681600 0.00000000 0.00
+ NH3 CT1 CT1 5 110.000000 566.513600 0.00000000 0.00
+ NH3 CT1 CT2 5 110.000000 566.513600 0.00000000 0.00
+ NH3 CT1 CT3 5 110.000000 566.513600 0.00000000 0.00
+ NH3 CT1 HB1 5 107.500000 430.952000 0.00000000 0.00
+ NH3 CT2 C 5 110.000000 365.681600 0.00000000 0.00
+ NH3 CT2 CC 5 110.000000 365.681600 0.00000000 0.00
+ NH3 CT2 CD 5 110.000000 365.681600 0.00000000 0.00
+ NH3 CT2 CT2 5 110.000000 566.513600 0.00000000 0.00
+ NH3 CT2 CT3 5 110.000000 566.513600 0.00000000 0.00
+ NH3 CT2 HA2 5 107.500000 376.560000 0.21010000 29288.00
+ NH3 CT2 HB2 5 107.500000 430.952000 0.00000000 0.00
+ NH3 CT3 HA3 5 107.500000 376.560000 0.21010000 29288.00
+ NP CP1 C 5 106.000000 418.400000 0.00000000 0.00
+ NP CP1 CC 5 106.000000 418.400000 0.00000000 0.00
+ NP CP1 CD 5 106.000000 418.400000 0.00000000 0.00
+ NP CP1 CP2 5 108.500000 585.760000 0.00000000 0.00
+ NP CP1 HB1 5 107.500000 430.952000 0.00000000 0.00
+ NP CP3 CP2 5 108.500000 585.760000 0.00000000 0.00
+ NP CP3 HA2 5 109.150000 430.952000 0.00000000 0.00
+ NR1 CPH1 CPH1 5 106.000000 1087.840000 0.00000000 0.00
+ NR1 CPH1 CT2 5 124.000000 383.254400 0.00000000 0.00
+ NR1 CPH1 CT3 5 124.000000 383.254400 0.00000000 0.00
+ NR1 CPH1 HR3 5 124.000000 209.200000 0.21400000 16736.00
+ NR1 CPH2 HR1 5 122.500000 209.200000 0.21400000 16736.00
+ NR2 CPH1 CPH1 5 110.000000 1087.840000 0.00000000 0.00
+ NR2 CPH1 CT2 5 120.000000 383.254400 0.00000000 0.00
+ NR2 CPH1 HR3 5 120.000000 209.200000 0.21400000 16736.00
+ NR2 CPH2 HR1 5 125.000000 209.200000 0.21200000 16736.00
+ NR2 CPH2 NR1 5 112.500000 1087.840000 0.00000000 0.00
+ NR3 CPH1 CPH1 5 108.000000 1213.360000 0.00000000 0.00
+ NR3 CPH1 CT2 5 122.000000 383.254400 0.00000000 0.00
+ NR3 CPH1 HR1 5 122.000000 184.096000 0.21800000 12552.00
+ NR3 CPH2 HR2 5 126.000000 267.776000 0.21400000 20920.00
+ NR3 CPH2 NR3 5 108.000000 1213.360000 0.00000000 0.00
+ O C CP1 5 118.000000 669.440000 0.00000000 0.00
+ O C CT1 5 121.000000 669.440000 0.00000000 0.00
+ O C CT2 5 121.000000 669.440000 0.00000000 0.00
+ O C CT3 5 121.000000 669.440000 0.00000000 0.00
+ O C H 5 121.700000 418.400000 0.00000000 0.00
+ O C N 5 122.500000 669.440000 0.00000000 0.00
+ O C NH1 5 122.500000 669.440000 0.00000000 0.00
+ O CC CP1 5 118.000000 669.440000 0.00000000 0.00
+ O CC CT1 5 121.000000 125.520000 0.24400000 41840.00
+ O CC CT2 5 121.000000 125.520000 0.24400000 41840.00
+ O CC CT3 5 121.000000 125.520000 0.24400000 41840.00
+ O CC HA1 5 122.000000 368.192000 0.00000000 0.00
+ O CC NH2 5 122.500000 627.600000 0.23700000 41840.00
+ OB CD CP1 5 125.000000 585.760000 0.24420000 16736.00
+ OB CD CT1 5 125.000000 585.760000 0.24420000 16736.00
+ OB CD CT2 5 125.000000 585.760000 0.24420000 16736.00
+ OB CD CT3 5 125.000000 585.760000 0.24420000 16736.00
+ OC CA CA 5 120.000000 334.720000 0.00000000 0.00
+ OC CC CP1 5 118.000000 334.720000 0.23880000 41840.00
+ OC CC CT1 5 118.000000 334.720000 0.23880000 41840.00
+ OC CC CT2 5 118.000000 334.720000 0.23880000 41840.00
+ OC CC CT3 5 118.000000 334.720000 0.23880000 41840.00
+ OC CC OC 5 124.000000 836.800000 0.22250000 58576.00
+ OC CT2 CT3 5 122.000000 543.920000 0.00000000 0.00
+ OC CT2 HA2 5 118.300000 543.920000 0.00000000 0.00
+ OC CT3 HA3 5 118.300000 543.920000 0.00000000 0.00
+ OH1 CA CA 5 120.000000 378.233600 0.00000000 0.00
+ OH1 CD CT2 5 110.500000 460.240000 0.00000000 0.00
+ OH1 CD CT3 5 110.500000 460.240000 0.00000000 0.00
+ OH1 CD OB 5 123.000000 418.400000 0.22620000 175728.00
+ OH1 CT1 CT1 5 110.100000 633.457600 0.00000000 0.00
+ OH1 CT1 CT3 5 110.100000 633.457600 0.00000000 0.00
+ OH1 CT1 HA1 5 108.890000 384.091200 0.00000000 0.00
+ OH1 CT2 CT1 5 110.100000 633.457600 0.00000000 0.00
+ OH1 CT2 CT2 5 110.100000 633.457600 0.00000000 0.00
+ OH1 CT2 CT3 5 110.100000 633.457600 0.00000000 0.00
+ OH1 CT2 HA2 5 108.890000 384.091200 0.00000000 0.00
+ OH1 CT3 HA3 5 108.890000 384.091200 0.00000000 0.00
+ OS CD CP1 5 109.000000 460.240000 0.23260000 16736.00
+ OS CD CT1 5 109.000000 460.240000 0.23260000 16736.00
+ OS CD CT2 5 109.000000 460.240000 0.23260000 16736.00
+ OS CD CT3 5 109.000000 460.240000 0.23260000 16736.00
+ OS CD OB 5 125.900000 753.120000 0.22576000 133888.00
+ OS CT2 HA2 5 109.500000 502.080000 0.00000000 0.00
+ OS CT3 HA3 5 109.500000 502.080000 0.00000000 0.00
+ S CT2 CT1 5 112.500000 485.344000 0.00000000 0.00
+ S CT2 CT2 5 114.500000 485.344000 0.00000000 0.00
+ S CT2 CT3 5 114.500000 485.344000 0.00000000 0.00
+ S CT2 HA2 5 111.300000 385.764800 0.00000000 0.00
+ S CT3 HA3 5 111.300000 385.764800 0.00000000 0.00
+ SM CT2 CT1 5 112.500000 485.344000 0.00000000 0.00
+ SM CT2 CT3 5 112.500000 485.344000 0.00000000 0.00
+ SM CT2 HA2 5 111.000000 317.984000 0.00000000 0.00
+ SM CT3 HA3 5 111.000000 317.984000 0.00000000 0.00
+ SM SM CT2 5 103.300000 606.680000 0.00000000 0.00
+ SM SM CT3 5 103.300000 606.680000 0.00000000 0.00
+ SS CS CT3 5 118.000000 460.240000 0.00000000 0.00
+ SS CS HA2 5 112.300000 334.720000 0.00000000 0.00
+ SS CS HA3 5 112.300000 334.720000 0.00000000 0.00
+ O CD HR1 5 121.000000 627.600000 0.00000000 0.00
+ NH1 CT1 CT2A 5 113.500000 585.760000 0.00000000 0.00
+ HB1 CT1 CT2A 5 111.000000 292.880000 0.00000000 0.00
+ CT2A CT1 C 5 108.000000 435.136000 0.00000000 0.00
+ CT1 CT2A HA2 5 110.100000 221.752000 0.21790000 18853.10
+ CT1 CT2A CT2 5 113.500000 488.272800 0.25610000 9338.69
+ HA2 CT2A HA2 5 109.000000 297.064000 0.18020000 4518.72
+ HA2 CT2A CT2 5 110.100000 221.752000 0.21790000 18853.10
+ CT2A CT2 HA2 5 110.100000 221.752000 0.21790000 18853.10
+ CT2A CT2 CC 5 108.000000 435.136000 0.00000000 0.00
+ CT1 CT2A CPH1 5 113.000000 488.272800 0.00000000 0.00
+ HA2 CT2A CPH1 5 109.500000 279.742240 0.00000000 0.00
+ CT2A CPH1 CPH1 5 130.000000 383.254400 0.00000000 0.00
+ CT2A CPH1 NR3 5 122.000000 383.254400 0.00000000 0.00
+ CT1 CT2A CC 5 108.000000 435.136000 0.00000000 0.00
+ HA2 CT2A CC 5 109.500000 276.144000 0.21630000 25104.00
+ OC CC CT2A 5 118.000000 334.720000 0.23880000 41840.00
+ NH3 CT1 CT2A 5 110.000000 566.513600 0.00000000 0.00
+ CT2A CT1 CD 5 108.000000 435.136000 0.00000000 0.00
+ HT OT HT 5 104.520000 460.240000 0.00000000 0.00
+ CG2R61 CG1N1 NG1T1 5 180.000000 334.720000 0.00000000 0.00
+ CG331 CG1N1 NG1T1 5 180.000000 177.401600 0.00000000 0.00
+ CG1T1 CG1T1 CG331 5 180.000000 158.992000 0.00000000 0.00
+ CG1T2 CG1T1 CG331 5 180.000000 92.048000 0.00000000 0.00
+ CG1T1 CG1T2 HGPAM1 5 180.000000 66.944000 0.00000000 0.00
+ CG25C1 CG251O CG2R53 5 125.000000 334.720000 0.00000000 0.00
+ CG25C1 CG251O NG2R53 5 124.000000 334.720000 0.00000000 0.00
+ CG25C1 CG251O SG311 5 124.000000 334.720000 0.00000000 0.00
+ CG2DC3 CG251O CG2R53 5 119.000000 334.720000 0.00000000 0.00
+ CG2DC3 CG251O NG2R53 5 130.000000 334.720000 0.00000000 0.00
+ CG2DC3 CG251O SG311 5 130.000000 334.720000 0.00000000 0.00
+ CG2R53 CG251O NG2R53 5 111.000000 970.688000 0.00000000 0.00
+ CG2R53 CG251O SG311 5 111.000000 920.480000 0.00000000 0.00
+ CG25C2 CG252O CG2R53 5 125.000000 334.720000 0.00000000 0.00
+ CG25C2 CG252O NG2R53 5 124.000000 334.720000 0.00000000 0.00
+ CG25C2 CG252O SG311 5 124.000000 334.720000 0.00000000 0.00
+ CG2DC3 CG252O CG2R53 5 119.000000 334.720000 0.00000000 0.00
+ CG2DC3 CG252O NG2R53 5 130.000000 334.720000 0.00000000 0.00
+ CG2DC3 CG252O SG311 5 130.000000 334.720000 0.00000000 0.00
+ CG2R53 CG252O NG2R53 5 111.000000 970.688000 0.00000000 0.00
+ CG2R53 CG252O SG311 5 111.000000 920.480000 0.00000000 0.00
+ CG251O CG25C1 CG2R53 5 113.000000 276.144000 0.00000000 0.00
+ CG251O CG25C1 CG2RC0 5 131.500000 276.144000 0.00000000 0.00
+ CG2DC3 CG25C1 CG2R53 5 115.500000 276.144000 0.00000000 0.00
+ CG2DC3 CG25C1 CG2RC0 5 130.000000 276.144000 0.00000000 0.00
+ CG2R53 CG25C1 CG2RC0 5 114.500000 376.560000 0.00000000 0.00
+ CG252O CG25C2 CG2R53 5 113.000000 276.144000 0.00000000 0.00
+ CG252O CG25C2 CG2RC0 5 131.500000 276.144000 0.00000000 0.00
+ CG2DC3 CG25C2 CG2R53 5 115.500000 276.144000 0.00000000 0.00
+ CG2DC3 CG25C2 CG2RC0 5 130.000000 276.144000 0.00000000 0.00
+ CG2R53 CG25C2 CG2RC0 5 114.500000 376.560000 0.00000000 0.00
+ CG2D1 CG2D1 CG301 5 123.500000 401.664000 0.00000000 0.00
+ CG2D1 CG2D1 CG321 5 123.500000 401.664000 0.00000000 0.00
+ CG2D1 CG2D1 CG331 5 123.500000 401.664000 0.00000000 0.00
+ CG2D1 CG2D1 HGA4 5 119.500000 435.136000 0.00000000 0.00
+ CG2D1O CG2D1 CG321 5 127.500000 334.720000 0.00000000 0.00
+ CG2D1O CG2D1 HGA4 5 119.500000 435.136000 0.00000000 0.00
+ CG2D2 CG2D1 CG321 5 126.000000 401.664000 0.00000000 0.00
+ CG2D2 CG2D1 CG331 5 125.200000 393.296000 0.00000000 0.00
+ CG2D2 CG2D1 HGA4 5 118.000000 351.456000 0.00000000 0.00
+ CG2D2O CG2D1 CG321 5 127.500000 334.720000 0.00000000 0.00
+ CG2D2O CG2D1 HGA4 5 119.500000 435.136000 0.00000000 0.00
+ CG301 CG2D1 CG321 5 113.000000 418.400000 0.00000000 0.00
+ CG301 CG2D1 CG331 5 123.500000 401.664000 0.00000000 0.00
+ CG321 CG2D1 CG331 5 123.500000 401.664000 0.00000000 0.00
+ CG321 CG2D1 HGA4 5 116.000000 334.720000 0.00000000 0.00
+ CG331 CG2D1 NG2D1 5 123.000000 669.440000 0.00000000 0.00
+ CG331 CG2D1 NG2P1 5 125.600000 393.296000 0.00000000 0.00
+ CG331 CG2D1 HGA4 5 117.000000 184.096000 0.00000000 0.00
+ CG331 CG2D1 HGR52 5 120.400000 351.456000 0.00000000 0.00
+ NG2D1 CG2D1 HGA4 5 119.500000 410.032000 0.00000000 0.00
+ NG2P1 CG2D1 HGR52 5 114.000000 326.352000 0.00000000 0.00
+ CG2D1 CG2D1O NG301 5 122.000000 502.080000 0.00000000 0.00
+ CG2D1 CG2D1O NG311 5 122.000000 502.080000 0.00000000 0.00
+ CG2D1 CG2D1O OG3R60 5 126.000000 334.720000 0.00000000 0.00
+ CG2D1 CG2D1O HGA4 5 122.000000 435.136000 0.00000000 0.00
+ CG2D2 CG2D1O NG321 5 128.000000 669.440000 0.00000000 0.00
+ CG2D2 CG2D1O OG301 5 123.500000 543.920000 0.00000000 0.00
+ CG2D2 CG2D1O HGA4 5 121.000000 368.192000 0.00000000 0.00
+ CG2DC1 CG2D1O NG301 5 122.000000 502.080000 0.00000000 0.00
+ CG2DC1 CG2D1O NG311 5 122.000000 502.080000 0.00000000 0.00
+ CG2DC1 CG2D1O OG301 5 124.500000 468.608000 0.00000000 0.00
+ CG2DC1 CG2D1O OG3R60 5 128.000000 334.720000 0.00000000 0.00
+ CG2DC1 CG2D1O HGA4 5 120.000000 351.456000 0.00000000 0.00
+ NG301 CG2D1O HGA4 5 119.000000 351.456000 0.00000000 0.00
+ NG311 CG2D1O HGA4 5 119.000000 351.456000 0.00000000 0.00
+ NG321 CG2D1O HGA4 5 113.000000 251.040000 0.00000000 0.00
+ OG301 CG2D1O HGA4 5 115.500000 251.040000 0.00000000 0.00
+ OG3R60 CG2D1O HGA4 5 112.000000 251.040000 0.00000000 0.00
+ CG2D1 CG2D2 HGA5 5 120.500000 376.560000 0.00000000 0.00
+ CG2D1O CG2D2 HGA5 5 120.500000 292.880000 0.00000000 0.00
+ CG2D2 CG2D2 HGA5 5 120.500000 464.424000 0.00000000 0.00
+ CG2D2O CG2D2 HGA5 5 120.500000 292.880000 0.00000000 0.00
+ HGA5 CG2D2 HGA5 5 119.000000 158.992000 0.00000000 0.00
+ CG2D1 CG2D2O NG301 5 122.000000 502.080000 0.00000000 0.00
+ CG2D1 CG2D2O NG311 5 122.000000 502.080000 0.00000000 0.00
+ CG2D1 CG2D2O OG3R60 5 126.000000 334.720000 0.00000000 0.00
+ CG2D1 CG2D2O HGA4 5 122.000000 435.136000 0.00000000 0.00
+ CG2D2 CG2D2O NG321 5 128.000000 669.440000 0.00000000 0.00
+ CG2D2 CG2D2O OG301 5 123.500000 543.920000 0.00000000 0.00
+ CG2D2 CG2D2O HGA4 5 121.000000 368.192000 0.00000000 0.00
+ CG2DC2 CG2D2O NG301 5 122.000000 502.080000 0.00000000 0.00
+ CG2DC2 CG2D2O NG311 5 122.000000 502.080000 0.00000000 0.00
+ CG2DC2 CG2D2O OG301 5 124.500000 468.608000 0.00000000 0.00
+ CG2DC2 CG2D2O OG3R60 5 128.000000 334.720000 0.00000000 0.00
+ CG2DC2 CG2D2O HGA4 5 120.000000 351.456000 0.00000000 0.00
+ NG301 CG2D2O HGA4 5 119.000000 351.456000 0.00000000 0.00
+ NG311 CG2D2O HGA4 5 119.000000 351.456000 0.00000000 0.00
+ NG321 CG2D2O HGA4 5 113.000000 251.040000 0.00000000 0.00
+ OG301 CG2D2O HGA4 5 115.500000 251.040000 0.00000000 0.00
+ OG3R60 CG2D2O HGA4 5 112.000000 251.040000 0.00000000 0.00
+ CG2D1O CG2DC1 CG2DC2 5 120.000000 401.664000 0.00000000 0.00
+ CG2D1O CG2DC1 CG2O1 5 113.000000 543.920000 0.00000000 0.00
+ CG2D1O CG2DC1 CG321 5 126.500000 364.008000 0.00000000 0.00
+ CG2D1O CG2DC1 HGA4 5 122.000000 351.456000 0.00000000 0.00
+ CG2DC1 CG2DC1 CG2DC2 5 123.000000 401.664000 0.00000000 0.00
+ CG2DC1 CG2DC1 CG2O1 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC1 CG2DC1 CG2O3 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC1 CG2DC1 CG2O4 5 120.000000 502.080000 0.00000000 0.00
+ CG2DC1 CG2DC1 CG301 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC1 CG2DC1 CG321 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC1 CG2DC1 CG331 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC1 CG2DC1 HGA4 5 119.000000 351.456000 0.00000000 0.00
+ CG2DC2 CG2DC1 CG2DC3 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC2 CG2DC1 CG301 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC2 CG2DC1 CG331 5 113.000000 401.664000 0.00000000 0.00
+ CG2DC2 CG2DC1 NG2P1 5 125.600000 334.720000 0.00000000 0.00
+ CG2DC2 CG2DC1 HGA4 5 118.000000 351.456000 0.00000000 0.00
+ CG2DC2 CG2DC1 HGR52 5 120.400000 351.456000 0.00000000 0.00
+ CG2DC3 CG2DC1 CG2O3 5 119.000000 334.720000 0.25267000 29288.00
+ CG2DC3 CG2DC1 CG2O4 5 120.000000 502.080000 0.00000000 0.00
+ CG2DC3 CG2DC1 CG2O5 5 118.600000 292.880000 0.00000000 0.00
+ CG2DC3 CG2DC1 CG2R61 5 122.000000 242.672000 0.00000000 0.00
+ CG2DC3 CG2DC1 CG331 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC3 CG2DC1 HGA4 5 118.000000 351.456000 0.00000000 0.00
+ CG2O1 CG2DC1 CG321 5 123.500000 543.920000 0.00000000 0.00
+ CG2O1 CG2DC1 HGA4 5 119.500000 435.136000 0.00000000 0.00
+ CG2O3 CG2DC1 HGA4 5 119.500000 435.136000 0.00000000 0.00
+ CG2O4 CG2DC1 HGA4 5 122.000000 267.776000 0.00000000 0.00
+ CG2O5 CG2DC1 HGA4 5 123.400000 267.776000 0.00000000 0.00
+ CG2R61 CG2DC1 NG2D1 5 117.000000 468.608000 0.00000000 0.00
+ CG2R61 CG2DC1 HGA4 5 120.000000 267.776000 0.00000000 0.00
+ CG321 CG2DC1 CG331 5 123.500000 401.664000 0.00000000 0.00
+ CG321 CG2DC1 HGA4 5 116.000000 334.720000 0.00000000 0.00
+ CG331 CG2DC1 CG331 5 113.000000 393.296000 0.00000000 0.00
+ CG331 CG2DC1 HGA4 5 117.500000 351.456000 0.00000000 0.00
+ NG2D1 CG2DC1 HGA4 5 123.000000 317.984000 0.00000000 0.00
+ NG2P1 CG2DC1 HGR52 5 114.000000 317.984000 0.00000000 0.00
+ CG2D2O CG2DC2 CG2DC1 5 120.000000 401.664000 0.00000000 0.00
+ CG2D2O CG2DC2 CG2O1 5 113.000000 543.920000 0.00000000 0.00
+ CG2D2O CG2DC2 CG321 5 126.500000 364.008000 0.00000000 0.00
+ CG2D2O CG2DC2 HGA4 5 122.000000 351.456000 0.00000000 0.00
+ CG2DC1 CG2DC2 CG2DC2 5 123.000000 401.664000 0.00000000 0.00
+ CG2DC1 CG2DC2 CG2DC3 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC1 CG2DC2 CG301 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC1 CG2DC2 CG331 5 113.000000 401.664000 0.00000000 0.00
+ CG2DC1 CG2DC2 NG2P1 5 125.600000 334.720000 0.00000000 0.00
+ CG2DC1 CG2DC2 HGA4 5 118.000000 351.456000 0.00000000 0.00
+ CG2DC1 CG2DC2 HGR52 5 120.400000 351.456000 0.00000000 0.00
+ CG2DC2 CG2DC2 CG2O1 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC2 CG2DC2 CG2O3 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC2 CG2DC2 CG2O4 5 120.000000 502.080000 0.00000000 0.00
+ CG2DC2 CG2DC2 CG301 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC2 CG2DC2 CG321 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC2 CG2DC2 CG331 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC2 CG2DC2 HGA4 5 119.000000 351.456000 0.00000000 0.00
+ CG2DC3 CG2DC2 CG2O3 5 119.000000 334.720000 0.25267000 29288.00
+ CG2DC3 CG2DC2 CG2O4 5 120.000000 502.080000 0.00000000 0.00
+ CG2DC3 CG2DC2 CG2O5 5 118.600000 292.880000 0.00000000 0.00
+ CG2DC3 CG2DC2 CG2R61 5 122.000000 242.672000 0.00000000 0.00
+ CG2DC3 CG2DC2 CG331 5 123.500000 401.664000 0.00000000 0.00
+ CG2DC3 CG2DC2 HGA4 5 118.000000 351.456000 0.00000000 0.00
+ CG2O1 CG2DC2 CG321 5 123.500000 543.920000 0.00000000 0.00
+ CG2O1 CG2DC2 HGA4 5 119.500000 435.136000 0.00000000 0.00
+ CG2O3 CG2DC2 HGA4 5 119.500000 435.136000 0.00000000 0.00
+ CG2O4 CG2DC2 HGA4 5 122.000000 267.776000 0.00000000 0.00
+ CG2O5 CG2DC2 HGA4 5 123.400000 267.776000 0.00000000 0.00
+ CG2R61 CG2DC2 NG2D1 5 117.000000 468.608000 0.00000000 0.00
+ CG2R61 CG2DC2 HGA4 5 120.000000 267.776000 0.00000000 0.00
+ CG321 CG2DC2 CG331 5 123.500000 401.664000 0.00000000 0.00
+ CG321 CG2DC2 HGA4 5 116.000000 334.720000 0.00000000 0.00
+ CG331 CG2DC2 CG331 5 113.000000 393.296000 0.00000000 0.00
+ CG331 CG2DC2 HGA4 5 117.500000 351.456000 0.00000000 0.00
+ NG2D1 CG2DC2 HGA4 5 123.000000 317.984000 0.00000000 0.00
+ NG2P1 CG2DC2 HGR52 5 114.000000 317.984000 0.00000000 0.00
+ CG251O CG2DC3 HGA5 5 120.500000 292.880000 0.00000000 0.00
+ CG252O CG2DC3 HGA5 5 120.500000 292.880000 0.00000000 0.00
+ CG25C1 CG2DC3 HGA5 5 120.500000 376.560000 0.00000000 0.00
+ CG25C2 CG2DC3 HGA5 5 120.500000 376.560000 0.00000000 0.00
+ CG2DC1 CG2DC3 HGA5 5 120.500000 376.560000 0.00000000 0.00
+ CG2DC2 CG2DC3 HGA5 5 120.500000 376.560000 0.00000000 0.00
+ HGA5 CG2DC3 HGA5 5 119.000000 158.992000 0.00000000 0.00
+ NG2D1 CG2N1 NG311 5 125.000000 418.400000 0.00000000 0.00
+ NG2D1 CG2N1 NG321 5 125.000000 836.800000 0.00000000 0.00
+ NG2P1 CG2N1 NG2P1 5 120.000000 435.136000 0.23642000 75312.00
+ NG311 CG2N1 NG321 5 113.000000 418.400000 0.00000000 0.00
+ NG321 CG2N1 NG321 5 113.000000 627.600000 0.00000000 0.00
+ CG2R61 CG2N2 NG2P1 5 118.500000 669.440000 0.00000000 0.00
+ CG331 CG2N2 NG2P1 5 118.500000 435.136000 0.00000000 0.00
+ NG2P1 CG2N2 NG2P1 5 123.000000 435.136000 0.23642000 75312.00
+ CG2DC1 CG2O1 NG2S1 5 116.500000 669.440000 0.00000000 0.00
+ CG2DC1 CG2O1 NG2S2 5 113.000000 711.280000 0.24600000 66944.00
+ CG2DC1 CG2O1 OG2D1 5 122.500000 669.440000 0.00000000 0.00
+ CG2DC2 CG2O1 NG2S1 5 116.500000 669.440000 0.00000000 0.00
+ CG2DC2 CG2O1 NG2S2 5 113.000000 711.280000 0.24600000 66944.00
+ CG2DC2 CG2O1 OG2D1 5 122.500000 669.440000 0.00000000 0.00
+ CG2R61 CG2O1 NG2S1 5 116.500000 669.440000 0.00000000 0.00
+ CG2R61 CG2O1 NG2S2 5 110.230000 418.400000 0.00000000 0.00
+ CG2R61 CG2O1 OG2D1 5 121.000000 251.040000 0.00000000 0.00
+ CG2R62 CG2O1 NG2S2 5 113.000000 711.280000 0.24600000 66944.00
+ CG2R62 CG2O1 OG2D1 5 118.500000 711.280000 0.24300000 16736.00
+ CG311 CG2O1 NG2S0 5 112.500000 167.360000 0.00000000 0.00
+ CG311 CG2O1 NG2S1 5 116.500000 669.440000 0.00000000 0.00
+ CG311 CG2O1 NG2S2 5 116.500000 418.400000 0.24500000 41840.00
+ CG311 CG2O1 OG2D1 5 121.000000 669.440000 0.00000000 0.00
+ CG314 CG2O1 NG2S0 5 112.500000 167.360000 0.00000000 0.00
+ CG314 CG2O1 NG2S1 5 116.500000 669.440000 0.00000000 0.00
+ CG314 CG2O1 NG2S2 5 116.500000 418.400000 0.24500000 41840.00
+ CG314 CG2O1 OG2D1 5 121.000000 669.440000 0.00000000 0.00
+ CG321 CG2O1 NG2S0 5 112.500000 167.360000 0.00000000 0.00
+ CG321 CG2O1 NG2S1 5 116.500000 669.440000 0.00000000 0.00
+ CG321 CG2O1 NG2S2 5 116.500000 418.400000 0.24500000 41840.00
+ CG321 CG2O1 OG2D1 5 121.000000 669.440000 0.00000000 0.00
+ CG324 CG2O1 NG2S0 5 112.500000 167.360000 0.00000000 0.00
+ CG324 CG2O1 NG2S1 5 116.500000 669.440000 0.00000000 0.00
+ CG324 CG2O1 NG2S2 5 116.500000 418.400000 0.24500000 41840.00
+ CG324 CG2O1 OG2D1 5 121.000000 669.440000 0.00000000 0.00
+ CG331 CG2O1 NG2S0 5 115.000000 334.720000 0.00000000 0.00
+ CG331 CG2O1 NG2S1 5 116.500000 669.440000 0.00000000 0.00
+ CG331 CG2O1 NG2S2 5 116.500000 418.400000 0.24500000 41840.00
+ CG331 CG2O1 OG2D1 5 121.000000 669.440000 0.00000000 0.00
+ CG3C51 CG2O1 NG2S0 5 112.500000 167.360000 0.00000000 0.00
+ CG3C51 CG2O1 NG2S1 5 116.500000 669.440000 0.00000000 0.00
+ CG3C51 CG2O1 NG2S2 5 112.500000 669.440000 0.00000000 0.00
+ CG3C51 CG2O1 OG2D1 5 118.000000 669.440000 0.00000000 0.00
+ CG3C53 CG2O1 NG2S0 5 112.500000 167.360000 0.00000000 0.00
+ CG3C53 CG2O1 NG2S1 5 116.500000 669.440000 0.00000000 0.00
+ CG3C53 CG2O1 NG2S2 5 112.500000 669.440000 0.00000000 0.00
+ CG3C53 CG2O1 OG2D1 5 118.000000 669.440000 0.00000000 0.00
+ NG2S0 CG2O1 OG2D1 5 124.000000 669.440000 0.00000000 0.00
+ NG2S0 CG2O1 HGR52 5 115.000000 359.824000 0.00000000 0.00
+ NG2S1 CG2O1 OG2D1 5 122.500000 669.440000 0.00000000 0.00
+ NG2S2 CG2O1 OG2D1 5 122.500000 627.600000 0.23700000 41840.00
+ NG2S2 CG2O1 HGR52 5 111.000000 368.192000 0.19800000 41840.00
+ OG2D1 CG2O1 HGR52 5 122.000000 368.192000 0.00000000 0.00
+ CG2R61 CG2O2 OG2D1 5 123.100000 585.760000 0.24420000 16736.00
+ CG2R61 CG2O2 OG302 5 111.000000 418.400000 0.23600000 16736.00
+ CG2R61 CG2O2 OG311 5 113.900000 334.720000 0.23700000 25104.00
+ CG311 CG2O2 OG2D1 5 125.000000 585.760000 0.24420000 16736.00
+ CG311 CG2O2 OG302 5 109.000000 460.240000 0.23260000 16736.00
+ CG311 CG2O2 OG311 5 110.500000 460.240000 0.00000000 0.00
+ CG321 CG2O2 OG2D1 5 125.000000 585.760000 0.24420000 16736.00
+ CG321 CG2O2 OG302 5 109.000000 460.240000 0.23260000 16736.00
+ CG321 CG2O2 OG311 5 110.500000 460.240000 0.00000000 0.00
+ CG331 CG2O2 OG2D1 5 125.000000 585.760000 0.24420000 16736.00
+ CG331 CG2O2 OG302 5 109.000000 460.240000 0.23260000 16736.00
+ CG331 CG2O2 OG311 5 110.500000 460.240000 0.00000000 0.00
+ OG2D1 CG2O2 OG302 5 125.900000 753.120000 0.22576000 133888.00
+ OG2D1 CG2O2 OG311 5 123.000000 418.400000 0.22620000 175728.00
+ OG2D1 CG2O2 HGR52 5 119.000000 326.352000 0.00000000 0.00
+ OG311 CG2O2 HGR52 5 105.000000 393.296000 0.00000000 0.00
+ CG2DC1 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ CG2DC2 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ CG2O5 CG2O3 OG2D2 5 116.000000 794.960000 0.00000000 0.00
+ CG2R61 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ CG301 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ CG311 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ CG314 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ CG321 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ CG324 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ CG331 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ CG3C51 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ CG3C53 CG2O3 OG2D2 5 116.000000 334.720000 0.23530000 41840.00
+ OG2D2 CG2O3 OG2D2 5 128.000000 836.800000 0.22587000 58576.00
+ OG2D2 CG2O3 HGR52 5 116.000000 376.560000 0.00000000 0.00
+ CG2DC1 CG2O4 OG2D1 5 126.000000 627.600000 0.00000000 0.00
+ CG2DC1 CG2O4 HGR52 5 116.000000 125.520000 0.00000000 0.00
+ CG2DC2 CG2O4 OG2D1 5 126.000000 627.600000 0.00000000 0.00
+ CG2DC2 CG2O4 HGR52 5 116.000000 125.520000 0.00000000 0.00
+ CG2R61 CG2O4 OG2D1 5 126.000000 627.600000 0.00000000 0.00
+ CG2R61 CG2O4 HGR52 5 116.000000 125.520000 0.00000000 0.00
+ CG321 CG2O4 OG2D1 5 126.000000 376.560000 0.00000000 0.00
+ CG321 CG2O4 HGR52 5 116.000000 543.920000 0.00000000 0.00
+ CG331 CG2O4 OG2D1 5 126.000000 376.560000 0.00000000 0.00
+ CG331 CG2O4 HGR52 5 116.000000 543.920000 0.00000000 0.00
+ OG2D1 CG2O4 HGR52 5 118.000000 543.920000 0.00000000 0.00
+ CG2DC1 CG2O5 CG331 5 116.000000 292.880000 0.00000000 0.00
+ CG2DC1 CG2O5 OG2D3 5 121.800000 585.760000 0.00000000 0.00
+ CG2DC2 CG2O5 CG331 5 116.000000 292.880000 0.00000000 0.00
+ CG2DC2 CG2O5 OG2D3 5 121.800000 585.760000 0.00000000 0.00
+ CG2O3 CG2O5 CG2R61 5 117.200000 334.720000 0.00000000 0.00
+ CG2O3 CG2O5 OG2D3 5 121.500000 794.960000 0.00000000 0.00
+ CG2R61 CG2O5 CG311 5 117.200000 334.720000 0.00000000 0.00
+ CG2R61 CG2O5 CG321 5 116.500000 167.360000 0.00000000 0.00
+ CG2R61 CG2O5 CG331 5 116.500000 502.080000 0.00000000 0.00
+ CG2R61 CG2O5 OG2D3 5 121.300000 585.760000 0.00000000 0.00
+ CG311 CG2O5 OG2D3 5 121.500000 794.960000 0.00000000 0.00
+ CG321 CG2O5 CG321 5 115.600000 292.880000 0.00000000 0.00
+ CG321 CG2O5 CG331 5 115.600000 292.880000 0.00000000 0.00
+ CG321 CG2O5 OG2D3 5 122.200000 627.600000 0.00000000 0.00
+ CG331 CG2O5 CG331 5 115.600000 292.880000 0.00000000 0.00
+ CG331 CG2O5 OG2D3 5 122.200000 627.600000 0.00000000 0.00
+ NG2S1 CG2O6 OG2D1 5 125.700000 502.080000 0.00000000 0.00
+ NG2S1 CG2O6 OG302 5 110.300000 753.120000 0.00000000 0.00
+ NG2S2 CG2O6 NG2S2 5 115.000000 585.760000 0.00000000 0.00
+ NG2S2 CG2O6 OG2D1 5 122.500000 627.600000 0.23700000 41840.00
+ OG2D1 CG2O6 OG302 5 123.500000 585.760000 0.00000000 0.00
+ OG2D2 CG2O6 OG2D2 5 120.000000 334.720000 0.22412700 83261.60
+ OG2D2 CG2O6 OG311 5 120.000000 661.072000 0.00000000 0.00
+ OG302 CG2O6 OG302 5 105.000000 711.280000 0.00000000 0.00
+ SG2D1 CG2O6 SG311 5 124.000000 585.760000 0.00000000 0.00
+ SG311 CG2O6 SG311 5 112.000000 334.720000 0.00000000 0.00
+ NG2D1 CG2O7 OG2D5 5 172.000000 351.456000 0.00000000 0.00
+ OG2D5 CG2O7 OG2D5 5 180.000000 376.560000 0.00000000 0.00
+ CG2R51 CG2R51 CG2R51 5 107.200000 753.120000 0.00000000 0.00
+ CG2R51 CG2R51 CG2R52 5 106.000000 753.120000 0.00000000 0.00
+ CG2R51 CG2R51 CG2R53 5 116.500000 836.800000 0.00000000 0.00
+ CG2R51 CG2R51 CG2R57 5 107.200000 753.120000 0.00000000 0.00
+ CG2R51 CG2R51 CG2RC0 5 105.700000 711.280000 0.22610000 20920.00
+ CG2R51 CG2R51 CG2RC7 5 106.900000 585.760000 0.00000000 0.00
+ CG2R51 CG2R51 CG321 5 130.000000 383.254400 0.00000000 0.00
+ CG2R51 CG2R51 CG331 5 130.000000 383.254400 0.00000000 0.00
+ CG2R51 CG2R51 CG3C52 5 109.000000 962.320000 0.00000000 0.00
+ CG2R51 CG2R51 CG3C54 5 109.000000 962.320000 0.00000000 0.00
+ CG2R51 CG2R51 NG2R50 5 110.000000 1087.840000 0.00000000 0.00
+ CG2R51 CG2R51 NG2R51 5 106.000000 1087.840000 0.00000000 0.00
+ CG2R51 CG2R51 NG2R52 5 108.000000 1213.360000 0.00000000 0.00
+ CG2R51 CG2R51 NG2R57 5 106.000000 1087.840000 0.00000000 0.00
+ CG2R51 CG2R51 NG2RC0 5 108.200000 1087.840000 0.00000000 0.00
+ CG2R51 CG2R51 NG3C51 5 111.800000 878.640000 0.00000000 0.00
+ CG2R51 CG2R51 NG3P2 5 111.000000 1004.160000 0.00000000 0.00
+ CG2R51 CG2R51 OG2R50 5 111.700000 1087.840000 0.00000000 0.00
+ CG2R51 CG2R51 OG3C51 5 113.200000 1129.680000 0.00000000 0.00
+ CG2R51 CG2R51 SG2R50 5 109.000000 878.640000 0.00000000 0.00
+ CG2R51 CG2R51 HGR51 5 126.400000 267.776000 0.21730000 20920.00
+ CG2R51 CG2R51 HGR52 5 130.000000 184.096000 0.22150000 12552.00
+ CG2R52 CG2R51 HGR51 5 127.600000 125.520000 0.00000000 0.00
+ CG2R53 CG2R51 HGR51 5 117.100000 83.680000 0.00000000 0.00
+ CG2R57 CG2R51 NG2R51 5 106.000000 1087.840000 0.00000000 0.00
+ CG2R57 CG2R51 HGR51 5 126.400000 267.776000 0.21730000 20920.00
+ CG2R57 CG2R51 HGR52 5 130.000000 184.096000 0.22150000 12552.00
+ CG2RC0 CG2R51 CG321 5 126.700000 251.040000 0.00000000 0.00
+ CG2RC0 CG2R51 CG331 5 126.700000 251.040000 0.00000000 0.00
+ CG2RC0 CG2R51 NG2R51 5 107.500000 836.800000 0.00000000 0.00
+ CG2RC0 CG2R51 HGR51 5 126.400000 267.776000 0.22550000 20920.00
+ CG2RC0 CG2R51 HGR52 5 128.500000 259.408000 0.00000000 0.00
+ CG2RC7 CG2R51 HGR51 5 126.700000 267.776000 0.00000000 0.00
+ CG321 CG2R51 NG2R50 5 120.000000 383.254400 0.00000000 0.00
+ CG321 CG2R51 NG2R51 5 124.000000 383.254400 0.00000000 0.00
+ CG321 CG2R51 NG2R52 5 122.000000 383.254400 0.00000000 0.00
+ CG331 CG2R51 NG2R51 5 124.000000 383.254400 0.00000000 0.00
+ CG3C52 CG2R51 HGR51 5 124.600000 242.672000 0.00000000 0.00
+ CG3C54 CG2R51 HGR51 5 124.600000 108.784000 0.00000000 0.00
+ NG2R50 CG2R51 HGR52 5 120.000000 209.200000 0.21400000 16736.00
+ NG2R51 CG2R51 HGR52 5 124.000000 209.200000 0.21400000 16736.00
+ NG2R52 CG2R51 HGR52 5 122.000000 184.096000 0.21800000 12552.00
+ NG2R57 CG2R51 HGR52 5 124.000000 209.200000 0.21400000 16736.00
+ NG2RC0 CG2R51 HGR52 5 121.800000 259.408000 0.00000000 0.00
+ NG3C51 CG2R51 HGR52 5 118.200000 292.880000 0.00000000 0.00
+ NG3P2 CG2R51 HGR52 5 119.000000 292.880000 0.00000000 0.00
+ OG2R50 CG2R51 HGR52 5 118.300000 418.400000 0.00000000 0.00
+ OG3C51 CG2R51 HGR52 5 116.800000 326.352000 0.00000000 0.00
+ SG2R50 CG2R51 HGR52 5 121.000000 376.560000 0.00000000 0.00
+ CG2R51 CG2R52 NG2R50 5 110.500000 920.480000 0.00000000 0.00
+ CG2R51 CG2R52 NG2R52 5 110.000000 1012.528000 0.00000000 0.00
+ CG2R51 CG2R52 HGR52 5 126.500000 267.776000 0.00000000 0.00
+ CG2R52 CG2R52 NG2R50 5 106.000000 585.760000 0.00000000 0.00
+ CG2R52 CG2R52 HGR52 5 131.000000 251.040000 0.00000000 0.00
+ CG2RC0 CG2R52 NG2R50 5 110.400000 1255.200000 0.00000000 0.00
+ CG2RC0 CG2R52 HGR52 5 126.600000 267.776000 0.00000000 0.00
+ CG3C52 CG2R52 NG2R50 5 112.000000 1422.560000 0.00000000 0.00
+ CG3C52 CG2R52 HGR52 5 125.000000 393.296000 0.00000000 0.00
+ NG2R50 CG2R52 HGR52 5 123.000000 267.776000 0.00000000 0.00
+ NG2R52 CG2R52 HGR52 5 123.500000 292.880000 0.00000000 0.00
+ CG251O CG2R53 NG2R53 5 108.500000 460.240000 0.00000000 0.00
+ CG251O CG2R53 OG2D1 5 124.500000 460.240000 0.00000000 0.00
+ CG252O CG2R53 NG2R53 5 108.500000 460.240000 0.00000000 0.00
+ CG252O CG2R53 OG2D1 5 124.500000 460.240000 0.00000000 0.00
+ CG25C1 CG2R53 NG2R51 5 107.000000 418.400000 0.00000000 0.00
+ CG25C1 CG2R53 OG2D1 5 125.500000 460.240000 0.00000000 0.00
+ CG25C2 CG2R53 NG2R51 5 107.000000 418.400000 0.00000000 0.00
+ CG25C2 CG2R53 OG2D1 5 125.500000 460.240000 0.00000000 0.00
+ CG2R51 CG2R53 OG2D1 5 127.500000 508.774400 0.00000000 0.00
+ CG2R51 CG2R53 OG3C51 5 105.000000 548.104000 0.00000000 0.00
+ CG3C41 CG2R53 NG2R43 5 104.500000 1004.160000 0.00000000 0.00
+ CG3C41 CG2R53 OG2D1 5 135.700000 502.080000 0.00000000 0.00
+ CG3C52 CG2R53 NG2R53 5 105.500000 1004.160000 0.00000000 0.00
+ CG3C52 CG2R53 OG2D1 5 126.700000 543.920000 0.00000000 0.00
+ CG3C52 CG2R53 OG3C51 5 105.800000 753.120000 0.00000000 0.00
+ NG2R43 CG2R53 OG2D1 5 134.300000 502.080000 0.00000000 0.00
+ NG2R50 CG2R53 NG2R50 5 111.000000 836.800000 0.00000000 0.00
+ NG2R50 CG2R53 NG2R51 5 113.000000 836.800000 0.00000000 0.00
+ NG2R50 CG2R53 NG3C51 5 117.400000 1338.880000 0.00000000 0.00
+ NG2R50 CG2R53 OG2R50 5 115.700000 1004.160000 0.00000000 0.00
+ NG2R50 CG2R53 SG2R50 5 117.200000 920.480000 0.00000000 0.00
+ NG2R50 CG2R53 HGR52 5 124.800000 326.352000 0.00000000 0.00
+ NG2R51 CG2R53 OG2D1 5 127.500000 585.760000 0.00000000 0.00
+ NG2R51 CG2R53 HGR52 5 122.200000 334.720000 0.00000000 0.00
+ NG2R52 CG2R53 NG2R52 5 108.000000 1213.360000 0.00000000 0.00
+ NG2R52 CG2R53 HGR53 5 126.000000 267.776000 0.21400000 20920.00
+ NG2R53 CG2R53 NG2R53 5 104.400000 627.600000 0.00000000 0.00
+ NG2R53 CG2R53 OG2D1 5 127.800000 543.920000 0.00000000 0.00
+ NG2R53 CG2R53 SG2D1 5 127.000000 376.560000 0.00000000 0.00
+ NG2R53 CG2R53 SG311 5 109.000000 585.760000 0.00000000 0.00
+ NG3C51 CG2R53 HGR52 5 117.800000 267.776000 0.00000000 0.00
+ OG2D1 CG2R53 OG3C51 5 127.500000 535.552000 0.00000000 0.00
+ OG2D1 CG2R53 SG311 5 125.000000 460.240000 0.00000000 0.00
+ OG2R50 CG2R53 HGR52 5 119.500000 209.200000 0.21400000 16736.00
+ SG2D1 CG2R53 SG311 5 124.000000 376.560000 0.00000000 0.00
+ SG2R50 CG2R53 HGR52 5 118.000000 251.040000 0.00000000 0.00
+ CG2R51 CG2R57 CG2R51 5 107.200000 753.120000 0.00000000 0.00
+ CG2R51 CG2R57 CG2R57 5 126.400000 276.144000 0.00000000 0.00
+ CG2R51 CG2R57 NG2R57 5 126.400000 355.640000 0.00000000 0.00
+ CG1N1 CG2R61 CG2R61 5 120.000000 292.880000 0.00000000 0.00
+ CG2DC1 CG2R61 CG2R61 5 120.000000 301.248000 0.00000000 0.00
+ CG2DC2 CG2R61 CG2R61 5 120.000000 301.248000 0.00000000 0.00
+ CG2N2 CG2R61 CG2R61 5 120.000000 209.200000 0.00000000 0.00
+ CG2O1 CG2R61 CG2R61 5 119.000000 376.560000 0.00000000 0.00
+ CG2O1 CG2R61 CG2RC0 5 120.000000 502.080000 0.00000000 0.00
+ CG2O2 CG2R61 CG2R61 5 120.000000 376.560000 0.00000000 0.00
+ CG2O3 CG2R61 CG2R61 5 119.000000 376.560000 0.00000000 0.00
+ CG2O4 CG2R61 CG2R61 5 119.800000 376.560000 0.00000000 0.00
+ CG2O5 CG2R61 CG2R61 5 120.000000 376.560000 0.00000000 0.00
+ CG2R61 CG2R61 CG2R61 5 120.000000 334.720000 0.24162000 29288.00
+ CG2R61 CG2R61 CG2R62 5 119.000000 334.720000 0.24162000 29288.00
+ CG2R61 CG2R61 CG2R63 5 120.000000 334.720000 0.24162000 29288.00
+ CG2R61 CG2R61 CG2R64 5 115.500000 334.720000 0.24162000 29288.00
+ CG2R61 CG2R61 CG2R66 5 119.000000 334.720000 0.24162000 29288.00
+ CG2R61 CG2R61 CG2R67 5 120.000000 334.720000 0.00000000 0.00
+ CG2R61 CG2R61 CG2RC0 5 120.000000 418.400000 0.00000000 0.00
+ CG2R61 CG2R61 CG311 5 120.000000 383.254400 0.00000000 0.00
+ CG2R61 CG2R61 CG312 5 120.000000 383.254400 0.00000000 0.00
+ CG2R61 CG2R61 CG321 5 120.000000 383.254400 0.00000000 0.00
+ CG2R61 CG2R61 CG324 5 120.000000 383.254400 0.00000000 0.00
+ CG2R61 CG2R61 CG331 5 120.000000 383.254400 0.00000000 0.00
+ CG2R61 CG2R61 NG2O1 5 120.000000 167.360000 0.00000000 0.00
+ CG2R61 CG2R61 NG2R60 5 124.000000 167.360000 0.00000000 0.00
+ CG2R61 CG2R61 NG2R61 5 120.000000 1046.000000 0.00000000 0.00
+ CG2R61 CG2R61 NG2R62 5 124.000000 167.360000 0.00000000 0.00
+ CG2R61 CG2R61 NG2RC0 5 121.400000 836.800000 0.00000000 0.00
+ CG2R61 CG2R61 NG2S1 5 120.000000 334.720000 0.24162000 29288.00
+ CG2R61 CG2R61 NG2S3 5 121.000000 502.080000 0.00000000 0.00
+ CG2R61 CG2R61 NG311 5 120.000000 334.720000 0.00000000 0.00
+ CG2R61 CG2R61 NG3N1 5 122.000000 401.664000 0.00000000 0.00
+ CG2R61 CG2R61 OG301 5 120.000000 920.480000 0.00000000 0.00
+ CG2R61 CG2R61 OG303 5 120.000000 627.600000 0.00000000 0.00
+ CG2R61 CG2R61 OG311 5 120.000000 378.233600 0.00000000 0.00
+ CG2R61 CG2R61 OG312 5 120.000000 334.720000 0.00000000 0.00
+ CG2R61 CG2R61 OG3R60 5 120.000000 334.720000 0.00000000 0.00
+ CG2R61 CG2R61 SG311 5 120.000000 334.720000 0.00000000 0.00
+ CG2R61 CG2R61 SG3O1 5 122.300000 83.680000 0.00000000 0.00
+ CG2R61 CG2R61 SG3O2 5 119.000000 292.880000 0.00000000 0.00
+ CG2R61 CG2R61 CLGR1 5 120.000000 502.080000 0.00000000 0.00
+ CG2R61 CG2R61 BRGR1 5 120.000000 376.560000 0.00000000 0.00
+ CG2R61 CG2R61 IGR1 5 120.000000 376.560000 0.00000000 0.00
+ CG2R61 CG2R61 HGR61 5 120.000000 251.040000 0.21525000 18409.60
+ CG2R61 CG2R61 HGR62 5 120.000000 251.040000 0.21525000 18409.60
+ CG2R62 CG2R61 HGR61 5 121.000000 167.360000 0.21525000 18409.60
+ CG2R63 CG2R61 HGR62 5 120.000000 150.624000 0.21525000 18409.60
+ CG2R64 CG2R61 NG2R60 5 123.400000 167.360000 0.00000000 0.00
+ CG2R64 CG2R61 OG311 5 120.000000 378.233600 0.00000000 0.00
+ CG2R64 CG2R61 HGR61 5 120.000000 251.040000 0.21525000 18409.60
+ CG2R66 CG2R61 CG2R66 5 117.000000 334.720000 0.24162000 29288.00
+ CG2R66 CG2R61 CG331 5 120.000000 383.254400 0.00000000 0.00
+ CG2R66 CG2R61 NG2R60 5 124.000000 167.360000 0.00000000 0.00
+ CG2R66 CG2R61 NG2S1 5 120.000000 334.720000 0.24162000 29288.00
+ CG2R66 CG2R61 HGR62 5 121.500000 251.040000 0.21525000 18409.60
+ CG2R67 CG2R61 NG2R60 5 124.000000 167.360000 0.00000000 0.00
+ CG2R67 CG2R61 HGR61 5 120.000000 251.040000 0.00000000 0.00
+ CG2R67 CG2R61 HGR62 5 120.000000 251.040000 0.00000000 0.00
+ CG2RC0 CG2R61 NG2R62 5 119.000000 167.360000 0.00000000 0.00
+ CG2RC0 CG2R61 HGR61 5 120.000000 251.040000 0.21460000 18409.60
+ CG2RC0 CG2R61 HGR62 5 121.500000 251.040000 0.00000000 0.00
+ CG321 CG2R61 NG2R60 5 122.300000 383.254400 0.00000000 0.00
+ CG331 CG2R61 NG2R60 5 122.300000 383.254400 0.00000000 0.00
+ NG2R60 CG2R61 BRGR1 5 120.000000 376.560000 0.00000000 0.00
+ NG2R60 CG2R61 HGR62 5 116.000000 251.040000 0.21000000 29288.00
+ NG2R61 CG2R61 HGR62 5 115.000000 276.144000 0.00000000 0.00
+ NG2R62 CG2R61 HGR62 5 116.000000 251.040000 0.21000000 29288.00
+ NG2RC0 CG2R61 HGR62 5 118.600000 251.040000 0.00000000 0.00
+ CG2O1 CG2R62 CG2R62 5 131.800000 83.680000 0.00000000 0.00
+ CG2R61 CG2R62 CG2R62 5 121.000000 334.720000 0.00000000 0.00
+ CG2R61 CG2R62 CG2R63 5 122.300000 1004.160000 0.00000000 0.00
+ CG2R61 CG2R62 NG2R61 5 116.100000 192.464000 0.00000000 0.00
+ CG2R61 CG2R62 NG2R62 5 118.000000 251.040000 0.00000000 0.00
+ CG2R61 CG2R62 OG3R60 5 119.700000 334.720000 0.00000000 0.00
+ CG2R62 CG2R62 CG2R62 5 118.000000 334.720000 0.00000000 0.00
+ CG2R62 CG2R62 CG2R63 5 116.700000 1004.160000 0.00000000 0.00
+ CG2R62 CG2R62 CG2R64 5 117.800000 711.280000 0.00000000 0.00
+ CG2R62 CG2R62 CG331 5 124.200000 334.720000 0.00000000 0.00
+ CG2R62 CG2R62 NG2R61 5 122.900000 711.280000 0.00000000 0.00
+ CG2R62 CG2R62 NG2R62 5 121.000000 167.360000 0.00000000 0.00
+ CG2R62 CG2R62 NG2R67 5 122.900000 711.280000 0.00000000 0.00
+ CG2R62 CG2R62 OG3R60 5 119.300000 83.680000 0.00000000 0.00
+ CG2R62 CG2R62 HGR62 5 119.000000 351.456000 0.00000000 0.00
+ CG2R62 CG2R62 HGR63 5 120.500000 669.440000 0.00000000 0.00
+ CG2R63 CG2R62 CG331 5 118.700000 317.984000 0.00000000 0.00
+ CG2R63 CG2R62 HGR62 5 120.300000 251.040000 0.00000000 0.00
+ CG2R64 CG2R62 HGR62 5 120.100000 317.984000 0.00000000 0.00
+ NG2R61 CG2R62 HGR62 5 115.000000 368.192000 0.00000000 0.00
+ NG2R61 CG2R62 HGR63 5 117.500000 669.440000 0.00000000 0.00
+ NG2R62 CG2R62 HGR62 5 120.000000 196.648000 0.21000000 29288.00
+ NG2R67 CG2R62 HGR62 5 118.100000 368.192000 0.00000000 0.00
+ CG2R61 CG2R63 NG2R61 5 111.900000 493.712000 0.00000000 0.00
+ CG2R61 CG2R63 NG2R67 5 113.400000 493.712000 0.00000000 0.00
+ CG2R61 CG2R63 SG2D1 5 125.100000 317.984000 0.00000000 0.00
+ CG2R62 CG2R63 CG2R62 5 120.800000 83.680000 0.00000000 0.00
+ CG2R62 CG2R63 NG2R61 5 113.500000 585.760000 0.00000000 0.00
+ CG2R62 CG2R63 NG2R67 5 115.700000 585.760000 0.00000000 0.00
+ CG2R62 CG2R63 OG2D4 5 124.600000 836.800000 0.00000000 0.00
+ CG2R62 CG2R63 OG3R60 5 121.500000 83.680000 0.00000000 0.00
+ CG2R62 CG2R63 SG2D1 5 123.500000 435.136000 0.00000000 0.00
+ CG2RC0 CG2R63 NG2R61 5 107.800000 585.760000 0.00000000 0.00
+ CG2RC0 CG2R63 OG2D4 5 124.700000 418.400000 0.00000000 0.00
+ NG2R61 CG2R63 NG2R61 5 114.000000 418.400000 0.00000000 0.00
+ NG2R61 CG2R63 NG2R62 5 116.800000 418.400000 0.00000000 0.00
+ NG2R61 CG2R63 NG2R67 5 114.000000 418.400000 0.00000000 0.00
+ NG2R61 CG2R63 OG2D4 5 119.400000 1087.840000 0.00000000 0.00
+ NG2R61 CG2R63 SG2D1 5 123.000000 468.608000 0.00000000 0.00
+ NG2R62 CG2R63 OG2D4 5 123.800000 1087.840000 0.00000000 0.00
+ NG2R67 CG2R63 OG2D4 5 119.700000 1087.840000 0.00000000 0.00
+ NG2R67 CG2R63 SG2D1 5 123.000000 468.608000 0.00000000 0.00
+ OG2D4 CG2R63 OG3R60 5 113.900000 167.360000 0.00000000 0.00
+ CG2R61 CG2R64 NG2R60 5 124.000000 167.360000 0.00000000 0.00
+ CG2R61 CG2R64 NG2R62 5 128.000000 167.360000 0.00000000 0.00
+ CG2R61 CG2R64 NG2S1 5 120.000000 334.720000 0.24162000 29288.00
+ CG2R62 CG2R64 NG2R62 5 119.300000 711.280000 0.00000000 0.00
+ CG2R62 CG2R64 NG2S3 5 118.400000 677.808000 0.00000000 0.00
+ CG2RC0 CG2R64 NG2R62 5 110.700000 502.080000 0.00000000 0.00
+ CG2RC0 CG2R64 NG2S3 5 118.600000 418.400000 0.00000000 0.00
+ NG2R60 CG2R64 NG2S1 5 120.000000 334.720000 0.24162000 29288.00
+ NG2R61 CG2R64 NG2R62 5 122.200000 585.760000 0.00000000 0.00
+ NG2R61 CG2R64 NG2S3 5 115.400000 794.960000 0.00000000 0.00
+ NG2R61 CG2R64 SG311 5 121.800000 167.360000 0.00000000 0.00
+ NG2R61 CG2R64 HGR62 5 119.000000 669.440000 0.00000000 0.00
+ NG2R62 CG2R64 NG2R62 5 128.000000 502.080000 0.00000000 0.00
+ NG2R62 CG2R64 NG2R67 5 125.000000 585.760000 0.00000000 0.00
+ NG2R62 CG2R64 NG2S3 5 122.400000 794.960000 0.00000000 0.00
+ NG2R62 CG2R64 SG311 5 116.000000 451.872000 0.00000000 0.00
+ NG2R62 CG2R64 HGR62 5 116.000000 317.984000 0.00000000 0.00
+ NG2R67 CG2R64 HGR62 5 119.000000 669.440000 0.00000000 0.00
+ CG2R61 CG2R66 CG2R61 5 122.500000 334.720000 0.24162000 29288.00
+ CG2R61 CG2R66 FGR1 5 118.750000 502.080000 0.00000000 0.00
+ CG2R61 CG2R67 CG2R61 5 120.000000 334.720000 0.00000000 0.00
+ CG2R61 CG2R67 CG2R67 5 120.000000 334.720000 0.00000000 0.00
+ CG2R61 CG2R67 CG2RC0 5 120.000000 418.400000 0.00000000 0.00
+ CG2R61 CG2R67 NG2R60 5 126.800000 485.344000 0.00000000 0.00
+ CG2R61 CG2R67 NG2R67 5 120.000000 418.400000 0.00000000 0.00
+ CG2R67 CG2R67 CG2RC0 5 110.000000 460.240000 0.00000000 0.00
+ CG2R67 CG2R67 NG2R60 5 113.200000 368.192000 0.00000000 0.00
+ CG2R71 CG2R71 CG2R71 5 128.600000 251.040000 0.00000000 0.00
+ CG2R71 CG2R71 CG2RC7 5 129.300000 753.120000 0.00000000 0.00
+ CG2R71 CG2R71 HGR71 5 115.700000 309.616000 0.00000000 0.00
+ CG2RC7 CG2R71 HGR71 5 115.000000 267.776000 0.00000000 0.00
+ CG25C1 CG2RC0 CG2R61 5 125.000000 334.720000 0.00000000 0.00
+ CG25C1 CG2RC0 CG2RC0 5 107.000000 167.360000 0.00000000 0.00
+ CG25C2 CG2RC0 CG2R61 5 125.000000 334.720000 0.00000000 0.00
+ CG25C2 CG2RC0 CG2RC0 5 107.000000 167.360000 0.00000000 0.00
+ CG2R51 CG2RC0 CG2R61 5 132.000000 1087.840000 0.00000000 0.00
+ CG2R51 CG2RC0 CG2RC0 5 108.000000 711.280000 0.00000000 0.00
+ CG2R51 CG2RC0 NG2RC0 5 109.200000 753.120000 0.00000000 0.00
+ CG2R52 CG2RC0 CG2R61 5 134.100000 502.080000 0.00000000 0.00
+ CG2R52 CG2RC0 CG2RC0 5 105.900000 753.120000 0.00000000 0.00
+ CG2R61 CG2RC0 CG2R67 5 120.000000 418.400000 0.00000000 0.00
+ CG2R61 CG2RC0 CG2RC0 5 120.000000 418.400000 0.00000000 0.00
+ CG2R61 CG2RC0 CG3C52 5 130.000000 502.080000 0.00000000 0.00
+ CG2R61 CG2RC0 NG2R50 5 130.000000 1087.840000 0.00000000 0.00
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+ CG2R61 CG2RC0 NG2RC0 5 118.800000 669.440000 0.00000000 0.00
+ CG2R61 CG2RC0 NG3C51 5 130.700000 292.880000 0.00000000 0.00
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+ CG2R61 CG2RC0 OG3C51 5 125.300000 418.400000 0.00000000 0.00
+ CG2R61 CG2RC0 SG2R50 5 123.700000 376.560000 0.00000000 0.00
+ CG2R63 CG2RC0 CG2RC0 5 119.600000 585.760000 0.00000000 0.00
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+ CG2RC0 CG2RC0 CG3C52 5 110.000000 920.480000 0.00000000 0.00
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+ CG2RC0 CG2RC0 NG2R62 5 127.400000 502.080000 0.00000000 0.00
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+ CG2RC0 CG2RC0 OG2R50 5 110.600000 920.480000 0.00000000 0.00
+ CG2RC0 CG2RC0 OG3C51 5 114.700000 669.440000 0.00000000 0.00
+ CG2RC0 CG2RC0 SG2R50 5 116.300000 585.760000 0.00000000 0.00
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+ NG2R51 CG2RC0 NG2R62 5 126.900000 836.800000 0.00000000 0.00
+ CG2R51 CG2RC7 CG2R71 5 122.700000 251.040000 0.00000000 0.00
+ CG2R51 CG2RC7 CG2RC7 5 109.500000 920.480000 0.00000000 0.00
+ CG2R71 CG2RC7 CG2RC7 5 127.800000 251.040000 0.00000000 0.00
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+ CG2D1 CG301 CG331 5 112.200000 267.776000 0.00000000 0.00
+ CG2DC1 CG301 CG321 5 112.200000 267.776000 0.00000000 0.00
+ CG2DC1 CG301 CG331 5 112.200000 267.776000 0.00000000 0.00
+ CG2DC2 CG301 CG321 5 112.200000 267.776000 0.00000000 0.00
+ CG2DC2 CG301 CG331 5 112.200000 267.776000 0.00000000 0.00
+ CG2O3 CG301 CG331 5 108.000000 435.136000 0.00000000 0.00
+ CG2O3 CG301 OG301 5 109.000000 376.560000 0.00000000 0.00
+ CG2O3 CG301 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG311 CG301 CG311 5 113.500000 488.272800 0.25610000 9338.69
+ CG311 CG301 CG321 5 113.500000 488.272800 0.25610000 9338.69
+ CG311 CG301 CG331 5 113.500000 488.272800 0.25610000 9338.69
+ CG321 CG301 CG321 5 113.500000 488.272800 0.25610000 9338.69
+ CG321 CG301 CG331 5 113.500000 488.272800 0.25610000 9338.69
+ CG321 CG301 OG301 5 114.500000 380.744000 0.00000000 0.00
+ CG331 CG301 CG331 5 113.500000 488.272800 0.25610000 9338.69
+ CG331 CG301 OG301 5 111.500000 376.560000 0.00000000 0.00
+ CG331 CG301 OG302 5 110.100000 633.457600 0.00000000 0.00
+ CG331 CG301 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG331 CG301 CLGA3 5 111.200000 811.696000 0.00000000 0.00
+ CG331 CG301 BRGA3 5 111.200000 820.064000 0.00000000 0.00
+ OG301 CG301 OG301 5 107.000000 589.860320 0.00000000 0.00
+ OG301 CG301 OG311 5 116.500000 376.560000 0.00000000 0.00
+ CLGA3 CG301 CLGA3 5 109.000000 794.960000 0.00000000 0.00
+ BRGA3 CG301 BRGA3 5 110.500000 753.120000 0.00000000 0.00
+ CG321 CG302 FGA3 5 112.000000 351.456000 0.23570000 25104.00
+ CG331 CG302 FGA3 5 112.000000 351.456000 0.23570000 25104.00
+ FGA3 CG302 FGA3 5 107.000000 987.424000 0.21550000 25104.00
+ CG2O1 CG311 CG311 5 108.000000 435.136000 0.00000000 0.00
+ CG2O1 CG311 CG321 5 108.000000 435.136000 0.00000000 0.00
+ CG2O1 CG311 CG331 5 108.000000 435.136000 0.00000000 0.00
+ CG2O1 CG311 NG2S1 5 107.000000 418.400000 0.00000000 0.00
+ CG2O1 CG311 HGA1 5 109.500000 418.400000 0.00000000 0.00
+ CG2O2 CG311 CG321 5 108.000000 435.136000 0.00000000 0.00
+ CG2O2 CG311 NG2R53 5 107.000000 418.400000 0.00000000 0.00
+ CG2O2 CG311 NG2S1 5 107.000000 418.400000 0.00000000 0.00
+ CG2O2 CG311 HGA1 5 109.500000 418.400000 0.00000000 0.00
+ CG2O3 CG311 CG2R61 5 107.500000 433.462400 0.00000000 0.00
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+ CG2O3 CG311 CG321 5 108.000000 435.136000 0.00000000 0.00
+ CG2O3 CG311 CG331 5 108.000000 435.136000 0.00000000 0.00
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+ CG2O3 CG311 NG2S1 5 107.000000 418.400000 0.00000000 0.00
+ CG2O3 CG311 OG301 5 109.000000 376.560000 0.00000000 0.00
+ CG2O3 CG311 HGA1 5 109.500000 418.400000 0.00000000 0.00
+ CG2O5 CG311 OG311 5 111.000000 937.216000 0.00000000 0.00
+ CG2O5 CG311 OG312 5 111.000000 1087.840000 0.00000000 0.00
+ CG2O5 CG311 HGA1 5 109.500000 418.400000 0.00000000 0.00
+ CG2R61 CG311 CG321 5 107.500000 433.462400 0.00000000 0.00
+ CG2R61 CG311 CG331 5 107.500000 433.462400 0.00000000 0.00
+ CG2R61 CG311 HGA1 5 111.000000 359.824000 0.00000000 0.00
+ CG301 CG311 CG311 5 108.000000 435.136000 0.00000000 0.00
+ CG301 CG311 CG321 5 113.500000 488.272800 0.25610000 9338.69
+ CG301 CG311 HGA1 5 110.100000 289.532800 0.21790000 18853.10
+ CG311 CG311 CG311 5 111.000000 446.432800 0.25610000 6694.40
+ CG311 CG311 CG321 5 111.000000 446.432800 0.25610000 6694.40
+ CG311 CG311 CG331 5 108.500000 446.432800 0.25610000 6694.40
+ CG311 CG311 CG3RC1 5 103.700000 446.432800 0.25610000 6694.40
+ CG311 CG311 NG2S1 5 113.500000 585.760000 0.00000000 0.00
+ CG311 CG311 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG311 CG311 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG314 CG311 CG321 5 111.000000 446.432800 0.25610000 6694.40
+ CG314 CG311 CG331 5 108.500000 446.432800 0.25610000 6694.40
+ CG314 CG311 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG321 CG311 CG321 5 113.500000 488.272800 0.25610000 9338.69
+ CG321 CG311 CG324 5 110.500000 488.272800 0.25610000 9338.69
+ CG321 CG311 CG331 5 114.000000 446.432800 0.25610000 6694.40
+ CG321 CG311 CG3C51 5 111.000000 446.432800 0.25610000 6694.40
+ CG321 CG311 CG3RC1 5 103.700000 446.432800 0.25610000 6694.40
+ CG321 CG311 NG2R53 5 113.500000 585.760000 0.00000000 0.00
+ CG321 CG311 NG2S1 5 113.500000 585.760000 0.00000000 0.00
+ CG321 CG311 OG302 5 109.700000 962.320000 0.00000000 0.00
+ CG321 CG311 OG311 5 110.000000 633.457600 0.00000000 0.00
+ CG321 CG311 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG324 CG311 NG2S1 5 113.500000 585.760000 0.00000000 0.00
+ CG324 CG311 OG311 5 112.100000 633.457600 0.00000000 0.00
+ CG324 CG311 HGA1 5 111.800000 221.752000 0.21790000 18853.10
+ CG331 CG311 CG331 5 114.000000 446.432800 0.25610000 6694.40
+ CG331 CG311 CG3C51 5 108.500000 446.432800 0.25610000 6694.40
+ CG331 CG311 NG2S1 5 113.500000 585.760000 0.00000000 0.00
+ CG331 CG311 OG301 5 111.500000 376.560000 0.00000000 0.00
+ CG331 CG311 OG302 5 110.100000 633.457600 0.00000000 0.00
+ CG331 CG311 OG303 5 109.700000 962.320000 0.00000000 0.00
+ CG331 CG311 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG331 CG311 CLGA1 5 111.200000 736.384000 0.00000000 0.00
+ CG331 CG311 BRGA2 5 111.000000 627.600000 0.00000000 0.00
+ CG331 CG311 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG3C51 CG311 HGA1 5 110.100000 289.532800 0.21790000 18853.10
+ CG3RC1 CG311 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG3RC1 CG311 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ NG2R53 CG311 HGA1 5 108.000000 401.664000 0.00000000 0.00
+ NG2S1 CG311 HGA1 5 108.000000 401.664000 0.00000000 0.00
+ OG301 CG311 HGA1 5 109.500000 502.080000 0.00000000 0.00
+ OG302 CG311 HGA1 5 109.500000 502.080000 0.00000000 0.00
+ OG303 CG311 HGA1 5 109.500000 502.080000 0.00000000 0.00
+ OG311 CG311 OG312 5 111.000000 936.379200 0.23500000 83680.00
+ OG311 CG311 HGA1 5 108.890000 384.091200 0.00000000 0.00
+ OG312 CG311 HGA1 5 117.800000 551.451200 0.00000000 0.00
+ CLGA1 CG311 CLGA1 5 109.000000 794.960000 0.00000000 0.00
+ CLGA1 CG311 HGA1 5 108.500000 368.192000 0.00000000 0.00
+ BRGA2 CG311 BRGA2 5 110.000000 794.960000 0.00000000 0.00
+ BRGA2 CG311 HGA1 5 107.000000 301.248000 0.00000000 0.00
+ CG2R61 CG312 PG1 5 117.000000 753.120000 0.23000000 16736.00
+ CG2R61 CG312 PG2 5 117.000000 753.120000 0.23000000 16736.00
+ CG2R61 CG312 FGA2 5 115.000000 418.400000 0.23570000 25104.00
+ CG331 CG312 FGA2 5 112.000000 418.400000 0.23570000 25104.00
+ CG331 CG312 HGA7 5 112.000000 267.776000 0.21680000 2510.40
+ PG1 CG312 FGA2 5 122.000000 418.400000 0.23570000 25104.00
+ PG2 CG312 FGA2 5 122.000000 418.400000 0.23570000 25104.00
+ FGA2 CG312 FGA2 5 107.000000 1255.200000 0.21700000 8368.00
+ FGA2 CG312 HGA7 5 108.890000 350.619200 0.19800000 4184.00
+ CG2O1 CG314 CG311 5 108.000000 435.136000 0.00000000 0.00
+ CG2O1 CG314 CG321 5 108.000000 435.136000 0.00000000 0.00
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+ CG2O1 CG314 NG3P3 5 110.000000 365.681600 0.00000000 0.00
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+ CG2O3 CG314 CG321 5 108.000000 435.136000 0.00000000 0.00
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+ CG311 CG314 NG3P3 5 110.000000 566.513600 0.00000000 0.00
+ CG311 CG314 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG321 CG314 CG321 5 113.500000 488.272800 0.25610000 9338.69
+ CG321 CG314 NG3P2 5 110.000000 334.720000 0.00000000 0.00
+ CG321 CG314 NG3P3 5 110.000000 566.513600 0.00000000 0.00
+ CG321 CG314 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG331 CG314 NG3P3 5 110.000000 566.513600 0.00000000 0.00
+ CG331 CG314 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ NG3P2 CG314 HGA1 5 102.300000 376.560000 0.21010000 29288.00
+ NG3P3 CG314 HGA1 5 107.500000 430.952000 0.00000000 0.00
+ CG2D1 CG321 CG2D1 5 114.000000 251.040000 0.00000000 0.00
+ CG2D1 CG321 CG2DC1 5 108.000000 1046.000000 0.00000000 0.00
+ CG2D1 CG321 CG2DC2 5 108.000000 1046.000000 0.00000000 0.00
+ CG2D1 CG321 CG311 5 112.200000 267.776000 0.00000000 0.00
+ CG2D1 CG321 CG321 5 112.200000 267.776000 0.00000000 0.00
+ CG2D1 CG321 CG331 5 112.200000 267.776000 0.00000000 0.00
+ CG2D1 CG321 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG2D1 CG321 HGA2 5 111.500000 376.560000 0.00000000 0.00
+ CG2DC1 CG321 CG321 5 112.200000 267.776000 0.00000000 0.00
+ CG2DC1 CG321 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG2DC1 CG321 OG3R60 5 99.000000 167.360000 0.00000000 0.00
+ CG2DC1 CG321 HGA2 5 111.500000 376.560000 0.00000000 0.00
+ CG2DC2 CG321 CG321 5 112.200000 267.776000 0.00000000 0.00
+ CG2DC2 CG321 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG2DC2 CG321 OG3R60 5 99.000000 167.360000 0.00000000 0.00
+ CG2DC2 CG321 HGA2 5 111.500000 376.560000 0.00000000 0.00
+ CG2O1 CG321 CG311 5 108.000000 435.136000 0.00000000 0.00
+ CG2O1 CG321 CG314 5 108.000000 435.136000 0.00000000 0.00
+ CG2O1 CG321 CG321 5 108.000000 435.136000 0.00000000 0.00
+ CG2O1 CG321 CG331 5 108.000000 435.136000 0.00000000 0.00
+ CG2O1 CG321 NG2S1 5 107.000000 418.400000 0.00000000 0.00
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+ CG2O2 CG321 CG311 5 108.000000 435.136000 0.00000000 0.00
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+ CG2O2 CG321 CG321 5 108.000000 435.136000 0.00000000 0.00
+ CG2O2 CG321 CG331 5 108.000000 435.136000 0.00000000 0.00
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+ CG2O2 CG321 NG321 5 110.000000 365.681600 0.00000000 0.00
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+ CG2O3 CG321 CG311 5 108.000000 435.136000 0.00000000 0.00
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+ CG2O3 CG321 CG321 5 108.000000 435.136000 0.00000000 0.00
+ CG2O3 CG321 CG331 5 108.000000 435.136000 0.00000000 0.00
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+ CG2O3 CG321 HGA2 5 109.500000 276.144000 0.21630000 25104.00
+ CG2O4 CG321 CG331 5 113.800000 502.080000 0.00000000 0.00
+ CG2O4 CG321 CLGA1 5 111.820000 543.920000 0.00000000 0.00
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+ CG2O5 CG321 CG321 5 113.800000 502.080000 0.00000000 0.00
+ CG2O5 CG321 CG331 5 111.500000 502.080000 0.00000000 0.00
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+ CG2R51 CG321 CG311 5 114.000000 488.272800 0.00000000 0.00
+ CG2R51 CG321 CG314 5 114.000000 488.272800 0.00000000 0.00
+ CG2R51 CG321 CG331 5 114.000000 488.272800 0.00000000 0.00
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+ CG2R61 CG321 CG331 5 107.500000 433.462400 0.00000000 0.00
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+ CG2R61 CG321 OG302 5 110.100000 633.457600 0.00000000 0.00
+ CG2R61 CG321 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG2R61 CG321 PG1 5 111.000000 753.120000 0.23000000 16736.00
+ CG2R61 CG321 PG2 5 111.000000 753.120000 0.23000000 16736.00
+ CG2R61 CG321 HGA2 5 107.500000 412.542400 0.00000000 0.00
+ CG301 CG321 CG321 5 113.500000 488.272800 0.25610000 9338.69
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+ CG302 CG321 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG302 CG321 HGA2 5 110.100000 289.532800 0.21790000 18853.10
+ CG311 CG321 CG311 5 113.500000 488.272800 0.25610000 9338.69
+ CG311 CG321 CG314 5 113.500000 488.272800 0.25610000 9338.69
+ CG311 CG321 CG321 5 113.500000 488.272800 0.25610000 9338.69
+ CG311 CG321 CG324 5 110.500000 488.272800 0.25610000 9338.69
+ CG311 CG321 CG331 5 113.500000 488.272800 0.25610000 9338.69
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+ CG311 CG321 OG303 5 110.100000 633.457600 0.00000000 0.00
+ CG311 CG321 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG311 CG321 SG311 5 112.500000 485.344000 0.00000000 0.00
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+ CG321 CG321 CG324 5 110.500000 488.272800 0.25610000 9338.69
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+ CG321 CG321 CG3RC1 5 111.000000 446.432800 0.25610000 6694.40
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+ CG321 CG321 OG303 5 110.100000 633.457600 0.00000000 0.00
+ CG321 CG321 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG321 CG321 OG3C61 5 111.500000 376.560000 0.00000000 0.00
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+ CG321 CG321 SG3O1 5 105.500000 359.824000 0.00000000 0.00
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+ CG331 CG321 CG3C31 5 111.000000 446.432800 0.00000000 0.00
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+ CG331 CG321 NG2S3 5 109.700000 228.446400 0.00000000 0.00
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+ CG331 CG321 SG3O2 5 105.000000 376.560000 0.00000000 0.00
+ CG331 CG321 SG3O3 5 105.000000 376.560000 0.00000000 0.00
+ CG331 CG321 CLGA1 5 112.200000 594.128000 0.00000000 0.00
+ CG331 CG321 BRGA1 5 111.000000 594.128000 0.00000000 0.00
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+ CG3C51 CG321 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG3C51 CG321 SG311 5 112.500000 485.344000 0.00000000 0.00
+ CG3C51 CG321 HGA2 5 110.100000 289.532800 0.21790000 18853.10
+ CG3RC1 CG321 OG303 5 110.100000 633.457600 0.00000000 0.00
+ CG3RC1 CG321 HGA2 5 110.100000 288.696000 0.21790000 18853.10
+ NG2R51 CG321 HGA2 5 110.100000 279.742240 0.00000000 0.00
+ NG2S1 CG321 HGA2 5 109.500000 430.952000 0.00000000 0.00
+ NG2S3 CG321 HGA2 5 105.200000 320.494400 0.00000000 0.00
+ NG311 CG321 NG311 5 113.000000 753.120000 0.00000000 0.00
+ NG311 CG321 HGA2 5 109.500000 271.123200 0.21300000 41840.00
+ NG321 CG321 HGA2 5 109.500000 271.123200 0.21400000 41840.00
+ OG301 CG321 HGA2 5 108.890000 384.091200 0.00000000 0.00
+ OG302 CG321 HGA2 5 109.500000 502.080000 0.00000000 0.00
+ OG303 CG321 HGA2 5 109.500000 502.080000 0.00000000 0.00
+ OG311 CG321 HGA2 5 108.890000 384.091200 0.00000000 0.00
+ OG312 CG321 HGA2 5 118.300000 543.920000 0.00000000 0.00
+ OG3C61 CG321 OG3C61 5 110.500000 376.560000 0.00000000 0.00
+ OG3C61 CG321 HGA2 5 109.500000 376.560000 0.00000000 0.00
+ OG3R60 CG321 HGA2 5 111.500000 460.240000 0.00000000 0.00
+ PG1 CG321 HGA2 5 110.000000 753.120000 0.18020000 4518.72
+ PG2 CG321 HGA2 5 110.000000 753.120000 0.18020000 4518.72
+ SG301 CG321 HGA2 5 111.000000 317.984000 0.00000000 0.00
+ SG311 CG321 SG311 5 117.000000 836.800000 0.00000000 0.00
+ SG311 CG321 HGA2 5 111.300000 385.764800 0.00000000 0.00
+ SG3O1 CG321 HGA2 5 109.000000 410.032000 0.00000000 0.00
+ SG3O2 CG321 HGA2 5 107.000000 376.560000 0.00000000 0.00
+ SG3O3 CG321 HGA2 5 107.000000 376.560000 0.00000000 0.00
+ CLGA1 CG321 HGA2 5 107.000000 351.456000 0.00000000 0.00
+ BRGA1 CG321 HGA2 5 106.000000 301.248000 0.00000000 0.00
+ HGA2 CG321 HGA2 5 109.000000 297.064000 0.18020000 4518.72
+ CG331 CG322 FGA1 5 112.000000 368.192000 0.23690000 25104.00
+ CG331 CG322 HGA6 5 112.000000 259.408000 0.21680000 2510.40
+ FGA1 CG322 HGA6 5 108.890000 481.160000 0.19970000 4184.00
+ HGA6 CG322 HGA6 5 108.400000 297.064000 0.17460000 8702.72
+ CG331 CG323 SG302 5 118.000000 460.240000 0.00000000 0.00
+ CG331 CG323 HGA2 5 110.100000 289.532800 0.21790000 18853.10
+ SG302 CG323 HGA2 5 112.300000 334.720000 0.00000000 0.00
+ SG302 CG323 HGA3 5 112.300000 334.720000 0.00000000 0.00
+ HGA2 CG323 HGA2 5 108.400000 297.064000 0.17750000 11715.20
+ HGA3 CG323 HGA3 5 108.400000 297.064000 0.17750000 11715.20
+ CG2O1 CG324 NG3P3 5 110.000000 365.681600 0.00000000 0.00
+ CG2O1 CG324 HGA2 5 109.500000 276.144000 0.21630000 25104.00
+ CG2O3 CG324 NG3P3 5 110.000000 365.681600 0.00000000 0.00
+ CG2O3 CG324 HGA2 5 109.500000 276.144000 0.21630000 25104.00
+ CG2R61 CG324 NG3P1 5 102.300000 376.560000 0.21010000 29288.00
+ CG2R61 CG324 HGA2 5 107.500000 412.542400 0.00000000 0.00
+ CG311 CG324 NG3P1 5 110.000000 836.800000 0.00000000 0.00
+ CG311 CG324 NG3P2 5 110.000000 334.720000 0.00000000 0.00
+ CG311 CG324 HGA2 5 111.800000 221.752000 0.21790000 18853.10
+ CG321 CG324 NG2O1 5 109.000000 475.302400 0.00000000 0.00
+ CG321 CG324 NG2P1 5 110.000000 566.513600 0.00000000 0.00
+ CG321 CG324 NG3P0 5 115.000000 566.513600 0.00000000 0.00
+ CG321 CG324 NG3P1 5 110.000000 836.800000 0.00000000 0.00
+ CG321 CG324 NG3P2 5 110.000000 334.720000 0.00000000 0.00
+ CG321 CG324 NG3P3 5 110.000000 566.513600 0.00000000 0.00
+ CG321 CG324 HGA2 5 111.800000 221.752000 0.21790000 18853.10
+ CG321 CG324 HGP5 5 110.100000 279.742240 0.21790000 18853.10
+ CG331 CG324 NG3P0 5 115.000000 566.513600 0.00000000 0.00
+ CG331 CG324 NG3P3 5 110.000000 566.513600 0.00000000 0.00
+ CG331 CG324 HGA2 5 110.100000 289.532800 0.21790000 18853.10
+ CG331 CG324 HGP5 5 110.100000 279.742240 0.21790000 18853.10
+ CG3C31 CG324 NG3P3 5 110.000000 566.513600 0.00000000 0.00
+ CG3C31 CG324 HGA2 5 110.100000 289.532800 0.00000000 0.00
+ NG2O1 CG324 HGA2 5 106.300000 502.080000 0.00000000 0.00
+ NG2P1 CG324 HGA2 5 110.100000 351.456000 0.00000000 0.00
+ NG3P0 CG324 HGP5 5 109.500000 334.720000 0.21300000 22593.60
+ NG3P1 CG324 HGA2 5 102.300000 376.560000 0.21010000 29288.00
+ NG3P2 CG324 HGA2 5 102.300000 376.560000 0.21010000 29288.00
+ NG3P3 CG324 HGA2 5 107.500000 376.560000 0.21010000 29288.00
+ HGA2 CG324 HGA2 5 109.000000 297.064000 0.18020000 4518.72
+ HGP5 CG324 HGP5 5 109.500000 200.832000 0.17670000 23430.40
+ CG1N1 CG331 HGA3 5 110.500000 418.400000 0.00000000 0.00
+ CG1T1 CG331 HGA3 5 111.500000 393.296000 0.00000000 0.00
+ CG2D1 CG331 HGA3 5 111.500000 351.456000 0.00000000 0.00
+ CG2DC1 CG331 HGA3 5 111.500000 351.456000 0.00000000 0.00
+ CG2DC2 CG331 HGA3 5 111.500000 351.456000 0.00000000 0.00
+ CG2N2 CG331 HGA3 5 109.500000 276.144000 0.21300000 25104.00
+ CG2O1 CG331 HGA3 5 109.500000 276.144000 0.21630000 25104.00
+ CG2O2 CG331 HGA3 5 109.500000 276.144000 0.21630000 25104.00
+ CG2O3 CG331 HGA3 5 109.500000 276.144000 0.21630000 25104.00
+ CG2O4 CG331 HGA3 5 109.500000 276.144000 0.21630000 25104.00
+ CG2O5 CG331 HGA3 5 109.500000 418.400000 0.00000000 0.00
+ CG2R51 CG331 HGA3 5 109.500000 460.240000 0.00000000 0.00
+ CG2R61 CG331 HGA3 5 107.500000 412.542400 0.00000000 0.00
+ CG2R62 CG331 HGA3 5 110.100000 279.742240 0.21790000 18853.10
+ CG301 CG331 HGA3 5 110.100000 279.742240 0.21790000 18853.10
+ CG302 CG331 HGA3 5 110.500000 276.144000 0.21550000 32635.20
+ CG311 CG331 HGA3 5 110.100000 279.742240 0.21790000 18853.10
+ CG312 CG331 HGA3 5 110.500000 276.144000 0.21680000 30961.60
+ CG314 CG331 HGA3 5 110.100000 279.742240 0.21790000 18853.10
+ CG321 CG331 HGA3 5 110.100000 289.532800 0.21790000 18853.10
+ CG322 CG331 HGA3 5 110.500000 276.144000 0.21810000 31798.40
+ CG323 CG331 HGA3 5 110.100000 289.532800 0.21790000 18853.10
+ CG324 CG331 HGA3 5 110.100000 289.532800 0.21790000 18853.10
+ CG331 CG331 HGA3 5 110.100000 313.800000 0.21790000 18853.10
+ CG3C51 CG331 HGA3 5 110.100000 289.532800 0.21790000 18853.10
+ CG3RC1 CG331 HGA3 5 110.100000 279.742240 0.21790000 18853.10
+ NG2D1 CG331 HGA3 5 113.500000 351.456000 0.00000000 0.00
+ NG2R51 CG331 HGA3 5 110.100000 279.742240 0.00000000 0.00
+ NG2R61 CG331 HGA3 5 110.100000 279.742240 0.21790000 18853.10
+ NG2S0 CG331 HGA3 5 105.000000 418.400000 0.00000000 0.00
+ NG2S1 CG331 HGA3 5 109.500000 430.952000 0.00000000 0.00
+ NG2S3 CG331 HGA3 5 107.500000 430.952000 0.00000000 0.00
+ NG311 CG331 HGA3 5 109.700000 255.224000 0.21400000 41840.00
+ OG301 CG331 HGA3 5 108.890000 384.091200 0.00000000 0.00
+ OG302 CG331 HGA3 5 109.500000 502.080000 0.00000000 0.00
+ OG303 CG331 HGA3 5 109.500000 502.080000 0.00000000 0.00
+ OG311 CG331 HGA3 5 108.890000 384.091200 0.00000000 0.00
+ OG312 CG331 HGA3 5 118.300000 543.920000 0.00000000 0.00
+ SG301 CG331 HGA3 5 111.000000 317.984000 0.00000000 0.00
+ SG311 CG331 HGA3 5 111.300000 385.764800 0.00000000 0.00
+ SG3O1 CG331 HGA3 5 110.600000 351.456000 0.00000000 0.00
+ SG3O2 CG331 HGA3 5 108.500000 376.560000 0.00000000 0.00
+ SG3O3 CG331 HGA3 5 111.300000 385.764800 0.00000000 0.00
+ HGA3 CG331 HGA3 5 108.400000 297.064000 0.18020000 4518.72
+ NG2O1 CG334 HGA3 5 108.000000 399.990400 0.00000000 0.00
+ NG2P1 CG334 HGA3 5 110.100000 351.456000 0.00000000 0.00
+ NG3P0 CG334 HGP5 5 109.500000 334.720000 0.21300000 22593.60
+ NG3P1 CG334 HGA3 5 102.300000 376.560000 0.21010000 29288.00
+ NG3P3 CG334 HGA3 5 107.500000 376.560000 0.21010000 29288.00
+ HGA3 CG334 HGA3 5 108.400000 297.064000 0.18020000 4518.72
+ HGP5 CG334 HGP5 5 109.500000 200.832000 0.17670000 23430.40
+ NG301 CG3AM0 HGAAM0 5 109.500000 292.880000 0.21400000 41840.00
+ HGAAM0 CG3AM0 HGAAM0 5 108.400000 297.064000 0.18020000 4518.72
+ NG311 CG3AM1 HGAAM1 5 109.700000 255.224000 0.21400000 41840.00
+ HGAAM1 CG3AM1 HGAAM1 5 109.000000 299.574400 0.18020000 4518.72
+ NG321 CG3AM2 HGAAM2 5 109.500000 271.123200 0.21400000 41840.00
+ HGAAM2 CG3AM2 HGAAM2 5 109.470000 292.880000 0.18020000 4518.72
+ CG321 CG3C31 CG3C31 5 116.700000 563.584800 0.00000000 0.00
+ CG321 CG3C31 OG3C31 5 115.500000 505.008800 0.00000000 0.00
+ CG321 CG3C31 HGA1 5 115.400000 251.040000 0.00000000 0.00
+ CG324 CG3C31 CG3C31 5 120.000000 488.272800 0.00000000 0.00
+ CG324 CG3C31 HGA1 5 110.100000 289.532800 0.00000000 0.00
+ CG3C31 CG3C31 CG3C31 5 111.000000 647.264800 0.25610000 6694.40
+ CG3C31 CG3C31 OG3C31 5 103.000000 251.040000 0.00000000 0.00
+ CG3C31 CG3C31 HGA1 5 117.100000 192.464000 0.21790000 18853.10
+ CG3C31 CG3C31 HGA2 5 117.100000 192.464000 0.21790000 18853.10
+ CG3RC1 CG3C31 CG3RC1 5 58.500000 446.432800 0.00000000 0.00
+ CG3RC1 CG3C31 HGA2 5 110.100000 288.696000 0.21790000 18853.10
+ OG3C31 CG3C31 HGA1 5 118.500000 535.552000 0.00000000 0.00
+ OG3C31 CG3C31 HGA2 5 115.000000 573.208000 0.00000000 0.00
+ HGA2 CG3C31 HGA2 5 117.000000 192.464000 0.18020000 4518.72
+ CG2R53 CG3C41 CG3C41 5 106.000000 753.120000 0.00000000 0.00
+ CG2R53 CG3C41 HGA2 5 112.300000 384.928000 0.00000000 0.00
+ CG3C41 CG3C41 CG3C41 5 106.000000 585.760000 0.00000000 0.00
+ CG3C41 CG3C41 NG2R43 5 104.500000 753.120000 0.00000000 0.00
+ CG3C41 CG3C41 HGA2 5 110.500000 384.928000 0.00000000 0.00
+ NG2R43 CG3C41 HGA2 5 110.800000 426.768000 0.00000000 0.00
+ HGA2 CG3C41 HGA2 5 105.000000 234.304000 0.18067000 4518.72
+ CG2O1 CG3C51 CG3C52 5 112.300000 435.136000 0.00000000 0.00
+ CG2O1 CG3C51 NG2S0 5 108.200000 418.400000 0.00000000 0.00
+ CG2O1 CG3C51 HGA1 5 112.000000 418.400000 0.00000000 0.00
+ CG2O3 CG3C51 CG3C52 5 112.300000 435.136000 0.00000000 0.00
+ CG2O3 CG3C51 NG2S0 5 108.200000 418.400000 0.00000000 0.00
+ CG2O3 CG3C51 HGA1 5 112.000000 418.400000 0.00000000 0.00
+ CG311 CG3C51 CG3C52 5 115.000000 485.344000 0.25610000 6694.40
+ CG311 CG3C51 CG3RC1 5 108.000000 435.136000 0.00000000 0.00
+ CG311 CG3C51 HGA1 5 110.100000 289.532800 0.21790000 18853.10
+ CG321 CG3C51 CG3C51 5 115.000000 485.344000 0.25610000 6694.40
+ CG321 CG3C51 CG3C52 5 115.000000 485.344000 0.25610000 6694.40
+ CG321 CG3C51 CG3RC1 5 103.700000 446.432800 0.25610000 6694.40
+ CG321 CG3C51 OG3C51 5 111.500000 376.560000 0.00000000 0.00
+ CG321 CG3C51 HGA1 5 110.100000 289.532800 0.21790000 18853.10
+ CG331 CG3C51 CG3C51 5 115.000000 485.344000 0.25610000 6694.40
+ CG331 CG3C51 CG3C52 5 115.000000 485.344000 0.25610000 6694.40
+ CG331 CG3C51 CG3RC1 5 108.500000 446.432800 0.25610000 6694.40
+ CG331 CG3C51 OG3C51 5 111.500000 376.560000 0.00000000 0.00
+ CG331 CG3C51 HGA1 5 110.100000 289.532800 0.21790000 18853.10
+ CG3C51 CG3C51 CG3C51 5 109.500000 485.344000 0.25610000 9338.69
+ CG3C51 CG3C51 CG3C52 5 109.500000 485.344000 0.25610000 9338.69
+ CG3C51 CG3C51 CG3C53 5 111.000000 446.432800 0.25610000 6694.40
+ CG3C51 CG3C51 CG3RC1 5 103.700000 446.432800 0.25610000 6694.40
+ CG3C51 CG3C51 NG2R51 5 111.000000 920.480000 0.00000000 0.00
+ CG3C51 CG3C51 NG2R61 5 111.000000 920.480000 0.00000000 0.00
+ CG3C51 CG3C51 NG2S3 5 110.000000 365.681600 0.00000000 0.00
+ CG3C51 CG3C51 NG301 5 111.000000 920.480000 0.00000000 0.00
+ CG3C51 CG3C51 NG321 5 107.500000 566.513600 0.00000000 0.00
+ CG3C51 CG3C51 OG303 5 109.700000 962.320000 0.00000000 0.00
+ CG3C51 CG3C51 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG3C51 CG3C51 OG3C51 5 111.100000 376.560000 0.00000000 0.00
+ CG3C51 CG3C51 FGA1 5 112.000000 368.192000 0.23690000 25104.00
+ CG3C51 CG3C51 HGA1 5 111.400000 292.880000 0.21790000 18853.10
+ CG3C51 CG3C51 HGA6 5 111.400000 292.880000 0.21790000 18853.10
+ CG3C52 CG3C51 CG3C52 5 109.500000 485.344000 0.25610000 9338.69
+ CG3C52 CG3C51 CG3RC1 5 103.700000 446.432800 0.25610000 6694.40
+ CG3C52 CG3C51 NG2R51 5 113.700000 1171.520000 0.00000000 0.00
+ CG3C52 CG3C51 NG2R61 5 113.700000 920.480000 0.00000000 0.00
+ CG3C52 CG3C51 NG2S0 5 110.800000 585.760000 0.00000000 0.00
+ CG3C52 CG3C51 NG2S3 5 110.000000 365.681600 0.00000000 0.00
+ CG3C52 CG3C51 NG321 5 107.500000 566.513600 0.00000000 0.00
+ CG3C52 CG3C51 OG301 5 106.500000 485.344000 0.25610000 6694.40
+ CG3C52 CG3C51 OG303 5 109.700000 962.320000 0.00000000 0.00
+ CG3C52 CG3C51 OG311 5 110.000000 633.457600 0.00000000 0.00
+ CG3C52 CG3C51 OG3C51 5 111.100000 376.560000 0.00000000 0.00
+ CG3C52 CG3C51 FGA1 5 112.000000 368.192000 0.23690000 25104.00
+ CG3C52 CG3C51 HGA1 5 111.400000 292.880000 0.21790000 18853.10
+ CG3C52 CG3C51 HGA6 5 111.400000 292.880000 0.21790000 18853.10
+ CG3C53 CG3C51 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG3C53 CG3C51 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG3RC1 CG3C51 NG2R51 5 108.000000 920.480000 0.00000000 0.00
+ CG3RC1 CG3C51 NG2R61 5 108.000000 920.480000 0.00000000 0.00
+ CG3RC1 CG3C51 OG303 5 110.100000 633.457600 0.00000000 0.00
+ CG3RC1 CG3C51 OG311 5 110.100000 633.457600 0.00000000 0.00
+ CG3RC1 CG3C51 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ NG2R51 CG3C51 OG3C51 5 108.000000 1171.520000 0.00000000 0.00
+ NG2R51 CG3C51 HGA1 5 111.000000 359.824000 0.00000000 0.00
+ NG2R61 CG3C51 OG3C51 5 108.000000 920.480000 0.00000000 0.00
+ NG2R61 CG3C51 HGA1 5 111.000000 359.824000 0.00000000 0.00
+ NG2S0 CG3C51 HGA1 5 112.000000 401.664000 0.00000000 0.00
+ NG2S3 CG3C51 HGA1 5 110.000000 401.664000 0.00000000 0.00
+ NG301 CG3C51 OG3C51 5 112.000000 920.480000 0.00000000 0.00
+ NG301 CG3C51 HGA1 5 111.000000 359.824000 0.00000000 0.00
+ NG321 CG3C51 HGA1 5 109.500000 271.123200 0.21400000 41840.00
+ OG301 CG3C51 HGA1 5 108.500000 384.091200 0.00000000 0.00
+ OG303 CG3C51 HGA1 5 109.500000 502.080000 0.00000000 0.00
+ OG311 CG3C51 HGA1 5 108.890000 384.091200 0.00000000 0.00
+ OG3C51 CG3C51 HGA1 5 107.300000 585.760000 0.00000000 0.00
+ FGA1 CG3C51 HGA6 5 108.890000 481.160000 0.19970000 4184.00
+ CG2R51 CG3C52 CG2R51 5 107.600000 635.968000 0.00000000 0.00
+ CG2R51 CG3C52 CG2R52 5 106.000000 702.912000 0.00000000 0.00
+ CG2R51 CG3C52 CG2R53 5 108.000000 376.560000 0.00000000 0.00
+ CG2R51 CG3C52 CG2RC0 5 107.300000 334.720000 0.00000000 0.00
+ CG2R51 CG3C52 CG3C52 5 106.000000 435.136000 0.00000000 0.00
+ CG2R51 CG3C52 CG3C54 5 103.300000 435.136000 0.00000000 0.00
+ CG2R51 CG3C52 NG2R50 5 111.600000 878.640000 0.00000000 0.00
+ CG2R51 CG3C52 NG3C51 5 105.100000 585.760000 0.00000000 0.00
+ CG2R51 CG3C52 OG3C51 5 102.400000 627.600000 0.00000000 0.00
+ CG2R51 CG3C52 HGA2 5 112.600000 435.136000 0.00000000 0.00
+ CG2R52 CG3C52 CG2RC0 5 105.000000 585.760000 0.00000000 0.00
+ CG2R52 CG3C52 CG3C52 5 99.000000 669.440000 0.00000000 0.00
+ CG2R52 CG3C52 HGA2 5 112.200000 485.344000 0.00000000 0.00
+ CG2R53 CG3C52 CG3C52 5 106.500000 585.760000 0.00000000 0.00
+ CG2R53 CG3C52 HGA2 5 111.000000 485.344000 0.00000000 0.00
+ CG2RC0 CG3C52 CG2RC0 5 95.000000 334.720000 0.00000000 0.00
+ CG2RC0 CG3C52 CG3C52 5 108.200000 543.920000 0.00000000 0.00
+ CG2RC0 CG3C52 HGA2 5 114.000000 317.984000 0.00000000 0.00
+ CG3C51 CG3C52 CG3C51 5 109.500000 485.344000 0.25610000 9338.69
+ CG3C51 CG3C52 CG3C52 5 109.500000 485.344000 0.25610000 9338.69
+ CG3C51 CG3C52 CG3RC1 5 105.500000 669.440000 0.25610000 6694.40
+ CG3C51 CG3C52 NG3C51 5 107.600000 702.912000 0.00000000 0.00
+ CG3C51 CG3C52 OG3C51 5 111.100000 376.560000 0.00000000 0.00
+ CG3C51 CG3C52 HGA2 5 111.400000 292.880000 0.21790000 18853.10
+ CG3C52 CG3C52 CG3C52 5 109.500000 485.344000 0.25610000 9338.69
+ CG3C52 CG3C52 CG3C53 5 108.500000 585.760000 0.00000000 0.00
+ CG3C52 CG3C52 CG3C54 5 108.500000 585.760000 0.00000000 0.00
+ CG3C52 CG3C52 CG3RC1 5 111.000000 446.432800 0.25610000 6694.40
+ CG3C52 CG3C52 NG2R50 5 107.100000 334.720000 0.00000000 0.00
+ CG3C52 CG3C52 NG2R53 5 104.500000 753.120000 0.00000000 0.00
+ CG3C52 CG3C52 NG2S0 5 110.500000 585.760000 0.00000000 0.00
+ CG3C52 CG3C52 NG3C51 5 107.600000 702.912000 0.00000000 0.00
+ CG3C52 CG3C52 OG3C51 5 111.100000 376.560000 0.00000000 0.00
+ CG3C52 CG3C52 HGA2 5 111.400000 292.880000 0.21790000 18853.10
+ CG3C53 CG3C52 HGA2 5 110.100000 279.742240 0.21790000 18853.10
+ CG3C54 CG3C52 NG3C51 5 110.400000 728.016000 0.00000000 0.00
+ CG3C54 CG3C52 HGA2 5 110.100000 221.752000 0.21790000 18853.10
+ CG3RC1 CG3C52 CG3RC1 5 105.300000 485.344000 0.00000000 0.00
+ CG3RC1 CG3C52 HGA2 5 110.100000 288.696000 0.21790000 18853.10
+ NG2R50 CG3C52 HGA2 5 109.800000 368.192000 0.00000000 0.00
+ NG2R53 CG3C52 HGA2 5 111.000000 493.712000 0.00000000 0.00
+ NG2S0 CG3C52 HGA2 5 108.000000 401.664000 0.00000000 0.00
+ NG3C51 CG3C52 HGA2 5 109.000000 451.872000 0.00000000 0.00
+ OG3C51 CG3C52 OG3C51 5 108.100000 711.280000 0.00000000 0.00
+ OG3C51 CG3C52 HGA2 5 107.300000 585.760000 0.00000000 0.00
+ HGA2 CG3C52 HGA2 5 106.800000 322.168000 0.18020000 4518.72
+ CG2O1 CG3C53 CG3C52 5 112.300000 435.136000 0.00000000 0.00
+ CG2O1 CG3C53 NG3P2 5 106.000000 418.400000 0.00000000 0.00
+ CG2O1 CG3C53 HGA1 5 112.000000 418.400000 0.00000000 0.00
+ CG2O3 CG3C53 CG3C52 5 112.300000 435.136000 0.00000000 0.00
+ CG2O3 CG3C53 NG3P2 5 106.000000 418.400000 0.00000000 0.00
+ CG2O3 CG3C53 HGA1 5 112.000000 418.400000 0.00000000 0.00
+ CG3C51 CG3C53 NG2R61 5 111.000000 920.480000 0.00000000 0.00
+ CG3C51 CG3C53 OG3C51 5 106.250000 1004.160000 0.00000000 0.00
+ CG3C51 CG3C53 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG3C52 CG3C53 NG3P2 5 108.500000 585.760000 0.00000000 0.00
+ CG3C52 CG3C53 HGA1 5 118.000000 292.880000 0.00000000 0.00
+ NG2R61 CG3C53 OG3C51 5 108.000000 920.480000 0.00000000 0.00
+ NG2R61 CG3C53 HGA1 5 111.000000 359.824000 0.00000000 0.00
+ NG3P2 CG3C53 HGA1 5 107.500000 430.952000 0.00000000 0.00
+ OG3C51 CG3C53 HGA1 5 107.240000 378.233600 0.00000000 0.00
+ CG2R51 CG3C54 NG2R52 5 103.100000 1154.784000 0.00000000 0.00
+ CG2R51 CG3C54 NG3P2 5 103.000000 518.816000 0.00000000 0.00
+ CG2R51 CG3C54 HGA2 5 114.800000 343.088000 0.00000000 0.00
+ CG3C52 CG3C54 NG3P2 5 108.500000 585.760000 0.00000000 0.00
+ CG3C52 CG3C54 HGA2 5 110.100000 221.752000 0.21790000 18853.10
+ CG3C54 CG3C54 NG2R52 5 106.000000 569.024000 0.00000000 0.00
+ CG3C54 CG3C54 HGA2 5 110.100000 221.752000 0.21790000 18853.10
+ NG2R52 CG3C54 HGA2 5 107.000000 451.872000 0.00000000 0.00
+ NG3C51 CG3C54 NG3P2 5 119.000000 719.648000 0.00000000 0.00
+ NG3C51 CG3C54 HGA2 5 114.600000 443.504000 0.00000000 0.00
+ NG3P2 CG3C54 HGA2 5 109.150000 430.952000 0.00000000 0.00
+ HGA2 CG3C54 HGA2 5 109.000000 297.064000 0.18020000 4518.72
+ CG311 CG3RC1 CG331 5 113.500000 488.272800 0.25610000 9338.69
+ CG311 CG3RC1 CG3C51 5 113.500000 488.272800 0.25610000 9338.69
+ CG311 CG3RC1 CG3C52 5 111.000000 446.432800 0.25610000 6694.40
+ CG311 CG3RC1 CG3RC1 5 108.000000 446.432800 0.25610000 6694.40
+ CG311 CG3RC1 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG321 CG3RC1 CG331 5 113.500000 488.272800 0.25610000 9338.69
+ CG321 CG3RC1 CG3C31 5 111.000000 446.432800 0.25610000 6694.40
+ CG321 CG3RC1 CG3C51 5 111.000000 446.432800 0.25610000 6694.40
+ CG321 CG3RC1 CG3C52 5 113.500000 488.272800 0.25610000 9338.69
+ CG321 CG3RC1 CG3RC1 5 111.000000 446.432800 0.25610000 6694.40
+ CG321 CG3RC1 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG331 CG3RC1 CG3C51 5 113.500000 488.272800 0.25610000 9338.69
+ CG331 CG3RC1 CG3RC1 5 113.500000 488.272800 0.25610000 9338.69
+ CG3C31 CG3RC1 CG3C51 5 111.000000 446.432800 0.25610000 6694.40
+ CG3C31 CG3RC1 CG3C52 5 111.000000 446.432800 0.25610000 6694.40
+ CG3C31 CG3RC1 CG3RC1 5 62.500000 446.432800 0.00000000 0.00
+ CG3C31 CG3RC1 NG2R51 5 113.700000 585.760000 0.00000000 0.00
+ CG3C31 CG3RC1 NG2R61 5 113.700000 585.760000 0.00000000 0.00
+ CG3C31 CG3RC1 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG3C51 CG3RC1 CG3C52 5 109.000000 585.760000 0.00000000 0.00
+ CG3C51 CG3RC1 CG3RC1 5 108.000000 446.432800 0.25610000 6694.40
+ CG3C51 CG3RC1 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG3C52 CG3RC1 CG3C52 5 109.400000 468.608000 0.00000000 0.00
+ CG3C52 CG3RC1 CG3RC1 5 111.000000 446.432800 0.25610000 6694.40
+ CG3C52 CG3RC1 NG2R51 5 113.700000 585.760000 0.00000000 0.00
+ CG3C52 CG3RC1 NG2R61 5 113.700000 585.760000 0.00000000 0.00
+ CG3C52 CG3RC1 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CG3RC1 CG3RC1 NG2R51 5 113.700000 585.760000 0.00000000 0.00
+ CG3RC1 CG3RC1 NG2R61 5 113.700000 585.760000 0.00000000 0.00
+ CG3RC1 CG3RC1 OG3C51 5 109.000000 418.400000 0.00000000 0.00
+ CG3RC1 CG3RC1 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ OG3C51 CG3RC1 OG3C51 5 105.000000 585.760000 0.00000000 0.00
+ OG3C51 CG3RC1 HGA1 5 106.000000 460.240000 0.00000000 0.00
+ CG2D1 NG2D1 CG331 5 111.000000 560.656000 0.00000000 0.00
+ CG2D1 NG2D1 NG2S1 5 115.000000 836.800000 0.00000000 0.00
+ CG2DC1 NG2D1 NG2S1 5 115.000000 836.800000 0.00000000 0.00
+ CG2DC2 NG2D1 NG2S1 5 115.000000 836.800000 0.00000000 0.00
+ CG2N1 NG2D1 CG331 5 108.000000 418.400000 0.00000000 0.00
+ CG2N1 NG2D1 HGP1 5 113.000000 410.032000 0.00000000 0.00
+ CG2O7 NG2D1 CG331 5 136.000000 75.312000 0.00000000 0.00
+ CG2R61 NG2O1 OG2N1 5 116.000000 543.920000 0.00000000 0.00
+ CG324 NG2O1 OG2N1 5 117.000000 468.608000 0.00000000 0.00
+ CG334 NG2O1 OG2N1 5 120.000000 502.080000 0.00000000 0.00
+ OG2N1 NG2O1 OG2N1 5 128.000000 878.640000 0.00000000 0.00
+ CG2D1 NG2P1 CG334 5 123.600000 560.656000 0.00000000 0.00
+ CG2D1 NG2P1 HGP2 5 118.800000 317.984000 0.00000000 0.00
+ CG2DC1 NG2P1 CG334 5 123.600000 560.656000 0.00000000 0.00
+ CG2DC1 NG2P1 HGP2 5 118.800000 317.984000 0.00000000 0.00
+ CG2DC2 NG2P1 CG334 5 123.600000 560.656000 0.00000000 0.00
+ CG2DC2 NG2P1 HGP2 5 118.800000 317.984000 0.00000000 0.00
+ CG2N1 NG2P1 CG324 5 120.000000 521.326400 0.00000000 0.00
+ CG2N1 NG2P1 CG334 5 120.000000 521.326400 0.00000000 0.00
+ CG2N1 NG2P1 HGP2 5 120.000000 410.032000 0.00000000 0.00
+ CG2N2 NG2P1 HGP2 5 120.000000 334.720000 0.00000000 0.00
+ CG324 NG2P1 HGP2 5 120.000000 338.067200 0.00000000 0.00
+ CG334 NG2P1 HGP2 5 120.000000 338.067200 0.00000000 0.00
+ HGP2 NG2P1 HGP2 5 120.000000 209.200000 0.00000000 0.00
+ CG2R53 NG2R43 CG3C41 5 111.500000 711.280000 0.00000000 0.00
+ CG2R53 NG2R43 HGP1 5 129.700000 284.512000 0.00000000 0.00
+ CG3C41 NG2R43 HGP1 5 125.300000 284.512000 0.00000000 0.00
+ CG2R51 NG2R50 CG2R52 5 103.000000 485.344000 0.00000000 0.00
+ CG2R51 NG2R50 CG2R53 5 103.500000 1087.840000 0.00000000 0.00
+ CG2R51 NG2R50 NG2R50 5 106.800000 920.480000 0.00000000 0.00
+ CG2R52 NG2R50 CG2RC0 5 103.000000 502.080000 0.00000000 0.00
+ CG2R52 NG2R50 CG3C52 5 102.900000 962.320000 0.00000000 0.00
+ CG2R52 NG2R50 NG2R51 5 103.500000 1338.880000 0.00000000 0.00
+ CG2R52 NG2R50 NG3C51 5 105.500000 1338.880000 0.00000000 0.00
+ CG2R52 NG2R50 OG2R50 5 103.300000 1255.200000 0.00000000 0.00
+ CG2R52 NG2R50 SG2R50 5 111.000000 1255.200000 0.00000000 0.00
+ CG2R53 NG2R50 CG2R53 5 101.000000 836.800000 0.00000000 0.00
+ CG2R53 NG2R50 CG2RC0 5 103.800000 1004.160000 0.00000000 0.00
+ CG2R53 NG2R50 CG3C52 5 101.900000 1338.880000 0.00000000 0.00
+ CG2R53 NG2R50 NG2R51 5 101.000000 836.800000 0.00000000 0.00
+ CG2R53 NG2R50 OG2R50 5 103.000000 418.400000 0.00000000 0.00
+ NG2R50 NG2R50 NG2R51 5 102.200000 1338.880000 0.00000000 0.00
+ NG2R50 NG2R50 OG2R50 5 103.000000 920.480000 0.00000000 0.00
+ CG2R51 NG2R51 CG2R51 5 109.000000 836.800000 0.00000000 0.00
+ CG2R51 NG2R51 CG2R53 5 107.500000 1087.840000 0.00000000 0.00
+ CG2R51 NG2R51 CG2RC0 5 110.000000 711.280000 0.00000000 0.00
+ CG2R51 NG2R51 CG321 5 127.100000 585.760000 0.00000000 0.00
+ CG2R51 NG2R51 CG3C51 5 126.000000 1087.840000 0.00000000 0.00
+ CG2R51 NG2R51 NG2R50 5 115.000000 1338.880000 0.00000000 0.00
+ CG2R51 NG2R51 HGP1 5 125.500000 251.040000 0.21500000 16736.00
+ CG2R53 NG2R51 CG2RC0 5 107.200000 836.800000 0.00000000 0.00
+ CG2R53 NG2R51 CG331 5 127.800000 585.760000 0.00000000 0.00
+ CG2R53 NG2R51 CG3C51 5 126.300000 376.560000 0.00000000 0.00
+ CG2R53 NG2R51 CG3RC1 5 127.600000 376.560000 0.00000000 0.00
+ CG2R53 NG2R51 NG2R50 5 114.000000 1087.840000 0.00000000 0.00
+ CG2R53 NG2R51 HGP1 5 127.000000 251.040000 0.21400000 16736.00
+ CG2RC0 NG2R51 CG2RC0 5 110.000000 711.280000 0.00000000 0.00
+ CG2RC0 NG2R51 CG331 5 125.900000 585.760000 0.00000000 0.00
+ CG2RC0 NG2R51 CG3C51 5 126.500000 376.560000 0.00000000 0.00
+ CG2RC0 NG2R51 CG3RC1 5 126.500000 376.560000 0.00000000 0.00
+ CG2RC0 NG2R51 NG2R50 5 114.500000 1589.920000 0.00000000 0.00
+ CG2RC0 NG2R51 HGP1 5 126.000000 234.304000 0.00000000 0.00
+ CG321 NG2R51 NG2R50 5 117.900000 585.760000 0.00000000 0.00
+ NG2R50 NG2R51 NG2R50 5 121.000000 753.120000 0.00000000 0.00
+ NG2R50 NG2R51 HGP1 5 119.500000 267.776000 0.00000000 0.00
+ CG2R51 NG2R52 CG2R53 5 108.000000 1213.360000 0.00000000 0.00
+ CG2R51 NG2R52 HGP2 5 124.900000 209.200000 0.21300000 12552.00
+ CG2R52 NG2R52 CG3C54 5 111.900000 845.168000 0.00000000 0.00
+ CG2R52 NG2R52 HGP2 5 123.200000 242.672000 0.00000000 0.00
+ CG2R53 NG2R52 CG3C54 5 108.000000 1171.520000 0.00000000 0.00
+ CG2R53 NG2R52 HGP2 5 127.100000 209.200000 0.20900000 12552.00
+ CG3C54 NG2R52 HGP2 5 124.900000 242.672000 0.00000000 0.00
+ CG251O NG2R53 CG2R53 5 117.500000 970.688000 0.00000000 0.00
+ CG251O NG2R53 HGP1 5 123.000000 317.984000 0.00000000 0.00
+ CG252O NG2R53 CG2R53 5 117.500000 970.688000 0.00000000 0.00
+ CG252O NG2R53 HGP1 5 123.000000 317.984000 0.00000000 0.00
+ CG2R53 NG2R53 CG2R53 5 120.500000 460.240000 0.00000000 0.00
+ CG2R53 NG2R53 CG311 5 120.000000 418.400000 0.00000000 0.00
+ CG2R53 NG2R53 CG3C52 5 111.000000 627.600000 0.00000000 0.00
+ CG2R53 NG2R53 HGP1 5 119.500000 317.984000 0.00000000 0.00
+ CG3C52 NG2R53 HGP1 5 116.000000 317.984000 0.00000000 0.00
+ CG2R51 NG2R57 CG2R51 5 109.000000 836.800000 0.00000000 0.00
+ CG2R51 NG2R57 CG2R57 5 125.500000 351.456000 0.00000000 0.00
+ CG2R51 NG2R57 NG2R57 5 125.500000 451.872000 0.00000000 0.00
+ CG2R61 NG2R60 CG2R61 5 112.000000 167.360000 0.00000000 0.00
+ CG2R61 NG2R60 CG2R64 5 112.000000 167.360000 0.00000000 0.00
+ CG2R61 NG2R60 CG2R67 5 109.200000 167.360000 0.00000000 0.00
+ CG2R61 NG2R61 CG2R63 5 123.900000 83.680000 0.00000000 0.00
+ CG2R61 NG2R61 HGP1 5 120.700000 276.144000 0.00000000 0.00
+ CG2R62 NG2R61 CG2R62 5 120.000000 251.040000 0.00000000 0.00
+ CG2R62 NG2R61 CG2R63 5 122.000000 585.760000 0.00000000 0.00
+ CG2R62 NG2R61 CG331 5 120.500000 585.760000 0.00000000 0.00
+ CG2R62 NG2R61 CG3C51 5 118.400000 376.560000 0.00000000 0.00
+ CG2R62 NG2R61 CG3C53 5 118.400000 376.560000 0.00000000 0.00
+ CG2R62 NG2R61 CG3RC1 5 115.900000 376.560000 0.00000000 0.00
+ CG2R62 NG2R61 HGP1 5 117.400000 267.776000 0.00000000 0.00
+ CG2R62 NG2R61 HGP2 5 117.400000 267.776000 0.00000000 0.00
+ CG2R63 NG2R61 CG2R63 5 130.200000 418.400000 0.00000000 0.00
+ CG2R63 NG2R61 CG2R64 5 131.100000 585.760000 0.00000000 0.00
+ CG2R63 NG2R61 CG331 5 115.400000 585.760000 0.00000000 0.00
+ CG2R63 NG2R61 CG3C51 5 118.400000 376.560000 0.00000000 0.00
+ CG2R63 NG2R61 CG3RC1 5 120.000000 376.560000 0.00000000 0.00
+ CG2R63 NG2R61 HGP1 5 115.400000 338.904000 0.00000000 0.00
+ CG2R64 NG2R61 HGP1 5 115.600000 376.560000 0.00000000 0.00
+ CG2R61 NG2R62 CG2R64 5 110.500000 334.720000 0.00000000 0.00
+ CG2R61 NG2R62 NG2R62 5 120.000000 83.680000 0.00000000 0.00
+ CG2R62 NG2R62 CG2R64 5 115.500000 585.760000 0.00000000 0.00
+ CG2R63 NG2R62 CG2R64 5 119.100000 711.280000 0.00000000 0.00
+ CG2R64 NG2R62 CG2R64 5 117.800000 753.120000 0.00000000 0.00
+ CG2R64 NG2R62 CG2RC0 5 115.100000 753.120000 0.00000000 0.00
+ CG2R64 NG2R62 NG2R62 5 121.000000 543.920000 0.00000000 0.00
+ CG2R62 NG2R67 CG2R62 5 120.000000 251.040000 0.00000000 0.00
+ CG2R62 NG2R67 CG2R63 5 128.700000 585.760000 0.00000000 0.00
+ CG2R62 NG2R67 CG2R67 5 120.000000 435.136000 0.00000000 0.00
+ CG2R63 NG2R67 CG2R63 5 128.700000 418.400000 0.00000000 0.00
+ CG2R63 NG2R67 CG2R64 5 126.100000 585.760000 0.00000000 0.00
+ CG2R63 NG2R67 CG2R67 5 111.300000 276.144000 0.00000000 0.00
+ CG2R64 NG2R67 CG2R67 5 121.000000 460.240000 0.00000000 0.00
+ CG2R51 NG2RC0 CG2R61 5 130.500000 125.520000 0.00000000 0.00
+ CG2R51 NG2RC0 CG2RC0 5 109.700000 836.800000 0.00000000 0.00
+ CG2R61 NG2RC0 CG2RC0 5 119.800000 125.520000 0.00000000 0.00
+ CG2O1 NG2S0 CG331 5 119.500000 351.456000 0.00000000 0.00
+ CG2O1 NG2S0 CG3C51 5 117.000000 502.080000 0.00000000 0.00
+ CG2O1 NG2S0 CG3C52 5 117.000000 502.080000 0.00000000 0.00
+ CG331 NG2S0 CG331 5 121.000000 376.560000 0.00000000 0.00
+ CG3C51 NG2S0 CG3C52 5 114.200000 836.800000 0.00000000 0.00
+ CG2O1 NG2S1 CG2R61 5 120.000000 418.400000 0.00000000 0.00
+ CG2O1 NG2S1 CG2R64 5 120.000000 418.400000 0.00000000 0.00
+ CG2O1 NG2S1 CG311 5 120.000000 418.400000 0.00000000 0.00
+ CG2O1 NG2S1 CG321 5 120.000000 418.400000 0.00000000 0.00
+ CG2O1 NG2S1 CG331 5 120.000000 418.400000 0.00000000 0.00
+ CG2O1 NG2S1 NG2D1 5 115.000000 418.400000 0.00000000 0.00
+ CG2O1 NG2S1 HGP1 5 123.000000 284.512000 0.00000000 0.00
+ CG2O6 NG2S1 CG321 5 120.000000 502.080000 0.00000000 0.00
+ CG2O6 NG2S1 CG331 5 120.000000 502.080000 0.00000000 0.00
+ CG2O6 NG2S1 HGP1 5 121.500000 334.720000 0.00000000 0.00
+ CG2R61 NG2S1 HGP1 5 117.000000 284.512000 0.00000000 0.00
+ CG2R64 NG2S1 HGP1 5 117.000000 284.512000 0.00000000 0.00
+ CG311 NG2S1 HGP1 5 117.000000 292.880000 0.00000000 0.00
+ CG321 NG2S1 HGP1 5 117.000000 292.880000 0.00000000 0.00
+ CG331 NG2S1 HGP1 5 117.000000 292.880000 0.00000000 0.00
+ NG2D1 NG2S1 HGP1 5 122.000000 284.512000 0.00000000 0.00
+ CG2O1 NG2S2 HGP1 5 120.000000 418.400000 0.00000000 0.00
+ CG2O6 NG2S2 HGP1 5 120.000000 418.400000 0.00000000 0.00
+ HGP1 NG2S2 HGP1 5 120.000000 192.464000 0.00000000 0.00
+ CG2R61 NG2S3 HGP4 5 111.600000 502.080000 0.00000000 0.00
+ CG2R64 NG2S3 HGP4 5 121.500000 334.720000 0.00000000 0.00
+ CG321 NG2S3 SG3O1 5 104.900000 491.201600 0.00000000 0.00
+ CG321 NG2S3 HGP1 5 109.500000 433.462400 0.00000000 0.00
+ CG331 NG2S3 PG1 5 118.300000 920.480000 0.23300000 29288.00
+ CG331 NG2S3 SG3O1 5 103.100000 330.536000 0.00000000 0.00
+ CG331 NG2S3 HGP1 5 109.000000 292.880000 0.00000000 0.00
+ CG3C51 NG2S3 PG1 5 118.300000 920.480000 0.23300000 29288.00
+ CG3C51 NG2S3 HGP1 5 109.000000 292.880000 0.00000000 0.00
+ PG1 NG2S3 HGP1 5 123.600000 251.040000 0.23500000 33472.00
+ SG3O1 NG2S3 HGP1 5 113.100000 393.296000 0.00000000 0.00
+ HGP4 NG2S3 HGP4 5 117.000000 259.408000 0.00000000 0.00
+ CG2D1O NG301 CG2D1O 5 114.000000 167.360000 0.00000000 0.00
+ CG2D1O NG301 CG3C51 5 121.700000 585.760000 0.00000000 0.00
+ CG2D2O NG301 CG2D2O 5 114.000000 167.360000 0.00000000 0.00
+ CG2D2O NG301 CG3C51 5 121.700000 585.760000 0.00000000 0.00
+ CG3AM0 NG301 CG3AM0 5 110.900000 443.504000 0.00000000 0.00
+ CG2D1O NG311 CG2D1O 5 114.000000 167.360000 0.00000000 0.00
+ CG2D1O NG311 HGPAM1 5 123.000000 326.352000 0.00000000 0.00
+ CG2D2O NG311 CG2D2O 5 114.000000 167.360000 0.00000000 0.00
+ CG2D2O NG311 HGPAM1 5 123.000000 326.352000 0.00000000 0.00
+ CG2N1 NG311 CG331 5 106.000000 359.824000 0.00000000 0.00
+ CG2N1 NG311 HGPAM1 5 106.000000 376.560000 0.00000000 0.00
+ CG2R61 NG311 CG2R61 5 109.000000 334.720000 0.00000000 0.00
+ CG2R61 NG311 CG321 5 113.000000 460.240000 0.00000000 0.00
+ CG2R61 NG311 SG3O2 5 115.000000 292.880000 0.00000000 0.00
+ CG2R61 NG311 HGP1 5 114.000000 334.720000 0.00000000 0.00
+ CG2R61 NG311 HGPAM1 5 115.000000 376.560000 0.00000000 0.00
+ CG321 NG311 SG3O2 5 115.000000 502.080000 0.00000000 0.00
+ CG321 NG311 HGP1 5 111.000000 384.928000 0.00000000 0.00
+ CG321 NG311 HGPAM1 5 111.000000 292.880000 0.00000000 0.00
+ CG331 NG311 SG3O2 5 114.000000 569.024000 0.00000000 0.00
+ CG331 NG311 HGP1 5 111.500000 353.966400 0.00000000 0.00
+ CG331 NG311 HGPAM1 5 104.000000 376.560000 0.00000000 0.00
+ CG3AM1 NG311 CG3AM1 5 112.200000 338.904000 0.24217000 4184.00
+ CG3AM1 NG311 HGPAM1 5 108.900000 352.292800 0.20292000 4184.00
+ SG3O2 NG311 HGP1 5 113.200000 353.966400 0.00000000 0.00
+ CG2D1O NG321 HGPAM2 5 113.000000 460.240000 0.00000000 0.00
+ CG2D2O NG321 HGPAM2 5 113.000000 460.240000 0.00000000 0.00
+ CG2N1 NG321 HGPAM2 5 108.000000 460.240000 0.00000000 0.00
+ CG321 NG321 HGPAM2 5 112.100000 343.088000 0.00000000 0.00
+ CG3AM2 NG321 HGPAM2 5 112.100000 343.088000 0.00000000 0.00
+ CG3C51 NG321 HGPAM2 5 112.100000 343.088000 0.00000000 0.00
+ SG3O2 NG321 HGP1 5 115.000000 410.032000 0.00000000 0.00
+ HGP1 NG321 HGP1 5 110.000000 317.984000 0.00000000 0.00
+ HGPAM2 NG321 HGPAM2 5 105.850000 351.456000 0.00000000 0.00
+ HGPAM3 NG331 HGPAM3 5 107.100000 347.272000 0.00000000 0.00
+ CG2R51 NG3C51 CG3C52 5 104.800000 376.560000 0.00000000 0.00
+ CG2R51 NG3C51 HGP1 5 113.900000 359.824000 0.00000000 0.00
+ CG2R53 NG3C51 CG3C52 5 107.000000 334.720000 0.00000000 0.00
+ CG2R53 NG3C51 HGP1 5 115.600000 359.824000 0.00000000 0.00
+ CG2RC0 NG3C51 CG3C52 5 106.900000 502.080000 0.00000000 0.00
+ CG2RC0 NG3C51 HGP1 5 114.500000 343.088000 0.00000000 0.00
+ CG3C52 NG3C51 CG3C52 5 103.700000 1171.520000 0.00000000 0.00
+ CG3C52 NG3C51 CG3C54 5 104.100000 560.656000 0.00000000 0.00
+ CG3C52 NG3C51 NG2R50 5 109.000000 393.296000 0.00000000 0.00
+ CG3C52 NG3C51 NG3P2 5 103.900000 393.296000 0.00000000 0.00
+ CG3C52 NG3C51 HGP1 5 112.000000 359.824000 0.00000000 0.00
+ CG3C54 NG3C51 HGP1 5 109.250000 418.400000 0.00000000 0.00
+ NG2R50 NG3C51 HGP1 5 103.600000 418.400000 0.00000000 0.00
+ NG3P2 NG3C51 HGP1 5 100.600000 468.608000 0.00000000 0.00
+ CG2R61 NG3N1 NG3N1 5 112.000000 502.080000 0.00000000 0.00
+ CG2R61 NG3N1 HGP1 5 115.000000 435.136000 0.00000000 0.00
+ NG3N1 NG3N1 HGP1 5 102.000000 460.240000 0.00000000 0.00
+ HGP1 NG3N1 HGP1 5 102.000000 418.400000 0.00000000 0.00
+ CG324 NG3P0 CG324 5 109.500000 502.080000 0.24660000 21756.80
+ CG324 NG3P0 CG334 5 109.500000 502.080000 0.24660000 21756.80
+ CG334 NG3P0 CG334 5 109.500000 502.080000 0.24660000 21756.80
+ CG334 NG3P0 OG311 5 100.000000 577.392000 0.00000000 0.00
+ CG334 NG3P0 OG312 5 112.000000 669.440000 0.00000000 0.00
+ CG324 NG3P1 CG324 5 115.200000 376.560000 0.00000000 0.00
+ CG324 NG3P1 CG334 5 109.500000 376.560000 0.00000000 0.00
+ CG324 NG3P1 HGP2 5 110.800000 251.040000 0.20740000 22593.60
+ CG334 NG3P1 HGP2 5 110.800000 251.040000 0.20740000 22593.60
+ CG2R51 NG3P2 CG3C54 5 107.000000 711.280000 0.00000000 0.00
+ CG2R51 NG3P2 HGP2 5 112.000000 317.984000 0.00000000 0.00
+ CG314 NG3P2 CG324 5 115.200000 376.560000 0.00000000 0.00
+ CG314 NG3P2 HGP2 5 110.800000 251.040000 0.20740000 22593.60
+ CG324 NG3P2 CG324 5 115.200000 334.720000 0.00000000 0.00
+ CG324 NG3P2 HGP2 5 110.800000 251.040000 0.20740000 22593.60
+ CG3C53 NG3P2 CG3C54 5 111.000000 836.800000 0.00000000 0.00
+ CG3C53 NG3P2 HGP2 5 109.500000 276.144000 0.20560000 3347.20
+ CG3C54 NG3P2 CG3C54 5 113.000000 870.272000 0.00000000 0.00
+ CG3C54 NG3P2 NG3C51 5 114.200000 1129.680000 0.00000000 0.00
+ CG3C54 NG3P2 HGP2 5 109.500000 276.144000 0.20560000 3347.20
+ NG3C51 NG3P2 HGP2 5 106.300000 351.456000 0.00000000 0.00
+ HGP2 NG3P2 HGP2 5 107.500000 426.768000 0.00000000 0.00
+ CG314 NG3P3 HGP2 5 109.500000 251.040000 0.20740000 16736.00
+ CG324 NG3P3 HGP2 5 109.500000 251.040000 0.20740000 16736.00
+ CG334 NG3P3 HGP2 5 109.500000 251.040000 0.20740000 16736.00
+ HGP2 NG3P3 HGP2 5 109.500000 368.192000 0.00000000 0.00
+ CG2R51 OG2R50 CG2R51 5 106.000000 836.800000 0.00000000 0.00
+ CG2R51 OG2R50 CG2R53 5 104.000000 1171.520000 0.00000000 0.00
+ CG2R51 OG2R50 CG2RC0 5 104.000000 418.400000 0.00000000 0.00
+ CG2R51 OG2R50 NG2R50 5 108.500000 1255.200000 0.00000000 0.00
+ CG2R53 OG2R50 NG2R50 5 109.300000 1380.720000 0.00000000 0.00
+ CG2D1O OG301 CG331 5 109.000000 443.504000 0.00000000 0.00
+ CG2D2O OG301 CG331 5 109.000000 443.504000 0.00000000 0.00
+ CG2R61 OG301 CG2R61 5 120.000000 1548.080000 0.00000000 0.00
+ CG2R61 OG301 CG321 5 108.000000 543.920000 0.00000000 0.00
+ CG2R61 OG301 CG331 5 108.000000 543.920000 0.00000000 0.00
+ CG301 OG301 CG331 5 109.700000 794.960000 0.00000000 0.00
+ CG311 OG301 CG331 5 109.700000 794.960000 0.00000000 0.00
+ CG321 OG301 CG321 5 109.700000 794.960000 0.00000000 0.00
+ CG321 OG301 CG331 5 109.700000 794.960000 0.00000000 0.00
+ CG331 OG301 CG331 5 109.700000 794.960000 0.00000000 0.00
+ CG331 OG301 CG3C51 5 107.000000 543.920000 0.00000000 0.00
+ CG2O2 OG302 CG301 5 109.600000 334.720000 0.22651000 25104.00
+ CG2O2 OG302 CG311 5 109.600000 334.720000 0.22651000 25104.00
+ CG2O2 OG302 CG321 5 109.600000 334.720000 0.22651000 25104.00
+ CG2O2 OG302 CG331 5 109.600000 334.720000 0.22651000 25104.00
+ CG2O6 OG302 CG321 5 111.000000 334.720000 0.00000000 0.00
+ CG2O6 OG302 CG331 5 111.000000 334.720000 0.00000000 0.00
+ CG2R61 OG303 PG1 5 120.000000 753.120000 0.23000000 16736.00
+ CG2R61 OG303 SG3O2 5 108.000000 276.144000 0.00000000 0.00
+ CG311 OG303 PG2 5 120.000000 167.360000 0.23300000 29288.00
+ CG321 OG303 PG1 5 120.000000 167.360000 0.23300000 29288.00
+ CG321 OG303 PG2 5 120.000000 167.360000 0.23300000 29288.00
+ CG321 OG303 SG3O1 5 109.000000 125.520000 0.19000000 22593.60
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+ CG331 OG303 PG1 5 120.000000 167.360000 0.23300000 29288.00
+ CG331 OG303 PG2 5 120.000000 167.360000 0.23300000 29288.00
+ CG331 OG303 SG3O1 5 109.000000 125.520000 0.19000000 22593.60
+ CG331 OG303 SG3O2 5 113.000000 401.664000 0.00000000 0.00
+ CG3C51 OG303 PG1 5 120.000000 167.360000 0.23300000 29288.00
+ CG3C51 OG303 PG2 5 120.000000 167.360000 0.23300000 29288.00
+ PG1 OG304 PG1 5 143.000000 376.560000 0.32500000 33472.00
+ PG1 OG304 PG2 5 139.500000 376.560000 0.30500000 33472.00
+ CG2O2 OG311 HGP1 5 115.000000 460.240000 0.00000000 0.00
+ CG2O6 OG311 HGP1 5 116.000000 510.448000 0.00000000 0.00
+ CG2R61 OG311 HGP1 5 108.000000 543.920000 0.00000000 0.00
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+ CG311 OG311 HGP1 5 106.000000 418.400000 0.00000000 0.00
+ CG321 OG311 HGP1 5 106.000000 418.400000 0.00000000 0.00
+ CG331 OG311 HGP1 5 106.000000 481.160000 0.00000000 0.00
+ CG3C51 OG311 HGP1 5 109.000000 418.400000 0.00000000 0.00
+ NG3P0 OG311 HGP1 5 101.500000 502.080000 0.00000000 0.00
+ PG0 OG311 HGP1 5 115.000000 251.040000 0.23500000 33472.00
+ PG1 OG311 HGP1 5 115.000000 251.040000 0.23500000 33472.00
+ CG3C31 OG3C31 CG3C31 5 97.000000 421.328800 0.00000000 0.00
+ CG2R51 OG3C51 CG2R53 5 104.000000 711.280000 0.00000000 0.00
+ CG2R51 OG3C51 CG3C52 5 104.400000 1046.000000 0.00000000 0.00
+ CG2R53 OG3C51 CG3C52 5 107.100000 753.120000 0.00000000 0.00
+ CG2RC0 OG3C51 CG3C52 5 108.050000 635.968000 0.00000000 0.00
+ CG3C51 OG3C51 CG3C51 5 111.000000 794.960000 0.00000000 0.00
+ CG3C51 OG3C51 CG3C52 5 111.000000 794.960000 0.00000000 0.00
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+ CG3C52 OG3C51 CG3C52 5 111.000000 794.960000 0.00000000 0.00
+ CG3C52 OG3C51 CG3RC1 5 109.000000 1422.560000 0.00000000 0.00
+ CG321 OG3C61 CG321 5 109.700000 794.960000 0.00000000 0.00
+ CG2D1O OG3R60 CG2D1O 5 99.000000 334.720000 0.00000000 0.00
+ CG2D1O OG3R60 CG321 5 99.000000 167.360000 0.00000000 0.00
+ CG2D2O OG3R60 CG2D2O 5 99.000000 334.720000 0.00000000 0.00
+ CG2D2O OG3R60 CG321 5 99.000000 167.360000 0.00000000 0.00
+ CG2R61 OG3R60 CG2R61 5 115.000000 334.720000 0.00000000 0.00
+ CG2R62 OG3R60 CG2R63 5 126.500000 853.536000 0.00000000 0.00
+ OG2P1 PG0 OG303 5 111.600000 827.595200 0.00000000 0.00
+ OG2P1 PG0 OG311 5 108.230000 827.595200 0.00000000 0.00
+ OG303 PG0 OG311 5 108.000000 402.500800 0.00000000 0.00
+ OG311 PG0 OG311 5 104.000000 827.595200 0.00000000 0.00
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+ CG312 PG1 OG311 5 90.000000 753.956800 0.00000000 0.00
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+ CG321 PG1 OG311 5 94.000000 753.956800 0.00000000 0.00
+ NG2S3 PG1 OG2P1 5 110.600000 1171.520000 0.00000000 0.00
+ NG2S3 PG1 OG303 5 103.200000 502.080000 0.00000000 0.00
+ OG2P1 PG1 OG2P1 5 120.000000 870.272000 0.00000000 0.00
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+ OG2P1 PG1 OG304 5 111.600000 743.915200 0.00000000 0.00
+ OG2P1 PG1 OG311 5 111.000000 827.595200 0.00000000 0.00
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+ OG303 PG1 OG311 5 108.000000 402.500800 0.00000000 0.00
+ OG304 PG1 OG304 5 107.500000 402.500800 0.00000000 0.00
+ OG304 PG1 OG311 5 111.000000 402.500800 0.00000000 0.00
+ CG312 PG2 OG2P1 5 94.000000 827.595200 0.00000000 0.00
+ CG321 PG2 OG2P1 5 103.000000 827.595200 0.00000000 0.00
+ OG2P1 PG2 OG2P1 5 121.000000 870.272000 0.00000000 0.00
+ OG2P1 PG2 OG303 5 111.000000 743.915200 0.00000000 0.00
+ OG2P1 PG2 OG304 5 111.600000 743.915200 0.00000000 0.00
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+ CG2R51 SG2R50 CG2R53 5 97.000000 920.480000 0.00000000 0.00
+ CG2R51 SG2R50 CG2RC0 5 99.500000 585.760000 0.00000000 0.00
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+ CG2R53 SG2R50 CG2RC0 5 97.000000 920.480000 0.00000000 0.00
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+ CG251O SG311 CG2R53 5 92.000000 627.600000 0.00000000 0.00
+ CG252O SG311 CG2R53 5 92.000000 627.600000 0.00000000 0.00
+ CG2O6 SG311 CG331 5 96.000000 502.080000 0.00000000 0.00
+ CG2R61 SG311 CG2R61 5 109.000000 418.400000 0.00000000 0.00
+ CG2R64 SG311 CG331 5 91.000000 552.288000 0.00000000 0.00
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+ CG321 SG311 HGP3 5 95.000000 324.678400 0.00000000 0.00
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+ CG2R61 SG3O1 OG2P1 5 98.000000 711.280000 0.00000000 0.00
+ CG321 SG3O1 OG2P1 5 99.000000 669.440000 0.00000000 0.00
+ CG331 SG3O1 OG2P1 5 100.000000 711.280000 0.00000000 0.00
+ NG2S3 SG3O1 OG2P1 5 94.200000 277.817600 0.00000000 0.00
+ OG2P1 SG3O1 OG2P1 5 109.470000 1087.840000 0.24500000 29288.00
+ OG2P1 SG3O1 OG303 5 98.000000 711.280000 0.00000000 0.00
+ CG2R61 SG3O2 NG311 5 97.000000 585.760000 0.00000000 0.00
+ CG2R61 SG3O2 NG321 5 98.000000 502.080000 0.00000000 0.00
+ CG2R61 SG3O2 OG2P1 5 101.000000 502.080000 0.00000000 0.00
+ CG321 SG3O2 CG331 5 102.000000 669.440000 0.00000000 0.00
+ CG321 SG3O2 NG311 5 101.000000 518.816000 0.00000000 0.00
+ CG321 SG3O2 OG2P1 5 107.500000 627.600000 0.00000000 0.00
+ CG331 SG3O2 CG331 5 102.000000 669.440000 0.00000000 0.00
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+ CG331 SG3O2 NG321 5 101.000000 694.544000 0.00000000 0.00
+ CG331 SG3O2 OG2P1 5 108.500000 661.072000 0.00000000 0.00
+ CG331 SG3O2 OG303 5 96.000000 778.224000 0.00000000 0.00
+ NG311 SG3O2 NG311 5 102.300000 695.380800 0.00000000 0.00
+ NG311 SG3O2 OG2P1 5 110.500000 627.600000 0.00000000 0.00
+ NG321 SG3O2 OG2P1 5 111.000000 669.440000 0.00000000 0.00
+ NG321 SG3O2 OG303 5 102.000000 836.800000 0.00000000 0.00
+ OG2P1 SG3O2 OG2P1 5 121.000000 711.280000 0.00000000 0.00
+ OG2P1 SG3O2 OG303 5 109.000000 753.120000 0.00000000 0.00
+ CG321 SG3O3 CG331 5 95.000000 711.280000 0.00000000 0.00
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+ CG331 SG3O3 CG331 5 95.000000 284.512000 0.00000000 0.00
+ CG331 SG3O3 OG2P1 5 106.750000 661.072000 0.00000000 0.00
+ FGP1 ALG1 FGP1 5 109.470000 192.464000 0.28185500 12552.00
+ CC311 CC311 CC321 5 111.000000 446.432800 0.25610000 6694.40
+ CC322 CC312 CC322 5 111.000000 376.560000 0.00000000 0.00
+ CC312 CC312 CC322 5 111.000000 376.560000 0.00000000 0.00
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+ CC322 CC2O3 OC2D3 5 121.500000 627.600000 0.00000000 0.00
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+ CC322 CC2O3 CC322 5 116.000000 292.880000 0.00000000 0.00
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+ CC2O3 CC322 HCA2 5 109.500000 418.400000 0.00000000 0.00
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+ OC311 CC312 CC2O3 5 108.890000 460.240000 0.00000000 0.00
+ CC2O3 CC322 OC311 5 108.890000 460.240000 0.00000000 0.00
+ OC2D4 CC2O4 HCR1 5 118.000000 543.920000 0.00000000 0.00
+ HCR1 CC2O4 CC331 5 116.000000 543.920000 0.00000000 0.00
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+ CC3161 CC3161 CC3161 5 111.000000 446.432800 0.25610000 6694.40
+ CC3261 CC3161 CC3161 5 111.000000 446.432800 0.25610000 6694.40
+ CC3161 CC3161 CC3163 5 111.000000 446.432800 0.25610000 6694.40
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+ CC3163 CC312 CC312 5 111.000000 446.432800 0.25610000 6694.40
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+ CC3161 CC3163 CC321 5 113.500000 488.272800 0.25610000 9338.69
+ CC3161 CC3163 CC312 5 113.500000 488.272800 0.25610000 9338.69
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+ CC2O2 CC301 CC331 5 112.000000 435.136000 0.00000000 0.00
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+ CC321C CC321C CC321C 5 112.000000 488.272800 0.25610000 9338.69
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+ CC321D CC321C CC311C 5 112.000000 488.272800 0.25610000 9338.69
+ CC321D CC311C CC321C 5 112.000000 488.272800 0.25610000 9338.69
+ CC321D CC321C CC321C 5 112.000000 488.272800 0.25610000 9338.69
+ CC311D CC321C CC321C 5 112.000000 488.272800 0.25610000 9338.69
+ CC311C CC321C CC321C 5 112.000000 488.272800 0.25610000 9338.69
+ CC321C CC321D CC321C 5 112.000000 488.272800 0.25610000 9338.69
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+ CC3161 CC3161 HCA1 5 110.100000 288.696000 0.21790000 18853.10
+ CC3161 CC3162 HCA1 5 110.100000 288.696000 0.21790000 18853.10
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+ CC3162 CC3161 HCA1 5 110.100000 288.696000 0.21790000 18853.10
+ CC3163 CC3161 HCA1 5 110.100000 288.696000 0.21790000 18853.10
+ CC3161 CC3163 HCA1 5 110.100000 288.696000 0.21790000 18853.10
+ CC3163 CC312 HCA1 5 110.100000 288.696000 0.21790000 18853.10
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+ CC301 CC331 HCA3 5 110.100000 279.742240 0.21790000 18853.10
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+ HCA1 CC311D CC321C 5 110.100000 288.696000 0.21790000 18853.10
+ HCA1 CC311C CC321C 5 110.100000 288.696000 0.21790000 18853.10
+ HCA1 CC311C CC321D 5 110.100000 288.696000 0.21790000 18853.10
+ HCA2 CC321 CC311C 5 110.100000 279.742240 0.21790000 18853.10
+ HCA2 CC321 CC321 5 110.100000 221.752000 0.21790000 18853.10
+ HCA2 CC321 CC331 5 110.100000 289.532800 0.21790000 18853.10
+ HCA3 CC331 CC321 5 110.100000 289.532800 0.21790000 18853.10
+ HCA2 CC321C CC321C 5 110.100000 288.696000 0.21790000 18853.10
+ HCA2 CC321D CC321C 5 110.100000 288.696000 0.21790000 18853.10
+ HCA2 CC321C CC321D 5 110.100000 288.696000 0.21790000 18853.10
+ HCA2 CC321C CC311D 5 110.100000 288.696000 0.21790000 18853.10
+ HCA2 CC321C CC311C 5 110.100000 288.696000 0.21790000 18853.10
+ HCA2 CC321D CC311C 5 110.100000 288.696000 0.21790000 18853.10
+ CC2O2 CC321 HCA2 5 109.500000 276.144000 0.21630000 25104.00
+ CC3161 CC3161 NC2D1 5 113.500000 585.760000 0.00000000 0.00
+ CC3162 CC3161 NC2D1 5 113.500000 585.760000 0.00000000 0.00
+ CC3163 CC3161 NC2D1 5 113.500000 585.760000 0.00000000 0.00
+ CC331 CC311 NC2D1 5 113.500000 585.760000 0.00000000 0.00
+ NC2D1 CC2O1 CC331 5 116.500000 669.440000 0.00000000 0.00
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+ NC2D1 CC2O1 OC2D1 5 122.500000 669.440000 0.00000000 0.00
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+ NC2D1 CC311 HCA1 5 108.000000 401.664000 0.00000000 0.00
+ NC2D1 CC331 HCA3 5 109.500000 430.952000 0.00000000 0.00
+ HCP1 NC2D1 CC2O1 5 123.000000 284.512000 0.00000000 0.00
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+ HCP1 NC2D1 CC311 5 117.000000 292.880000 0.00000000 0.00
+ HCP1 NC2D1 CC331 5 117.000000 292.880000 0.00000000 0.00
+ HCA2 CC321 HCA2 5 109.000000 297.064000 0.18020000 4518.72
+ HCA2 CC322 HCA2 5 109.000000 297.064000 0.18020000 4518.72
+ HCA2 CC321C HCA2 5 109.000000 297.064000 0.18020000 4518.72
+ HCA2 CC321D HCA2 5 109.000000 297.064000 0.18020000 4518.72
+ HCA2 CC3261 HCA2 5 109.000000 297.064000 0.18020000 4518.72
+ HCA2 CC3263 HCA2 5 109.000000 297.064000 0.18020000 4518.72
+ HCA3 CC331 HCA3 5 108.400000 297.064000 0.18020000 4518.72
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+ CC3161 CC3263 OC3C61 5 110.000000 376.560000 0.00000000 0.00
+ CC3161 CC3162 OC3C61 5 106.000000 376.560000 0.00000000 0.00
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+ CC3161 CC3161 OC311 5 110.100000 633.457600 0.00000000 0.00
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+ OC3C61 CC321C CC311C 5 111.500000 376.560000 0.00000000 0.00
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+ CC331 CC311 OC311M 5 110.100000 633.457600 0.00000000 0.00
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+ CC3162 OC311 HCP1 5 109.000000 418.400000 0.00000000 0.00
+ CC3062 OC311 HCP1 5 109.000000 418.400000 0.00000000 0.00
+ HCP1 OC311 CC311 5 106.000000 418.400000 0.00000000 0.00
+ HCP1 OC311 CC312 5 106.000000 418.400000 0.00000000 0.00
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+ HCP1M OC311M CC321 5 106.000000 418.400000 0.00000000 0.00
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+ CN3 CN3 NN2B 5 123.600000 836.800000 0.00000000 0.00
+ CN1T NN2B HN2 5 122.000000 338.904000 0.00000000 0.00
+ CN3 NN2B HN2 5 116.000000 267.776000 0.00000000 0.00
+ NN2B CN1T ON1 5 121.600000 836.800000 0.00000000 0.00
+ NN2U CN1T ON1 5 124.400000 836.800000 0.00000000 0.00
+ CN1T NN2U HN2 5 114.400000 338.904000 0.00000000 0.00
+ CN1 NN2U HN2 5 115.400000 338.904000 0.00000000 0.00
+ NN2U CN1 ON1 5 121.900000 836.800000 0.00000000 0.00
+ CN3 CN1 ON1 5 125.500000 836.800000 0.00000000 0.00
+ CN1 CN3 HN3 5 120.300000 251.040000 0.00000000 0.00
+ HN3 CN3 NN2B 5 114.300000 251.040000 0.00000000 0.00
+ CN3T CN1 NN2U 5 113.500000 585.760000 0.00000000 0.00
+ CN1 CN3T CN3 5 116.700000 1004.160000 0.00000000 0.00
+ CN3T CN3 NN2B 5 123.600000 1004.160000 0.00000000 0.00
+ CN3T CN1 ON1 5 124.600000 836.800000 0.00000000 0.00
+ CN1 CN3T CN9 5 118.700000 317.984000 0.00000000 0.00
+ CN3 CN3T CN9 5 124.600000 317.984000 0.00000000 0.00
+ CN3T CN3 HN3 5 122.100000 251.040000 0.00000000 0.00
+ CN1T NN2B CN9 5 116.000000 585.760000 0.00000000 0.00
+ CN3 NN2B CN9 5 122.000000 585.760000 0.00000000 0.00
+ CN1 NN2 CN9 5 115.400000 585.760000 0.00000000 0.00
+ CN3 NN2 CN9 5 120.500000 585.760000 0.00000000 0.00
+ CN5 NN2 CN9 5 125.900000 585.760000 0.00000000 0.00
+ CN4 NN2 CN9 5 127.800000 585.760000 0.00000000 0.00
+ CN5 NN2B CN9 5 125.900000 585.760000 0.00000000 0.00
+ CN4 NN2B CN9 5 126.900000 585.760000 0.00000000 0.00
+ CN5 NN2B CN8 5 125.900000 585.760000 0.00000000 0.00
+ CN4 NN2B CN8 5 126.900000 585.760000 0.00000000 0.00
+ NN2B CN8 CN9 5 113.700000 585.760000 0.00000000 0.00
+ CN1T NN2B CN7B 5 118.400000 376.560000 0.00000000 0.00
+ CN3 NN2B CN7B 5 119.600000 376.560000 0.00000000 0.00
+ CN1 NN2 CN7B 5 120.000000 376.560000 0.00000000 0.00
+ CN3 NN2 CN7B 5 115.900000 376.560000 0.00000000 0.00
+ CN5 NN2 CN7B 5 126.100000 376.560000 0.00000000 0.00
+ CN4 NN2 CN7B 5 127.600000 376.560000 0.00000000 0.00
+ CN5 NN2B CN7B 5 126.500000 376.560000 0.00000000 0.00
+ CN4 NN2B CN7B 5 126.300000 376.560000 0.00000000 0.00
+ ON6 CN7B NN2 5 108.000000 920.480000 0.00000000 0.00
+ ON6B CN7B NN2 5 112.000000 920.480000 0.00000000 0.00
+ CN8 CN7B NN2 5 113.700000 920.480000 0.00000000 0.00
+ CN7B CN7B NN2 5 111.000000 920.480000 0.00000000 0.00
+ ON6 CN7B NN2B 5 108.000000 920.480000 0.00000000 0.00
+ ON6B CN7B NN2B 5 112.000000 920.480000 0.00000000 0.00
+ CN8 CN7B NN2B 5 113.700000 920.480000 0.00000000 0.00
+ CN7B CN7B NN2B 5 111.000000 920.480000 0.00000000 0.00
+ HN7 CN7B NN2 5 111.000000 359.824000 0.00000000 0.00
+ HN7 CN7B NN2B 5 111.000000 359.824000 0.00000000 0.00
+ CN9 CN8 HN8 5 110.100000 289.532800 0.21790000 18853.10
+ CN9 CN7 HN7 5 110.100000 289.532800 0.21790000 18853.10
+ HN8 CN8 NN2 5 110.100000 279.742240 0.00000000 0.00
+ HN8 CN8 ON5 5 108.890000 384.091200 0.00000000 0.00
+ CN3 CN9 HN9 5 110.100000 279.742240 0.21790000 18853.10
+ CN3T CN9 HN9 5 110.100000 279.742240 0.21790000 18853.10
+ CN8 CN9 HN9 5 110.100000 289.532800 0.21790000 18853.10
+ HN9 CN9 CN7 5 110.100000 279.742240 0.21790000 18853.10
+ HN9 CN9 NN2 5 110.100000 279.742240 0.00000000 0.00
+ HN9 CN9 NN2B 5 110.100000 279.742240 0.00000000 0.00
+ HN8 CN8 NN2B 5 110.100000 279.742240 0.00000000 0.00
+ HN9 CN9 ON2 5 109.500000 502.080000 0.00000000 0.00
+ CN9 ON2 P 5 120.000000 167.360000 0.23300000 29288.00
+ HN4 ON4 P 5 115.000000 251.040000 0.23500000 33472.00
+ HN4 ON4 P2 5 115.000000 251.040000 0.23500000 33472.00
+ HN5 ON5 CN8 5 106.000000 481.160000 0.00000000 0.00
+ HN5 ON5 CN9 5 106.000000 481.160000 0.00000000 0.00
+ ON2 P ON2 5 104.300000 669.440000 0.00000000 0.00
+ ON2 P2 ON2 5 104.300000 669.440000 0.00000000 0.00
+ ON2 P ON4 5 108.000000 402.500800 0.00000000 0.00
+ ON2 P2 ON4 5 108.000000 402.500800 0.00000000 0.00
+ ON3 P ON4 5 108.230000 827.595200 0.00000000 0.00
+ ON3 P2 ON4 5 108.230000 827.595200 0.00000000 0.00
+ ON4 P ON4 5 104.000000 827.595200 0.00000000 0.00
+ ON4 P2 ON4 5 104.000000 827.595200 0.00000000 0.00
+ CN7 CN8 ON5 5 110.100000 633.457600 0.00000000 0.00
+ HN9 CN9 HN9 5 108.400000 297.064000 0.18020000 4518.72
+ CN7 ON6 CN7B 5 108.000000 920.480000 0.00000000 0.00
+ ON6 CN7B CN8 5 102.000000 753.120000 0.00000000 0.00
+ CN7B CN8 CN7 5 100.000000 669.440000 0.00000000 0.00
+ CN8 CN7 CN7 5 102.000000 502.080000 0.25610000 6694.40
+ CN9 CN7 CN7 5 102.000000 502.080000 0.25610000 6694.40
+ CN7 CN7 ON6 5 104.000000 836.800000 0.00000000 0.00
+ HN7 CN7 ON6 5 107.240000 378.233600 0.00000000 0.00
+ HN7 CN7B ON6 5 107.240000 378.233600 0.00000000 0.00
+ HN7 CN7 CN7 5 108.000000 334.720000 0.00000000 0.00
+ CN7B CN8 HN8 5 110.100000 279.491200 0.21790000 18853.10
+ CN8 CN7B HN7 5 110.100000 279.491200 0.21790000 18853.10
+ HN7 CN7 CN8 5 110.100000 288.696000 0.21790000 18853.10
+ HN8 CN8 CN7 5 110.100000 288.947040 0.21790000 18853.10
+ HN8 CN8 CN8 5 110.100000 288.947040 0.21790000 18853.10
+ HN8 CN8 HN8 5 109.000000 297.064000 0.18020000 4518.72
+ HN7 CN7 HN7 5 109.000000 297.064000 0.18020000 4518.72
+ CN7 ON6B CN7B 5 115.000000 920.480000 0.00000000 0.00
+ CN7 CN7 ON6B 5 110.000000 836.800000 0.00000000 0.00
+ ON6B CN7B CN7B 5 106.000000 753.120000 0.00000000 0.00
+ CN7B CN7B CN7 5 96.000000 920.480000 0.00000000 0.00
+ CN7B CN7 CN7 5 100.000000 502.080000 0.25610000 6694.40
+ HN7 CN7 ON6B 5 107.240000 378.233600 0.00000000 0.00
+ HN7 CN7B ON6B 5 107.240000 378.233600 0.00000000 0.00
+ CN7B CN7B HN7 5 110.100000 279.491200 0.21790000 18853.10
+ HN7 CN7B HN7 5 109.000000 297.064000 0.18020000 4518.72
+ ON6 CN7 CN8B 5 108.200000 753.120000 0.00000000 0.00
+ ON6 CN7 CN9 5 108.200000 753.120000 0.00000000 0.00
+ CN7 CN7 CN8B 5 110.000000 376.560000 0.00000000 0.00
+ CN8 CN7 CN8B 5 113.600000 488.272800 0.25610000 9338.69
+ CN7 CN8B ON2 5 108.400000 585.760000 0.00000000 0.00
+ CN7 CN7 ON2 5 109.700000 962.320000 0.00000000 0.00
+ CN7B CN7B ON2 5 109.700000 962.320000 0.00000000 0.00
+ CN8 CN7 ON2 5 109.700000 962.320000 0.00000000 0.00
+ CN8B ON2 P 5 120.000000 167.360000 0.23300000 29288.00
+ CN8B ON2 P2 5 120.000000 167.360000 0.23300000 29288.00
+ CN7 ON2 P 5 120.000000 167.360000 0.23300000 29288.00
+ CN7 ON2 P2 5 120.000000 167.360000 0.23300000 29288.00
+ CN7B ON2 P 5 120.000000 167.360000 0.23300000 29288.00
+ CN7B ON2 P2 5 120.000000 167.360000 0.23300000 29288.00
+ HN7 CN7 CN8B 5 110.100000 288.696000 0.21790000 18853.10
+ HN8 CN8B ON2 5 109.500000 502.080000 0.00000000 0.00
+ HN5 ON5 CN8B 5 106.000000 481.160000 0.00000000 0.00
+ HN8 CN8B HN8 5 109.000000 297.064000 0.18020000 4518.72
+ HN8 CN8B CN7 5 110.100000 288.947040 0.21790000 18853.10
+ HN7 CN7 ON2 5 109.500000 502.080000 0.00000000 0.00
+ HN7 CN7B ON2 5 109.500000 502.080000 0.00000000 0.00
+ CN7 CN8B ON5 5 110.100000 633.457600 0.00000000 0.00
+ CN8B CN7 ON5 5 108.200000 753.120000 0.00000000 0.00
+ HN8 CN8B ON5 5 108.890000 384.091200 0.00000000 0.00
+ ON5 CN7 CN8 5 110.000000 633.457600 0.00000000 0.00
+ ON5 CN7 CN7 5 110.100000 633.457600 0.00000000 0.00
+ HN7 CN7 ON5 5 109.500000 502.080000 0.00000000 0.00
+ HN5 ON5 CN7 5 109.000000 481.160000 0.00000000 0.00
+ ON6B CN7 CN8B 5 108.200000 753.120000 0.00000000 0.00
+ ON6B CN7 CN9 5 108.200000 753.120000 0.00000000 0.00
+ ON2 CN7 CN7B 5 110.000000 753.120000 0.00000000 0.00
+ ON5 CN7 CN7B 5 110.000000 753.120000 0.00000000 0.00
+ ON5 CN7B CN7B 5 108.400000 669.440000 0.00000000 0.00
+ ON5 CN7B CN7 5 108.000000 753.120000 0.00000000 0.00
+ HN7 CN7B ON5 5 109.500000 502.080000 0.00000000 0.00
+ HN5 ON5 CN7B 5 109.000000 481.160000 0.00000000 0.00
+ HN7 CN7B CN7 5 110.100000 288.947040 0.21790000 18853.10
+ HN7 CN7 CN7B 5 110.100000 288.947040 0.21790000 18853.10
+ CN8 ON2 P 5 120.000000 167.360000 0.23300000 29288.00
+ CN8 ON2 P2 5 120.000000 167.360000 0.23300000 29288.00
+ ON2 P ON3 5 111.600000 827.595200 0.00000000 0.00
+ ON2 P2 ON3 5 111.600000 827.595200 0.00000000 0.00
+ ON3 P ON3 5 120.000000 1004.160000 0.00000000 0.00
+ ON3 P2 ON3 5 120.000000 1004.160000 0.00000000 0.00
+ HN8 CN8 ON2 5 109.500000 502.080000 0.00000000 0.00
+ ON5 P ON3 5 111.600000 827.595200 0.00000000 0.00
+ ON6 CN7B CN7 5 106.250000 1004.160000 0.00000000 0.00
+ CN7B CN7 CN8 5 113.600000 488.272800 0.25610000 9338.69
+ OBL CL CTL3 5 125.000000 585.760000 0.24420000 16736.00
+ OBL CL CTL2 5 125.000000 585.760000 0.24420000 16736.00
+ OBL CL CTL1 5 125.000000 585.760000 0.24420000 16736.00
+ OSL CL OBL 5 125.900000 753.120000 0.22576000 133888.00
+ CL OSL CTL1 5 109.600000 334.720000 0.22651000 25104.00
+ CL OSL CTL2 5 109.600000 334.720000 0.22651000 25104.00
+ CL OSL CTL3 5 109.600000 334.720000 0.22651000 25104.00
+ HAL2 CTL2 CL 5 109.500000 276.144000 0.21630000 25104.00
+ HAL3 CTL3 CL 5 109.500000 276.144000 0.21630000 25104.00
+ CTL2 CTL2 CL 5 108.000000 435.136000 0.00000000 0.00
+ CTL2 CTL1 CCL 5 108.000000 435.136000 0.00000000 0.00
+ CTL3 CTL2 CL 5 108.000000 435.136000 0.00000000 0.00
+ OSL CL CTL3 5 109.000000 460.240000 0.23260000 16736.00
+ OSL CL CTL2 5 109.000000 460.240000 0.23260000 16736.00
+ OSL CL CTL1 5 109.000000 460.240000 0.23260000 16736.00
+ OHL CL OBL 5 123.000000 418.400000 0.22620000 175728.00
+ OCL CL CTL2 5 118.000000 334.720000 0.23880000 41840.00
+ OCL CL CTL3 5 118.000000 334.720000 0.23880000 41840.00
+ OCL CL OCL 5 124.000000 836.800000 0.22250000 58576.00
+ OCL CCL OCL 5 124.000000 836.800000 0.22250000 58576.00
+ OCL CCL CTL1 5 118.000000 334.720000 0.23880000 41840.00
+ OHL CL CTL3 5 110.500000 460.240000 0.00000000 0.00
+ OHL CL CTL2 5 110.500000 460.240000 0.00000000 0.00
+ HOL OHL CL 5 115.000000 460.240000 0.00000000 0.00
+ OSL CTL1 CTL1 5 110.100000 633.457600 0.00000000 0.00
+ OSL CTL1 CTL2 5 110.100000 633.457600 0.00000000 0.00
+ OSL CTL1 CTL3 5 110.100000 633.457600 0.00000000 0.00
+ OSL CTL2 CTL1 5 110.100000 633.457600 0.00000000 0.00
+ OSL CTL2 CTL2 5 110.100000 633.457600 0.00000000 0.00
+ OSL CTL2 CTL3 5 110.100000 633.457600 0.00000000 0.00
+ OSLP CTL1 CTL1 5 110.100000 633.457600 0.00000000 0.00
+ OSLP CTL1 CTL2 5 110.100000 633.457600 0.00000000 0.00
+ OSLP CTL1 CTL3 5 110.100000 633.457600 0.00000000 0.00
+ OSLP CTL2 CTL1 5 110.100000 633.457600 0.00000000 0.00
+ OSLP CTL2 CTL2 5 110.100000 633.457600 0.00000000 0.00
+ OSLP CTL2 CTL3 5 110.100000 633.457600 0.00000000 0.00
+ HAL2 CTL2 HAL2 5 109.000000 297.064000 0.18020000 4518.72
+ HAL3 CTL3 HAL3 5 108.400000 297.064000 0.18020000 4518.72
+ HAL1 CTL1 OSL 5 109.500000 502.080000 0.00000000 0.00
+ HAL2 CTL2 OSL 5 109.500000 502.080000 0.00000000 0.00
+ HAL3 CTL3 OSL 5 109.500000 502.080000 0.00000000 0.00
+ HAL1 CTL1 OSLP 5 109.500000 502.080000 0.00000000 0.00
+ HAL2 CTL2 OSLP 5 109.500000 502.080000 0.00000000 0.00
+ HAL3 CTL3 OSLP 5 109.500000 502.080000 0.00000000 0.00
+ CTL1 OSL PL 5 120.000000 167.360000 0.23300000 29288.00
+ CTL2 OSL PL 5 120.000000 167.360000 0.23300000 29288.00
+ CTL3 OSL PL 5 120.000000 167.360000 0.23300000 29288.00
+ CTL1 OSLP PL 5 120.000000 167.360000 0.23300000 29288.00
+ CTL2 OSLP PL 5 120.000000 167.360000 0.23300000 29288.00
+ CTL3 OSLP PL 5 120.000000 167.360000 0.23300000 29288.00
+ HOL OHL PL 5 115.000000 251.040000 0.23000000 33472.00
+ OSL PL OSL 5 104.300000 669.440000 0.00000000 0.00
+ OSL PL O2L 5 111.600000 827.595200 0.00000000 0.00
+ OSL PL OHL 5 108.000000 402.500800 0.00000000 0.00
+ OSLP PL OSLP 5 104.300000 669.440000 0.00000000 0.00
+ OSLP PL O2L 5 111.600000 827.595200 0.00000000 0.00
+ OSLP PL OHL 5 108.000000 402.500800 0.00000000 0.00
+ O2L PL O2L 5 120.000000 1004.160000 0.00000000 0.00
+ O2L PL OHL 5 108.230000 827.595200 0.00000000 0.00
+ NTL CTL2 HL 5 109.500000 334.720000 0.21300000 22593.60
+ NTL CTL5 HL 5 109.500000 334.720000 0.21300000 22593.60
+ HL CTL2 HL 5 109.500000 200.832000 0.17670000 23430.40
+ HL CTL5 HL 5 109.500000 200.832000 0.17670000 23430.40
+ CTL2 NTL CTL2 5 109.500000 502.080000 0.24660000 21756.80
+ CTL5 NTL CTL2 5 109.500000 502.080000 0.24660000 21756.80
+ CTL5 NTL CTL5 5 109.500000 502.080000 0.24660000 21756.80
+ HL CTL2 CTL2 5 110.100000 279.742240 0.21790000 18853.10
+ HL CTL2 CTL3 5 110.100000 279.742240 0.21790000 18853.10
+ HAL1 CTL1 CTL1 5 110.100000 288.696000 0.21790000 18853.10
+ HAL1 CTL1 CTL2 5 110.100000 288.696000 0.21790000 18853.10
+ HAL1 CTL1 CTL3 5 110.100000 288.696000 0.21790000 18853.10
+ HAL2 CTL2 CTL1 5 110.100000 221.752000 0.21790000 18853.10
+ HAL2 CTL2 CTL2 5 110.100000 221.752000 0.21790000 18853.10
+ HAL2 CTL2 CTL3 5 110.100000 289.532800 0.21790000 18853.10
+ HAL3 CTL3 CTL1 5 110.100000 279.742240 0.21790000 18853.10
+ HAL3 CTL3 CTL2 5 110.100000 289.532800 0.21790000 18853.10
+ HAL3 CTL3 CTL3 5 110.100000 313.800000 0.21790000 18853.10
+ HBL CTL1 CCL 5 109.500000 418.400000 0.00000000 0.00
+ HBL CTL1 CTL2 5 111.000000 292.880000 0.00000000 0.00
+ NTL CTL2 CTL2 5 115.000000 566.513600 0.00000000 0.00
+ NTL CTL2 CTL3 5 115.000000 566.513600 0.00000000 0.00
+ HCL NH3L CTL2 5 109.500000 276.144000 0.20560000 3347.20
+ HCL NH3L CTL1 5 109.500000 251.040000 0.20740000 16736.00
+ HCL NH3L HCL 5 109.500000 343.088000 0.00000000 0.00
+ NH3L CTL2 CTL2 5 110.000000 566.513600 0.00000000 0.00
+ NH3L CTL2 HAL2 5 107.500000 376.560000 0.20836000 29288.00
+ CTL1 CTL1 CTL1 5 111.000000 446.432800 0.25610000 6694.40
+ NH3L CTL1 CCL 5 110.000000 365.681600 0.00000000 0.00
+ NH3L CTL1 CTL2 5 110.000000 566.513600 0.00000000 0.00
+ NH3L CTL1 HBL 5 107.500000 430.952000 0.00000000 0.00
+ CTL1 CTL1 CTL2 5 113.500000 488.272800 0.25610000 9338.69
+ CTL1 CTL1 CTL3 5 108.500000 446.432800 0.25610000 6694.40
+ CTL1 CTL2 CTL1 5 113.500000 488.272800 0.25610000 9338.69
+ CTL1 CTL2 CTL2 5 113.500000 488.272800 0.25610000 9338.69
+ CTL1 CTL2 CTL3 5 113.500000 488.272800 0.25610000 9338.69
+ CTL2 CTL1 CTL2 5 113.500000 488.272800 0.25610000 9338.69
+ CTL2 CTL1 CTL3 5 113.500000 488.272800 0.25610000 9338.69
+ CTL2 CTL2 CTL2 5 113.600000 488.272800 0.25610000 9338.69
+ CTL2 CTL2 CTL3 5 115.000000 485.344000 0.25610000 6694.40
+ CTL3 CTL1 CTL3 5 113.500000 488.272800 0.25610000 9338.69
+ HOL OHL CTL1 5 106.000000 481.160000 0.00000000 0.00
+ HOL OHL CTL2 5 106.000000 481.160000 0.00000000 0.00
+ HOL OHL CTL3 5 106.000000 481.160000 0.00000000 0.00
+ OHL CTL1 CTL1 5 110.100000 633.457600 0.00000000 0.00
+ OHL CTL1 CTL2 5 110.100000 633.457600 0.00000000 0.00
+ OHL CTL2 CTL1 5 110.100000 633.457600 0.00000000 0.00
+ OHL CTL2 CTL2 5 110.100000 633.457600 0.00000000 0.00
+ OHL CTL2 CTL3 5 110.100000 633.457600 0.00000000 0.00
+ OHL CTL1 HAL1 5 108.890000 384.091200 0.00000000 0.00
+ OHL CTL2 HAL2 5 108.890000 384.091200 0.00000000 0.00
+ OHL CTL3 HAL3 5 108.890000 384.091200 0.00000000 0.00
+ O2L SL O2L 5 109.470000 1087.840000 0.24500000 29288.00
+ O2L SL OSL 5 98.000000 711.280000 0.00000000 0.00
+ CTL2 OSL SL 5 109.000000 125.520000 0.19000000 22593.60
+ CTL3 OSL SL 5 109.000000 125.520000 0.19000000 22593.60
+ CEL1 CEL1 CTL2 5 123.500000 401.664000 0.00000000 0.00
+ CEL1 CEL1 CTL3 5 123.500000 401.664000 0.00000000 0.00
+ CEL2 CEL1 CTL2 5 126.000000 401.664000 0.00000000 0.00
+ CEL2 CEL1 CTL3 5 125.200000 393.296000 0.00000000 0.00
+ HEL1 CEL1 CEL1 5 119.500000 435.136000 0.00000000 0.00
+ HEL1 CEL1 CEL2 5 118.000000 351.456000 0.00000000 0.00
+ HEL1 CEL1 CTL2 5 116.000000 334.720000 0.00000000 0.00
+ HEL1 CEL1 CTL3 5 117.000000 184.096000 0.00000000 0.00
+ HEL2 CEL2 CEL1 5 120.500000 376.560000 0.00000000 0.00
+ HEL2 CEL2 CEL2 5 120.500000 464.424000 0.00000000 0.00
+ HEL2 CEL2 HEL2 5 119.000000 158.992000 0.00000000 0.00
+ CEL1 CTL2 CTL2 5 112.200000 267.776000 0.00000000 0.00
+ CEL1 CTL2 CTL3 5 112.200000 267.776000 0.00000000 0.00
+ HAL2 CTL2 CEL1 5 111.500000 376.560000 0.00000000 0.00
+ HAL3 CTL3 CEL1 5 111.500000 351.456000 0.00000000 0.00
+ CEL1 CTL2 CEL1 5 114.000000 251.040000 0.00000000 0.00
+ HCA1A CC31A CC31A 5 110.100000 288.696000 0.21790000 18853.10
+ HCA1A CC31A CC32A 5 110.100000 288.696000 0.21790000 18853.10
+ HCA1A CC31A CC33A 5 110.100000 288.696000 0.21790000 18853.10
+ HCA2A CC32A CC30A 5 110.100000 221.752000 0.21790000 18853.10
+ HCA2A CC32A CC31A 5 110.100000 221.752000 0.21790000 18853.10
+ HCA2A CC32A CC32A 5 110.100000 221.752000 0.21790000 18853.10
+ HCA2A CC32A CC33A 5 110.100000 289.532800 0.21790000 18853.10
+ HCA3A CC33A CC30A 5 110.100000 279.742240 0.21790000 18853.10
+ HCA3A CC33A CC31A 5 110.100000 279.742240 0.21790000 18853.10
+ HCA3A CC33A CC32A 5 110.100000 289.532800 0.21790000 18853.10
+ HCA3A CC33A CC33A 5 110.100000 313.800000 0.21790000 18853.10
+ HCA2A CC32A HCA2A 5 109.000000 297.064000 0.18020000 4518.72
+ HCA3A CC33A HCA3A 5 108.400000 297.064000 0.18020000 4518.72
+ CC30A CC32A CC32A 5 113.500000 488.272800 0.25610000 9338.69
+ CC30A CC32A CC33A 5 113.500000 488.272800 0.25610000 9338.69
+ CC31A CC31A CC31A 5 111.000000 446.432800 0.25610000 6694.40
+ CC31A CC31A CC32A 5 113.500000 488.272800 0.25610000 9338.69
+ CC31A CC31A CC33A 5 108.500000 446.432800 0.25610000 6694.40
+ CC31A CC32A CC31A 5 113.500000 488.272800 0.25610000 9338.69
+ CC31A CC32A CC32A 5 113.500000 488.272800 0.25610000 9338.69
+ CC31A CC32A CC33A 5 113.500000 488.272800 0.25610000 9338.69
+ CC32A CC30A CC32A 5 113.500000 488.272800 0.25610000 9338.69
+ CC32A CC31A CC32A 5 113.500000 488.272800 0.25610000 9338.69
+ CC32A CC32A CC32A 5 113.600000 488.272800 0.25610000 9338.69
+ CC32A CC32A CC33A 5 115.000000 485.344000 0.25610000 6694.40
+ CC33A CC30A CC33A 5 114.000000 446.432800 0.25610000 6694.40
+ CC33A CC31A CC32A 5 114.000000 446.432800 0.25610000 6694.40
+ CC33A CC31A CC33A 5 114.000000 446.432800 0.25610000 6694.40
+ CC33A CC32A CC33A 5 114.000000 446.432800 0.25610000 6694.40
+ CC325A CC325A CC325A 5 106.000000 485.344000 0.25610000 9338.69
+ HCA25A CC325A CC325A 5 111.400000 292.880000 0.21790000 18853.10
+ HCA25A CC325A HCA25A 5 106.800000 322.168000 0.18020000 4518.72
+ HCA25A CC325B CC325B 5 111.400000 292.880000 0.21790000 18853.10
+ HCA25A CC325B HCA25A 5 106.800000 322.168000 0.18020000 4518.72
+ CC325B CC325B CC325B 5 109.500000 485.344000 0.25610000 9338.69
+ OC305A CC325B CC325B 5 111.100000 376.560000 0.00000000 0.00
+ CC325B OC305A CC325B 5 111.000000 794.960000 0.00000000 0.00
+ HCA25A CC325B OC305A 5 107.300000 585.760000 0.00000000 0.00
+ HCA3A CC33A CC325B 5 110.100000 289.532800 0.21790000 18853.10
+ CC325B CC325B CC33A 5 115.000000 485.344000 0.25610000 6694.40
+ HCA25A CC325B CC33A 5 110.100000 289.532800 0.21790000 18853.10
+ OC305A CC325B CC33A 5 111.500000 376.560000 0.00000000 0.00
+ CC32A OC30A CC32A 5 109.700000 794.960000 0.00000000 0.00
+ CC33A OC30A CC32A 5 109.700000 794.960000 0.00000000 0.00
+ CC33A OC30A CC33A 5 109.700000 794.960000 0.00000000 0.00
+ OC30A CC32A CC32A 5 111.500000 376.560000 0.00000000 0.00
+ OC30A CC32A CC33A 5 111.500000 376.560000 0.00000000 0.00
+ HCA3A CC33A OC30A 5 109.500000 502.080000 0.00000000 0.00
+ HCA2A CC32A OC30A 5 109.500000 502.080000 0.00000000 0.00
+ HCA2A CC326A CC326A 5 110.100000 288.696000 0.21790000 18853.10
+ HCA2A CC326A HCA2A 5 109.000000 297.064000 0.18020000 4518.72
+ CC326A CC326A CC326A 5 112.000000 488.272800 0.25610000 9338.69
+ OC30A CC326A CC326A 5 111.500000 376.560000 0.00000000 0.00
+ CC326A OC30A CC326A 5 109.700000 794.960000 0.00000000 0.00
+ HCA2A CC326A OC30A 5 109.500000 376.560000 0.00000000 0.00
+ OST CST OST 5 180.000000 25104.000000 0.00000000 0.00
+ CS SS FE 5 100.600000 418.400000 0.00000000 0.00
+ SS FE NPH 5 90.000000 836.800000 0.00000000 0.00
+ CPA CPB CE1 5 126.740000 585.760000 0.00000000 0.00
+ CPA CPM CPA 5 125.120000 788.265600 0.00000000 0.00
+ CPA NPH CPA 5 103.900000 1165.662400 0.00000000 0.00
+ CPB CE1 CE2 5 121.500000 585.760000 0.00000000 0.00
+ CPB CPB CE1 5 126.750000 585.760000 0.00000000 0.00
+ CPB CPB CPA 5 106.510000 257.734400 0.00000000 0.00
+ CPM CPA CPB 5 124.070000 515.468800 0.00000000 0.00
+ CT2 CPB CPA 5 126.740000 543.920000 0.00000000 0.00
+ CT2 CPB CPB 5 126.750000 543.920000 0.00000000 0.00
+ CT2 CT2 CPB 5 113.000000 585.760000 0.00000000 0.00
+ CT3 CPB CPA 5 126.740000 543.920000 0.00000000 0.00
+ CT3 CPB CPB 5 126.750000 543.920000 0.00000000 0.00
+ FE NPH CPA 5 128.050000 804.583200 0.00000000 0.00
+ FE NR2 CPH1 5 133.000000 251.040000 0.00000000 0.00
+ FE NR2 CPH2 5 123.000000 251.040000 0.00000000 0.00
+ HA CPM CPA 5 117.440000 106.273600 0.00000000 0.00
+ HA CPM FE 5 180.000000 0.000000 0.00000000 0.00
+ HA2 CT2 CPB 5 109.500000 418.400000 0.00000000 0.00
+ HA3 CT3 CPB 5 109.500000 418.400000 0.00000000 0.00
+ HE1 CE1 CPB 5 120.000000 418.400000 0.00000000 0.00
+ NPH CPA CPB 5 111.540000 1020.896000 0.00000000 0.00
+ NPH CPA CPM 5 124.390000 736.384000 0.00000000 0.00
+ NPH FE CM 5 90.000000 418.400000 0.00000000 0.00
+ NPH FE CPM 5 45.000000 0.000000 0.00000000 0.00
+ NPH FE NPH 5 90.000000 120.415520 0.00000000 0.00
+ NR2 FE CM 5 180.000000 418.400000 0.00000000 0.00
+ NR2 FE NPH 5 90.000000 418.400000 0.00000000 0.00
+ OM CM FE 5 180.000000 292.880000 0.00000000 0.00
+ OM FE NPH 5 90.000000 41.840000 0.00000000 0.00
+ OM OM FE 5 180.000000 0.000000 0.00000000 0.00
+ CTL1 CTL2 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CTL1 CEL1 CTL2 5 113.000000 418.400000 0.00000000 0.00
+ CEL1 CEL1 CTL1 5 123.500000 401.664000 0.00000000 0.00
+ CTL1 CTL1 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CTL3 CTL1 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CTL2 CTL1 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ OHL CTL1 CTL3 5 110.100000 633.457600 0.00000000 0.00
+ HOL OHL CRL1 5 106.000000 481.160000 0.00000000 0.00
+ OHL CRL1 CRL2 5 110.100000 633.457600 0.00000000 0.00
+ OHL CRL1 HGA1 5 108.890000 384.091200 0.00000000 0.00
+ HAL3 CTL3 CRL1 5 110.100000 279.742240 0.21790000 18853.10
+ CRL1 CRL1 CTL3 5 108.500000 446.432800 0.25610000 6694.40
+ CRL2 CRL1 CTL3 5 113.500000 488.272800 0.25610000 9338.69
+ HEL1 CEL1 CRL2 5 116.000000 334.720000 0.00000000 0.00
+ HGA2 CRL2 CEL1 5 111.500000 376.560000 0.00000000 0.00
+ HAL2 CRL2 CEL1 5 111.500000 376.560000 0.00000000 0.00
+ HGA2 CTL2 CEL1 5 111.500000 376.560000 0.00000000 0.00
+ CRL1 CRL2 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CEL1 CEL1 CRL2 5 123.500000 401.664000 0.00000000 0.00
+ CEL1 CEL1 CRL1 5 123.500000 401.664000 0.00000000 0.00
+ CRL1 CRL1 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CTL1 CRL1 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CRL1 CTL1 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CTL3 CRL1 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CRL2 CRL1 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CTL2 CRL1 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CRL2 CTL1 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CRL2 CRL1 CTL2 5 113.500000 488.272800 0.25610000 9338.69
+ CRL2 CRL1 CRL2 5 113.500000 488.272800 0.25610000 9338.69
+ HGA1 CRL1 CTL2 5 110.100000 288.696000 0.21790000 18853.10
+ HGA1 CRL1 CRL2 5 110.100000 288.696000 0.21790000 18853.10
+ CRL1 CRL1 CTL2 5 113.500000 488.272800 0.25610000 9338.69
+ CRL1 CRL1 CRL2 5 113.500000 488.272800 0.25610000 9338.69
+ CRL1 CTL2 CTL3 5 113.500000 488.272800 0.25610000 9338.69
+ HAL2 CTL2 CRL1 5 110.100000 221.752000 0.21790000 18853.10
+ HGA2 CRL2 CRL1 5 110.100000 221.752000 0.21790000 18853.10
+ CRL1 CTL2 CTL2 5 113.500000 488.272800 0.25610000 9338.69
+ CRL1 CRL2 CRL2 5 113.500000 488.272800 0.25610000 9338.69
+ CRL1 CEL1 CRL2 5 113.000000 418.400000 0.00000000 0.00
+ CRL1 CRL1 CRL1 5 111.000000 446.432800 0.25610000 6694.40
+ CTL1 CRL1 CRL2 5 113.500000 488.272800 0.25610000 9338.69
+ HGA1 CRL1 CTL1 5 110.100000 288.696000 0.21790000 18853.10
+ HGA1 CRL1 CRL1 5 110.100000 288.696000 0.21790000 18853.10
+ CTL1 CRL1 CRL1 5 111.000000 446.432800 0.25610000 6694.40
+ HAL1 CTL1 CRL1 5 110.100000 288.696000 0.21790000 18853.10
+ CRL1 CTL1 CTL3 5 108.500000 446.432800 0.25610000 6694.40
+ CRL1 CTL1 CTL2 5 113.500000 488.272800 0.25610000 9338.69
+ CEL2 CEL1 CRL2 5 126.000000 401.664000 0.00000000 0.00
+ CEL1 CRL2 CRL2 5 112.200000 267.776000 0.00000000 0.00
+ CEL1 CTL2 CRL2 5 112.200000 267.776000 0.00000000 0.00
+ CEL1 CRL2 CTL2 5 112.200000 267.776000 0.00000000 0.00
+ CEL1 CRL2 CTL3 5 112.200000 267.776000 0.00000000 0.00
+ CEL1 CRL2 CEL1 5 114.000000 251.040000 0.00000000 0.00
+ CTL1 CRL2 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CRL1 CTL2 CEL1 5 112.200000 267.776000 0.00000000 0.00
+ CTL1 CEL1 CRL2 5 113.000000 418.400000 0.00000000 0.00
+ CRL1 CEL1 CTL2 5 113.000000 418.400000 0.00000000 0.00
+ HGA2 CRL2 HGA2 5 109.000000 297.064000 0.18020000 4518.72
+ HGA2 CRL2 CRL2 5 110.100000 221.752000 0.21790000 18853.10
+ HGA1 CRL1 CTL3 5 110.100000 288.696000 0.21790000 18853.10
+ CRL2 CRL2 CRL2 5 113.600000 488.272800 0.25610000 9338.69
+ CTL2 CG3RC1 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CTL2 CTL2 CG3RC1 5 111.000000 446.432800 0.25610000 6694.40
+ HAL2 CTL2 CG3RC1 5 110.100000 288.696000 0.21790000 18853.10
+ CTL2 CG3RC1 CG3C31 5 111.000000 446.432800 0.25610000 6694.40
+ CTL2 CG3RC1 CG3RC1 5 111.000000 446.432800 0.25610000 6694.40
+ CG3RC1 CTL3 HAL3 5 110.100000 279.742240 0.21790000 18853.10
+ CTL3 CG3RC1 CG3RC1 5 113.500000 488.272800 0.25610000 9338.69
+ CTL3 CG3RC1 HGA1 5 110.100000 288.696000 0.21790000 18853.10
+ CTL3 CG3RC1 CG3C31 5 111.000000 446.432800 0.25610000 6694.40
+ CG3C31 CTL2 HAL2 5 110.100000 221.752000 0.21790000 18853.10
+ CTL1 CTL2 CL 5 108.000000 435.136000 0.00000000 0.00
+ CA CA ON2B 5 120.000000 627.600000 0.00000000 0.00
+ CA ON2B P 5 120.000000 753.120000 0.23000000 16736.00
+ ON4 P ON2B 5 108.000000 402.500800 0.00000000 0.00
+ ON3 P ON2B 5 103.000000 827.595200 0.00000000 0.00
+ HA2 CT2 P 5 110.000000 753.120000 0.18020000 4518.72
+ CA CT2 P 5 111.000000 753.120000 0.23000000 16736.00
+ CT2 P ON4 5 94.000000 753.956800 0.00000000 0.00
+ CT2 P ON3 5 103.000000 827.595200 0.00000000 0.00
+ CT1 CT1 ON2 5 109.700000 962.320000 0.00000000 0.00
+ CT3 CT1 ON2 5 109.700000 962.320000 0.00000000 0.00
+ CT1 CT2 ON2 5 108.400000 585.760000 0.00000000 0.00
+ CT3 CT2 ON2 5 108.400000 585.760000 0.00000000 0.00
+ CN9 CN8 ON2 5 108.400000 585.760000 0.00000000 0.00
+ CT1 ON2 P 5 120.000000 167.360000 0.23300000 29288.00
+ CT2 ON2 P 5 120.000000 167.360000 0.23300000 29288.00
+ HA1 CT1 ON2 5 109.500000 502.080000 0.00000000 0.00
+ HA2 CT2 ON2 5 109.500000 502.080000 0.00000000 0.00
+ CN9 CN7 CN9 5 113.600000 488.272800 0.25610000 9338.69
+ ON2 CN7 CN9 5 109.700000 962.320000 0.00000000 0.00
+ S CN8B CN7 5 114.500000 485.344000 0.00000000 0.00
+ CN8B S CT2 5 95.000000 284.512000 0.00000000 0.00
+ S CN8B HN8 5 111.300000 385.764800 0.00000000 0.00
+ SP CT2 HA2 5 111.300000 385.764800 0.00000000 0.00
+ SP CT2 CT2 5 114.500000 485.344000 0.00000000 0.00
+ CT2 SP CT3 5 95.000000 284.512000 0.00000000 0.00
+ CT2 SP CN8B 5 95.000000 284.512000 0.00000000 0.00
+ SP CT3 HA3 5 111.300000 385.764800 0.00000000 0.00
+ CT3 SP CN8B 5 95.000000 284.512000 0.00000000 0.00
+ SP CN8B CN7 5 114.500000 485.344000 0.00000000 0.00
+ SP CN8B HN8 5 111.300000 385.764800 0.00000000 0.00
+ ON6 CN7B NR1 5 108.000000 1171.520000 0.00000000 0.00
+ ON6B CN7B NR1 5 108.000000 1171.520000 0.00000000 0.00
+ CN8 CN7B NR1 5 113.700000 1171.520000 0.00000000 0.00
+ CN7B CN7B NR1 5 113.700000 1171.520000 0.00000000 0.00
+ CN7B NR1 CPH2 5 127.000000 1087.840000 0.00000000 0.00
+ CN7B NR1 CPH1 5 126.000000 1087.840000 0.00000000 0.00
+ HN7 CN7B NR1 5 106.300000 251.040000 0.00000000 0.00
+ NC2D1 CC311D OC3C61 5 110.000000 753.120000 0.00000000 0.00
+ HCA1 CC311D NC2D1 5 108.000000 401.664000 0.00000000 0.00
+ NC2D1 CC311D CC321C 5 113.500000 585.760000 0.00000000 0.00
+ NC2D1 CC311D CC311D 5 113.500000 585.760000 0.00000000 0.00
+ CC311D NC2D1 HCP1 5 117.000000 292.880000 0.00000000 0.00
+ CC311D NC2D1 CC2O1 5 120.000000 418.400000 0.00000000 0.00
+ NC2D1 CC3162 OC3C61 5 110.000000 753.120000 0.00000000 0.00
+ HCA1 CC3162 NC2D1 5 108.000000 401.664000 0.00000000 0.00
+ NC2D1 CC3162 CC3161 5 113.500000 585.760000 0.00000000 0.00
+ CC3162 NC2D1 HCP1 5 117.000000 292.880000 0.00000000 0.00
+ CC3162 NC2D1 CC2O1 5 120.000000 418.400000 0.00000000 0.00
+ NH3 CT1 CC321 5 110.000000 566.513600 0.00000000 0.00
+ CC321 CT1 CC 5 108.000000 435.136000 0.00000000 0.00
+ NH1 CT1 CC321 5 113.500000 585.760000 0.00000000 0.00
+ HB2 CT1 CC321 5 111.000000 292.880000 0.00000000 0.00
+ HB1 CT1 CC321 5 111.000000 292.880000 0.00000000 0.00
+ CC321 CT1 C 5 108.000000 435.136000 0.00000000 0.00
+ CT1 CC321 CC2O1 5 108.000000 435.136000 0.00000000 0.00
+ CT1 CC321 HCA2 5 110.100000 279.742240 0.21790000 18853.10
+ HCA2 CC321 CC2O1 5 109.500000 276.144000 0.21630000 25104.00
+ CC321 CC2O1 OC2D1 5 121.000000 125.520000 0.24400000 41840.00
+ CC321 CC2O1 NC2D1 5 116.500000 418.400000 0.24500000 41840.00
+ CT1 CT2 OC301 5 107.000000 376.560000 0.00000000 0.00
+ CT1 CT1 OC301 5 107.000000 376.560000 0.00000000 0.00
+ CT2 OC301 CC311D 5 110.700000 794.960000 0.00000000 0.00
+ CT1 OC301 CC311D 5 110.700000 794.960000 0.00000000 0.00
+ CT2 OC301 CC3162 5 110.700000 794.960000 0.00000000 0.00
+ CT1 OC301 CC3162 5 110.700000 794.960000 0.00000000 0.00
+ CT3 CT1 OC301 5 110.000000 376.560000 0.00000000 0.00
+ HA CT2 OC301 5 109.500000 502.080000 0.00000000 0.00
+ HA2 CT2 OC301 5 109.500000 502.080000 0.00000000 0.00
+ HA CT1 OC301 5 109.500000 502.080000 0.00000000 0.00
+ HA1 CT1 OC301 5 109.500000 502.080000 0.00000000 0.00
+ OC30P PL OC2DP 5 111.600000 827.595200 0.00000000 0.00
+ OC2DP PL OC2DP 5 120.000000 1004.160000 0.00000000 0.00
+ OC30P PL OC30P 5 104.300000 669.440000 0.00000000 0.00
+ CC3161 OC30P PL 5 120.000000 167.360000 0.23300000 29288.00
+ OC301 CTL2 CTL2 5 111.500000 376.560000 0.00000000 0.00
+ CC3162 OC301 CTL2 5 109.700000 794.960000 0.00000000 0.00
+ CC311D OC301 CTL2 5 109.700000 794.960000 0.00000000 0.00
+ OC301 CTL2 HAL2 5 109.500000 502.080000 0.00000000 0.00
+ OC30P PL O2L 5 111.600000 827.595200 0.00000000 0.00
+ OC30P PL OSLP 5 104.300000 669.440000 0.00000000 0.00
+
+
+[ dihedraltypes ]
+; i j k l func phi0 kphi mult
+ NH2 CT1 C O 9 0.000000 0.000000 1
+ NH2 CT2 C O 9 0.000000 0.000000 1
+ NH2 CT1 C NH1 9 0.000000 0.000000 1
+ NH2 CT2 C NH1 9 0.000000 0.000000 1
+ H NH2 CT1 CT1 9 0.000000 0.000000 1
+ H NH2 CT1 C 9 0.000000 0.000000 1
+ H NH2 CT2 C 9 0.000000 0.000000 1
+ H NH2 CT1 HB1 9 0.000000 0.460240 3
+ H NH2 CT2 HB2 9 0.000000 0.460240 3
+ H NH2 CT1 CT2 9 0.000000 0.460240 3
+ H NH2 CT1 CT3 9 0.000000 0.460240 3
+ CAI CA CA CAI 9 180.000000 12.970400 2
+ CA CPT CPT CA 9 180.000000 12.552000 2
+ CAI CPT CPT CAI 9 180.000000 12.552000 2
+ CA CY CPT CA 9 180.000000 12.552000 2
+ CA CY CPT CAI 9 180.000000 12.552000 2
+ CA NY CPT CA 9 180.000000 12.552000 2
+ CPT CA CA CA 9 180.000000 12.552000 2
+ CPT CPT CA CA 9 180.000000 12.552000 2
+ CA NY CPT CAI 9 180.000000 12.552000 2
+ CPT CAI CA CA 9 180.000000 12.552000 2
+ CPT CPT CAI CA 9 180.000000 12.552000 2
+ CPT CPT CY CA 9 180.000000 20.920000 2
+ CPT CPT NY CA 9 180.000000 27.196000 2
+ CT3 CY CPT CA 9 180.000000 10.460000 2
+ CT3 CY CPT CAI 9 180.000000 10.460000 2
+ CT3 CY CPT CPT 9 180.000000 12.552000 2
+ CT2 CY CPT CA 9 180.000000 10.460000 2
+ CT2 CY CPT CAI 9 180.000000 10.460000 2
+ CT2 CY CPT CPT 9 180.000000 12.552000 2
+ CY CA NY CPT 9 180.000000 25.104000 2
+ CY CPT CA CA 9 180.000000 16.736000 2
+ CY CPT CPT CA 9 180.000000 16.736000 2
+ CY CPT CAI CA 9 180.000000 16.736000 2
+ CY CPT CPT CAI 9 180.000000 16.736000 2
+ H NY CA CY 9 180.000000 0.209200 2
+ H NY CPT CA 9 180.000000 0.836800 2
+ H NY CPT CAI 9 180.000000 0.836800 2
+ H NY CPT CPT 9 180.000000 3.556400 2
+ HP CAI CA CA 9 180.000000 17.572800 2
+ HP CA CA CPT 9 180.000000 12.552000 2
+ HP CA CPT CPT 9 180.000000 12.552000 2
+ HP CA CPT CY 9 180.000000 16.736000 2
+ HP CA CA CAI 9 180.000000 17.572800 2
+ HP CA CAI CPT 9 180.000000 12.552000 2
+ HP CAI CA HP 9 180.000000 10.041600 2
+ HP CAI CPT CPT 9 180.000000 12.552000 2
+ HP CAI CPT CY 9 180.000000 16.736000 2
+ HP CA CY CPT 9 180.000000 11.715200 2
+ HP CA CY CT3 9 180.000000 5.020800 2
+ HP CA CY CT2 9 180.000000 5.020800 2
+ HP CA NY CPT 9 180.000000 10.878400 2
+ HP CA NY H 9 180.000000 1.673600 2
+ HP CY CA HP 9 180.000000 4.184000 2
+ HP CY CPT CA 9 180.000000 11.715200 2
+ HP CY CPT CAI 9 180.000000 11.715200 2
+ HP CY CPT CPT 9 180.000000 10.878400 2
+ NY CA CY CPT 9 180.000000 20.920000 2
+ NY CA CY CT3 9 180.000000 10.460000 2
+ NY CA CY CT2 9 180.000000 10.460000 2
+ NY CA CY HP 9 180.000000 14.644000 2
+ NY CPT CA CA 9 180.000000 12.552000 2
+ NY CPT CA HP 9 180.000000 12.552000 2
+ NY CPT CPT CA 9 180.000000 16.736000 2
+ NY CPT CAI CA 9 180.000000 12.552000 2
+ NY CPT CAI HP 9 180.000000 12.552000 2
+ NY CPT CPT CAI 9 180.000000 16.736000 2
+ NY CPT CPT CY 9 180.000000 27.196000 2
+ CT3 CT2 CY CA 9 0.000000 1.589920 2
+ CT3 CT2 CY CPT 9 180.000000 1.046000 2
+ CT3 CT2 CY CPT 9 0.000000 1.255200 3
+ HA3 CT3 CY CA 9 0.000000 0.041840 3
+ HA3 CT3 CY CPT 9 0.000000 0.836800 3
+ HA2 CT2 CY CA 9 0.000000 0.041840 3
+ HA2 CT2 CY CPT 9 0.000000 0.836800 3
+ C CT1 NH1 C 9 180.000000 0.836800 1
+ C CT2 NH1 C 9 180.000000 0.836800 1
+ C N CP1 C 9 0.000000 3.347200 3
+ CA CA CA CA 9 180.000000 12.970400 2
+ CC CP1 N C 9 0.000000 3.347200 3
+ CC CT1 CT2 CA 9 0.000000 0.167360 3
+ CC CT1 NH1 C 9 180.000000 0.836800 1
+ CC CT2 NH1 C 9 180.000000 8.368000 1
+ CD CP1 N C 9 180.000000 0.000000 1
+ CD CT1 NH1 C 9 180.000000 0.836800 1
+ CD CT2 NH1 C 9 180.000000 8.368000 1
+ CE1 CE1 CT3 HA3 9 0.000000 0.125520 3
+ CE2 CE1 CT2 CT3 9 180.000000 2.092000 1
+ CE2 CE1 CT2 CT3 9 180.000000 5.439200 3
+ CE2 CE1 CT2 HA2 9 0.000000 0.502080 3
+ CE2 CE1 CT3 HA3 9 180.000000 0.209200 3
+ CP1 C N CP1 9 180.000000 11.506000 2
+ CP1 C N CP1 9 0.000000 1.255200 4
+ CP2 CP1 N C 9 0.000000 3.347200 3
+ CP2 CP3 N C 9 180.000000 0.000000 3
+ CP2 CP3 N CP1 9 0.000000 0.418400 3
+ CP2 CP3 NP CP1 9 0.000000 0.334720 3
+ CP3 N C CP1 9 180.000000 11.506000 2
+ CP3 N C CP1 9 0.000000 1.255200 4
+ CP3 N CP1 C 9 0.000000 0.418400 3
+ CP3 N CP1 CC 9 0.000000 0.418400 3
+ CP3 N CP1 CP2 9 0.000000 0.418400 3
+ CP3 NP CP1 C 9 0.000000 0.334720 3
+ CP3 NP CP1 CC 9 0.000000 0.334720 3
+ CP3 NP CP1 CD 9 0.000000 0.334720 3
+ CP3 NP CP1 CP2 9 0.000000 0.334720 3
+ CPH2 NR1 CPH1 CPH1 9 180.000000 58.576000 2
+ CPH2 NR2 CPH1 CPH1 9 180.000000 58.576000 2
+ CPH2 NR3 CPH1 CPH1 9 180.000000 50.208000 2
+ CT1 C N CP1 9 180.000000 11.506000 2
+ CT1 C N CP1 9 0.000000 1.255200 4
+ CT1 C N CP3 9 180.000000 11.506000 2
+ CT1 C N CP3 9 0.000000 1.255200 4
+ CT1 C NH1 CT1 9 0.000000 6.694400 1
+ CT1 C NH1 CT1 9 180.000000 10.460000 2
+ CT1 CT1 NH1 C 9 0.000000 7.531200 1
+ CT1 NH1 C CP1 9 0.000000 6.694400 1
+ CT1 NH1 C CP1 9 180.000000 10.460000 2
+ CT2 C N CP1 9 180.000000 11.506000 2
+ CT2 C N CP1 9 0.000000 1.255200 4
+ CT2 C N CP3 9 180.000000 11.506000 2
+ CT2 C N CP3 9 0.000000 1.255200 4
+ CT2 C NH1 CT1 9 0.000000 6.694400 1
+ CT2 C NH1 CT1 9 180.000000 10.460000 2
+ CT2 C NH1 CT2 9 0.000000 6.694400 1
+ CT2 C NH1 CT2 9 180.000000 10.460000 2
+ CT2 C NH1 CT3 9 0.000000 6.694400 1
+ CT2 C NH1 CT3 9 180.000000 10.460000 2
+ CT2 CA CA CA 9 180.000000 12.970400 2
+ CT2 CPH1 NR1 CPH2 9 180.000000 12.552000 2
+ CT2 CPH1 NR2 CPH2 9 180.000000 12.552000 2
+ CT2 CPH1 NR3 CPH2 9 180.000000 10.460000 2
+ CT2 CT1 NH1 C 9 0.000000 7.531200 1
+ CT2 CT2 CPH1 CPH1 9 0.000000 1.673600 1
+ CT2 CT2 CT2 CT2 9 180.000000 0.418400 2
+ CT2 CT2 CT2 CT2 9 0.000000 0.627600 4
+ CT2 CT2 CT2 CT2 9 180.000000 0.418400 6
+ CT2 CT2 CT2 CT3 9 180.000000 0.418400 2
+ CT2 CT2 CT2 CT3 9 0.000000 0.627600 4
+ CT2 CT2 CT2 CT3 9 180.000000 0.418400 6
+ CT2 CT2 NH1 C 9 0.000000 7.531200 1
+ CT2 NH1 C CP1 9 0.000000 6.694400 1
+ CT2 NH1 C CP1 9 180.000000 10.460000 2
+ CT2 NH1 C CT1 9 0.000000 6.694400 1
+ CT2 NH1 C CT1 9 180.000000 10.460000 2
+ CT2 SM SM CT2 9 0.000000 4.184000 1
+ CT2 SM SM CT2 9 0.000000 17.154400 2
+ CT2 SM SM CT2 9 0.000000 3.765600 3
+ CT3 C N CP1 9 180.000000 11.506000 2
+ CT3 C N CP1 9 0.000000 1.255200 4
+ CT3 C N CP3 9 180.000000 11.506000 2
+ CT3 C N CP3 9 0.000000 1.255200 4
+ CT3 C NH1 CT1 9 0.000000 6.694400 1
+ CT3 C NH1 CT1 9 180.000000 10.460000 2
+ CT3 C NH1 CT2 9 0.000000 6.694400 1
+ CT3 C NH1 CT2 9 180.000000 10.460000 2
+ CT3 C NH1 CT3 9 0.000000 6.694400 1
+ CT3 C NH1 CT3 9 180.000000 10.460000 2
+ CT3 CA CA CA 9 180.000000 12.970400 2
+ CT3 CE1 CE2 HE2 9 180.000000 21.756800 2
+ CT3 CPH1 NR1 CPH2 9 180.000000 12.552000 2
+ CT3 CT1 NH1 C 9 0.000000 7.531200 1
+ CT3 CT2 CA CA 9 180.000000 0.962320 2
+ CT3 CT2 CPH1 CPH1 9 0.000000 0.836800 1
+ CT3 CT2 CPH1 CPH1 9 0.000000 1.129680 2
+ CT3 CT2 CPH1 CPH1 9 0.000000 0.000000 3
+ CT3 CT2 S CT3 9 180.000000 1.004160 1
+ CT3 CT2 S CT3 9 0.000000 1.548080 3
+ CT3 NH1 C CP1 9 0.000000 6.694400 1
+ CT3 NH1 C CP1 9 180.000000 10.460000 2
+ CT3 NH1 C CT1 9 0.000000 6.694400 1
+ CT3 NH1 C CT1 9 180.000000 10.460000 2
+ CT3 S CT2 CT2 9 180.000000 1.004160 1
+ CT3 S CT2 CT2 9 0.000000 1.548080 3
+ CT3 SM SM CT3 9 0.000000 4.184000 1
+ CT3 SM SM CT3 9 0.000000 17.154400 2
+ CT3 SM SM CT3 9 0.000000 3.765600 3
+ H NH1 C CP1 9 180.000000 10.460000 2
+ H NH1 C CT1 9 180.000000 10.460000 2
+ H NH1 C CT2 9 180.000000 10.460000 2
+ H NH1 C CT3 9 180.000000 10.460000 2
+ H NH1 CT1 C 9 0.000000 0.000000 1
+ H NH1 CT1 CC 9 0.000000 0.000000 1
+ H NH1 CT1 CD 9 0.000000 0.000000 1
+ H NH1 CT1 CT1 9 0.000000 0.000000 1
+ H NH1 CT1 CT2 9 0.000000 0.000000 1
+ H NH1 CT1 CT3 9 0.000000 0.000000 1
+ H NH1 CT2 C 9 0.000000 0.000000 1
+ H NH1 CT2 CC 9 0.000000 0.000000 1
+ H NH1 CT2 CD 9 0.000000 0.000000 1
+ H NH1 CT2 CT2 9 0.000000 0.000000 1
+ H NH1 CT2 CT3 9 0.000000 0.000000 1
+ H NH2 CC CT1 9 180.000000 5.857600 2
+ H NH2 CC CT2 9 180.000000 5.857600 2
+ H NH2 CC CT3 9 180.000000 5.857600 2
+ H NH2 CC CP1 9 180.000000 10.460000 2
+ H NR1 CPH1 CPH1 9 180.000000 4.184000 2
+ H NR1 CPH1 CT2 9 180.000000 4.184000 2
+ H NR1 CPH1 CT3 9 180.000000 4.184000 2
+ H NR3 CPH1 CPH1 9 180.000000 5.857600 2
+ H NR3 CPH1 CT2 9 180.000000 12.552000 2
+ H NR3 CPH1 CT3 9 180.000000 12.552000 2
+ H OH1 CA CA 9 180.000000 4.142160 2
+ H OH1 CT1 CT3 9 0.000000 5.564720 1
+ H OH1 CT1 CT3 9 0.000000 0.753120 2
+ H OH1 CT1 CT3 9 0.000000 1.338880 3
+ H OH1 CT2 CT2 9 0.000000 5.439200 1
+ H OH1 CT2 CT2 9 0.000000 1.255200 2
+ H OH1 CT2 CT2 9 0.000000 1.757280 3
+ H OH1 CT2 CT3 9 0.000000 5.439200 1
+ H OH1 CT2 CT3 9 0.000000 1.255200 2
+ H OH1 CT2 CT3 9 0.000000 1.757280 3
+ HA1 CC NH2 H 9 180.000000 5.857600 2
+ HA2 CP3 N C 9 180.000000 0.000000 3
+ HA2 CP3 N CP1 9 0.000000 0.418400 3
+ HA2 CP3 NP CP1 9 0.000000 0.334720 3
+ HA1 CT1 CT2 CA 9 0.000000 0.167360 3
+ HA2 CT2 CPH1 CPH1 9 0.000000 0.000000 3
+ HA2 CT2 NH1 C 9 0.000000 0.000000 3
+ HA2 CT2 NH1 H 9 0.000000 0.000000 3
+ HA2 CT2 S CT3 9 0.000000 1.171520 3
+ HA3 CT3 CPH1 CPH1 9 0.000000 0.000000 3
+ HA3 CT3 CS HA2 9 0.000000 0.669440 3
+ HA3 CT3 CS HA3 9 0.000000 0.669440 3
+ HA3 CT3 CT2 CA 9 0.000000 0.167360 3
+ HA3 CT3 NH1 C 9 0.000000 0.000000 3
+ HA3 CT3 NH1 H 9 0.000000 0.000000 3
+ HA3 CT3 S CT2 9 0.000000 1.171520 3
+ HE1 CE1 CE1 HE1 9 180.000000 4.184000 2
+ CT3 CE1 CE1 HE1 9 180.000000 4.184000 2
+ HE1 CE1 CE2 HE2 9 180.000000 21.756800 2
+ HE1 CE1 CT2 HA2 9 0.000000 0.000000 3
+ HE1 CE1 CT2 CT3 9 0.000000 0.502080 3
+ HE1 CE1 CT3 HA3 9 0.000000 0.000000 3
+ HE2 CE2 CE1 CT2 9 180.000000 21.756800 2
+ HB1 CP1 N C 9 0.000000 3.347200 3
+ HB1 CP1 N CP3 9 0.000000 0.418400 3
+ HB1 CP1 NP CP3 9 0.000000 0.334720 3
+ HB1 CT1 NH1 C 9 0.000000 0.000000 1
+ HB1 CT1 NH1 H 9 0.000000 0.000000 1
+ HB2 CT2 NH1 C 9 0.000000 0.000000 1
+ HB2 CT2 NH1 H 9 0.000000 0.000000 1
+ HC NH2 CT2 HB2 9 0.000000 0.460240 3
+ HC NH2 CT2 CD 9 0.000000 0.460240 3
+ HC NH2 CT2 CT2 9 0.000000 0.460240 3
+ HC NH2 CT2 HA2 9 0.000000 0.460240 3
+ HC NP CP1 C 9 0.000000 0.334720 3
+ HC NP CP1 CC 9 0.000000 0.334720 3
+ HC NP CP1 CD 9 0.000000 0.334720 3
+ HC NP CP1 CP2 9 0.000000 0.334720 3
+ HC NP CP1 HB1 9 0.000000 0.334720 3
+ HC NP CP3 CP2 9 0.000000 0.334720 3
+ HC NP CP3 HA2 9 0.000000 0.334720 3
+ HP CA CA CA 9 180.000000 17.572800 2
+ HP CA CA CT2 9 180.000000 17.572800 2
+ HP CA CA CT3 9 180.000000 17.572800 2
+ HP CA CA HP 9 180.000000 10.041600 2
+ HR1 CPH1 CPH1 CT2 9 180.000000 4.184000 2
+ HR1 CPH1 CPH1 CT3 9 180.000000 4.184000 2
+ HR1 CPH1 CPH1 HR1 9 180.000000 4.184000 2
+ HR1 CPH1 NR3 CPH2 9 180.000000 10.460000 2
+ HR1 CPH1 NR3 H 9 180.000000 12.552000 2
+ HR1 CPH2 NR1 CPH1 9 180.000000 12.552000 2
+ HR1 CPH2 NR1 H 9 180.000000 4.184000 2
+ HR1 CPH2 NR2 CPH1 9 180.000000 12.552000 2
+ HR2 CPH2 NR3 CPH1 9 180.000000 12.552000 2
+ HR2 CPH2 NR3 H 9 180.000000 0.000000 2
+ HR3 CPH1 CPH1 CT2 9 180.000000 8.368000 2
+ HR3 CPH1 CPH1 CT3 9 180.000000 8.368000 2
+ HR3 CPH1 CPH1 HR3 9 180.000000 8.368000 2
+ HR3 CPH1 NR1 CPH2 9 180.000000 12.552000 2
+ HR3 CPH1 NR1 H 9 180.000000 4.184000 2
+ HR3 CPH1 NR2 CPH2 9 180.000000 12.552000 2
+ HS S CT2 CT3 9 0.000000 1.004160 1
+ HS S CT2 CT3 9 0.000000 0.627600 2
+ HS S CT2 CT3 9 0.000000 1.129680 3
+ HS S CT2 HA2 9 0.000000 0.836800 3
+ HS S CT3 HA3 9 0.000000 0.836800 3
+ N C CP1 CP2 9 0.000000 1.673600 1
+ N C CP1 CP2 9 0.000000 2.510400 2
+ N C CP1 HB1 9 180.000000 1.673600 1
+ N C CP1 HB1 9 0.000000 2.510400 2
+ N C CP1 N 9 0.000000 1.255200 1
+ N C CP1 N 9 0.000000 -1.255200 4
+ N C CT1 CT1 9 0.000000 0.000000 1
+ N C CT1 CT2 9 0.000000 0.000000 1
+ N C CT1 CT3 9 0.000000 0.000000 1
+ N C CT1 HB1 9 0.000000 0.000000 1
+ N C CT2 HB2 9 0.000000 0.000000 1
+ N C CT3 HA3 9 0.000000 0.000000 1
+ N CT1 CT2 CA 9 0.000000 0.167360 3
+ NH1 C CP1 CP2 9 0.000000 1.673600 1
+ NH1 C CP1 CP2 9 0.000000 2.510400 2
+ NH1 C CP1 HB1 9 180.000000 1.673600 1
+ NH1 C CP1 HB1 9 0.000000 2.510400 2
+ NH1 C CP1 N 9 0.000000 1.255200 1
+ NH1 C CP1 N 9 0.000000 -1.255200 4
+ NH1 C CT1 CT1 9 227.000000 2.092000 1 ; EEF1-SB
+ NH1 C CT1 CT2 9 227.000000 2.092000 1 ; EEF1-SB
+ NH1 C CT1 CT3 9 227.000000 2.092000 1 ; EEF1-SB
+ NH1 C CT1 HB1 9 0.000000 0.000000 1
+ NH1 C CT1 NH1 9 0.000000 2.510400 1
+ NH1 C CT2 CT2 9 0.000000 0.000000 1
+ NH1 C CT2 HA2 9 0.000000 0.000000 3
+ NH1 C CT2 HB2 9 0.000000 0.000000 1
+ NH1 C CT2 NH1 9 0.000000 2.510400 1
+ NH1 C CT3 HA3 9 0.000000 0.000000 3
+ NH1 CT1 C N 9 0.000000 1.673600 1
+ NH1 CT2 C N 9 0.000000 1.673600 1
+ NH2 CC CP1 CP2 9 0.000000 1.673600 1
+ NH2 CC CP1 CP2 9 0.000000 2.510400 2
+ NH2 CC CP1 HB1 9 180.000000 1.673600 1
+ NH2 CC CP1 HB1 9 0.000000 2.510400 2
+ NH2 CC CP1 N 9 0.000000 1.255200 1
+ NH2 CC CP1 N 9 0.000000 -1.255200 4
+ NH2 CC CT2 HA2 9 180.000000 0.000000 3
+ NH3 CT1 C N 9 0.000000 1.673600 1
+ NH3 CT1 C NH1 9 0.000000 2.510400 1
+ NH3 CT1 CC NH2 9 0.000000 1.673600 1
+ NH3 CT2 C N 9 0.000000 1.673600 1
+ NH3 CT2 C NH1 9 0.000000 4.184000 1
+ NH3 CT2 CC NH2 9 0.000000 1.673600 1
+ NP CP1 C N 9 0.000000 1.255200 1
+ NP CP1 C NH1 9 0.000000 1.255200 1
+ NP CP1 CC NH2 9 0.000000 1.255200 1
+ NR1 CPH1 CPH1 CT2 9 180.000000 12.552000 2
+ NR1 CPH1 CPH1 CT3 9 180.000000 12.552000 2
+ NR1 CPH1 CPH1 HR3 9 180.000000 12.552000 2
+ NR1 CPH1 CT2 CT2 9 0.000000 0.794960 3
+ NR1 CPH1 CT2 CT3 9 0.000000 0.794960 3
+ NR1 CPH1 CT2 HA2 9 0.000000 0.794960 3
+ NR1 CPH1 CT3 HA3 9 0.000000 0.794960 3
+ NR1 CPH2 NR2 CPH1 9 180.000000 58.576000 2
+ NR2 CPH1 CPH1 CT2 9 180.000000 12.552000 2
+ NR2 CPH1 CPH1 CT3 9 180.000000 12.552000 2
+ NR2 CPH1 CPH1 HR3 9 180.000000 12.552000 2
+ NR2 CPH1 CPH1 NR1 9 180.000000 58.576000 2
+ NR2 CPH1 CT2 CT2 9 0.000000 0.794960 3
+ NR2 CPH1 CT2 CT3 9 0.000000 0.794960 3
+ NR2 CPH1 CT2 HA2 9 0.000000 0.794960 3
+ NR2 CPH1 CT3 HA3 9 0.000000 0.794960 3
+ NR2 CPH2 NR1 CPH1 9 180.000000 58.576000 2
+ NR2 CPH2 NR1 H 9 180.000000 4.184000 2
+ NR3 CPH1 CPH1 CT2 9 180.000000 10.460000 2
+ NR3 CPH1 CPH1 CT3 9 180.000000 10.460000 2
+ NR3 CPH1 CPH1 HR1 9 180.000000 10.460000 2
+ NR3 CPH1 CPH1 NR3 9 180.000000 50.208000 2
+ NR3 CPH1 CT2 CT2 9 0.000000 0.794960 3
+ NR3 CPH1 CT2 CT3 9 0.000000 0.794960 3
+ NR3 CPH1 CT2 HA2 9 0.000000 0.794960 3
+ NR3 CPH1 CT3 HA3 9 0.000000 0.794960 3
+ NR3 CPH2 NR3 CPH1 9 180.000000 50.208000 2
+ NR3 CPH2 NR3 H 9 180.000000 5.857600 2
+ O C CP1 CP2 9 180.000000 1.673600 1
+ O C CP1 CP2 9 0.000000 2.510400 2
+ O C CP1 HB1 9 0.000000 1.673600 1
+ O C CP1 HB1 9 0.000000 2.510400 2
+ O C CP1 N 9 0.000000 -1.255200 4
+ O C CT1 CT1 9 0.000000 5.857600 1
+ O C CT1 CT2 9 0.000000 5.857600 1
+ O C CT1 CT3 9 0.000000 5.857600 1
+ O C CT1 HB1 9 0.000000 0.000000 1
+ O C CT1 NH1 9 0.000000 0.000000 1
+ O C CT1 NH3 9 0.000000 0.000000 1
+ O C CT2 CT2 9 0.000000 5.857600 1
+ O C CT2 HA2 9 180.000000 0.000000 3
+ O C CT2 HB2 9 0.000000 0.000000 1
+ O C CT2 NH1 9 0.000000 0.000000 1
+ O C CT2 NH3 9 0.000000 0.000000 1
+ O C CT3 HA3 9 180.000000 0.000000 3
+ O C N CP1 9 180.000000 11.506000 2
+ O C N CP1 9 0.000000 1.255200 4
+ O C N CP3 9 180.000000 11.506000 2
+ O C N CP3 9 0.000000 1.255200 4
+ O C NH1 CT1 9 180.000000 10.460000 2
+ O C NH1 CT2 9 180.000000 10.460000 2
+ O C NH1 CT3 9 180.000000 10.460000 2
+ O C NH1 H 9 180.000000 10.460000 2
+ O CC CP1 CP2 9 180.000000 1.673600 1
+ O CC CP1 CP2 9 0.000000 2.510400 2
+ O CC CP1 HB1 9 0.000000 1.673600 1
+ O CC CP1 HB1 9 0.000000 2.510400 2
+ O CC CP1 N 9 0.000000 -1.255200 4
+ O CC CT2 HA2 9 180.000000 0.000000 3
+ O CC NH2 H 9 180.000000 5.857600 2
+ OB CD OS CT2 9 180.000000 4.037560 1
+ OB CD OS CT2 9 180.000000 16.108400 2
+ OB CD OS CT3 9 180.000000 4.037560 1
+ OB CD OS CT3 9 180.000000 16.108400 2
+ OC CA CA CA 9 180.000000 12.970400 2
+ OC CA CA HP 9 180.000000 17.572800 2
+ OC CC CP1 CP2 9 0.000000 0.669440 3
+ OC CC CP1 HB1 9 0.000000 0.669440 3
+ OC CC CP1 N 9 0.000000 0.669440 3
+ OC CC CP1 NP 9 0.000000 0.669440 3
+ OC CC CT1 NH3 9 180.000000 13.388800 2
+ OC CC CT2 NH3 9 180.000000 13.388800 2
+ OH1 CA CA CA 9 180.000000 12.970400 2
+ OH1 CA CA HP 9 180.000000 17.572800 2
+ S CT2 CT2 HA2 9 0.000000 0.041840 3
+ SM CT2 CT2 HA2 9 0.000000 0.041840 3
+ SM SM CT2 CT1 9 0.000000 1.297040 3
+ SM SM CT2 CT2 9 0.000000 1.297040 3
+ SM SM CT2 CT3 9 0.000000 1.297040 3
+ SM SM CT2 HA2 9 0.000000 0.661072 3
+ SM SM CT3 HA3 9 0.000000 0.661072 3
+ SS CS CT3 HA3 9 0.000000 0.627600 3
+ NH1 CT1 CT1 HA1 9 0.000000 0.836800 3
+ HB1 CT1 CT1 HA1 9 0.000000 0.836800 3
+ HB1 CT1 CT1 CT3 9 0.000000 0.836800 3
+ HA1 CT1 CT1 C 9 0.000000 0.836800 3
+ NH1 CT1 CT2 HA2 9 0.000000 0.836800 3
+ HB1 CT1 CT2 HA2 9 0.000000 0.836800 3
+ HB1 CT1 CT2 OH1 9 0.000000 0.836800 3
+ HB1 CT1 CT2 CT2 9 0.000000 0.836800 3
+ HA2 CT2 CT1 C 9 0.000000 0.836800 3
+ HA2 CT2 OH1 H 9 0.000000 0.585760 3
+ CT1 CT2 CT2 HA2 9 0.000000 0.794960 3
+ HA2 CT2 CT2 HA2 9 0.000000 0.794960 3
+ HA2 CT2 CT2 CC 9 0.000000 0.794960 3
+ HB1 CT1 CT2 S 9 0.000000 0.836800 3
+ CT2 CT2 CT2 HA2 9 0.000000 0.794960 3
+ CT2 CT2 CT2 NC2 9 0.000000 0.794960 3
+ CT2 CT2 NC2 HC 9 180.000000 0.000000 6
+ CT2 CT2 NC2 C 9 180.000000 0.000000 6
+ HA2 CT2 CT2 NC2 9 0.000000 0.794960 3
+ CT2 NC2 C NC2 9 180.000000 9.414000 2
+ HA2 CT2 NC2 HC 9 180.000000 0.000000 6
+ HA2 CT2 NC2 C 9 180.000000 0.000000 6
+ NC2 C NC2 HC 9 180.000000 9.414000 2
+ HB1 CT1 CT2 CC 9 0.000000 0.836800 3
+ HB1 CT1 CT2 CY 9 0.000000 0.836800 3
+ HA2 CT2 CC OC 9 180.000000 0.209200 6
+ HB1 CT1 CT2 CPH1 9 0.000000 0.836800 3
+ CT1 CT1 CT3 HA3 9 0.000000 0.836800 3
+ CT1 CT1 CT2 HA2 9 0.000000 0.836800 3
+ HB1 CT1 CT1 CT2 9 0.000000 0.836800 3
+ CT1 CT2 CT3 HA3 9 0.000000 0.669440 3
+ HA1 CT1 CT3 HA3 9 0.000000 0.836800 3
+ HA1 CT1 CT2 HA2 9 0.000000 0.836800 3
+ HA1 CT1 CT2 CT3 9 0.000000 0.836800 3
+ CT3 CT1 CT2 HA2 9 0.000000 0.836800 3
+ CT3 CT1 CT2 CT3 9 0.000000 0.836800 3
+ HA3 CT3 CT1 CT2 9 0.000000 0.836800 3
+ HA2 CT2 CT3 HA3 9 0.000000 0.669440 3
+ CT1 CT2 CT1 HA1 9 0.000000 0.836800 3
+ HB1 CT1 CT2 CT1 9 0.000000 0.836800 3
+ CT3 CT1 CT3 HA3 9 0.000000 0.836800 3
+ CT2 CT2 CT2 NH3 9 0.000000 0.794960 3
+ CT2 CT2 NH3 HC 9 0.000000 0.418400 3
+ HA2 CT2 CT2 NH3 9 0.000000 0.794960 3
+ HA2 CT2 NH3 HC 9 0.000000 0.418400 3
+ HB1 CT1 CT2 CA 9 0.000000 0.836800 3
+ HA2 CT2 CA CA 9 0.000000 0.000000 6
+ HB1 CT1 CT1 OH1 9 0.000000 0.836800 3
+ HA1 CT1 OH1 H 9 0.000000 0.585760 3
+ OH1 CT1 CT3 HA3 9 0.000000 0.836800 3
+ CT2 CT2 CC O 9 180.000000 0.209200 6
+ CT2 CT2 CC NH2 9 180.000000 0.209200 6
+ CT2 CT2 CC OC 9 180.000000 0.209200 6
+ NH1 CT1 CT2A HA2 9 0.000000 0.836800 3
+ NH3 CT1 CT2A CT2 9 0.000000 0.836800 3
+ CT1 CT2A CT2 HA2 9 0.000000 0.794960 3
+ HB1 CT1 CT2A HA2 9 0.000000 0.836800 3
+ HB1 CT1 CT2A CT2 9 0.000000 0.836800 3
+ HA2 CT2A CT1 C 9 0.000000 0.836800 3
+ HA2 CT2A CT1 CC 9 0.000000 0.836800 3
+ HA2 CT2A CT2 HA2 9 0.000000 0.794960 3
+ HA2 CT2A CT2 CC 9 0.000000 0.794960 3
+ HB1 CT1 CT2A CPH1 9 0.000000 0.836800 3
+ C NH1 CT1 CT2A 9 0.000000 7.531200 1
+ H NH1 CT1 CT2A 9 0.000000 0.000000 1
+ CT2A CT1 C O 9 0.000000 5.857600 1
+ CT2A CT1 C NH1 9 227.000000 2.092000 1 ; EEF1-SB
+ CT2A CT1 C N 9 0.000000 0.000000 1
+ CT1 CT2A CT2 CD 9 0.000000 0.794960 3
+ HA2 CT2A CT2 CD 9 0.000000 0.794960 3
+ CT2A CPH1 CPH1 HR1 9 180.000000 4.184000 2
+ CT2A CPH1 CPH1 NR3 9 180.000000 10.460000 2
+ CT2A CPH1 NR3 H 9 180.000000 12.552000 2
+ CT2A CPH1 NR3 CPH2 9 180.000000 10.460000 2
+ HA2 CT2A CPH1 CPH1 9 0.000000 0.000000 3
+ HA2 CT2A CPH1 NR3 9 0.000000 0.794960 3
+ C CT1 CT2 CT2 9 180.000000 1.464400 1
+ C CT1 CT2 CT2 9 180.000000 1.757280 2
+ C CT1 CT2 CT2 9 180.000000 7.991440 3
+ CT2 CT2 CT1 NH1 9 180.000000 3.681920 1
+ CT2 CT2 CT1 NH1 9 180.000000 0.000000 2
+ CT2 CT2 CT1 NH1 9 0.000000 7.949600 3
+ CC CT2 CT2 CT1 9 180.000000 7.698560 1
+ CC CT2 CT2 CT1 9 180.000000 3.514560 2
+ CC CT2 CT2 CT1 9 180.000000 1.631760 3
+ CT1 CT2 CT2 CT2 9 180.000000 2.635920 1
+ CT1 CT2 CT2 CT2 9 0.000000 0.041840 2
+ CT1 CT2 CT2 CT2 9 0.000000 0.627600 3
+ CT1 CT2 CT2 S 9 180.000000 0.585760 1
+ CT1 CT2 CT2 S 9 0.000000 2.259360 2
+ CT1 CT2 CT2 S 9 0.000000 2.886960 3
+ C CT1 CT2 CC 9 180.000000 5.899440 1
+ C CT1 CT2 CC 9 180.000000 5.397360 2
+ C CT1 CT2 CC 9 180.000000 2.468560 3
+ CC CT2 CT1 NH1 9 180.000000 1.171520 1
+ CC CT2 CT1 NH1 9 180.000000 2.092000 2
+ CC CT2 CT1 NH1 9 0.000000 1.589920 3
+ CT1 CT2 CC NH2 9 180.000000 2.594080 1
+ CT1 CT2 CC NH2 9 180.000000 2.761440 2
+ CT1 CT2 CC NH2 9 180.000000 3.012480 3
+ CT1 CT2 CC O 9 180.000000 1.757280 1
+ CT1 CT2 CC O 9 180.000000 0.627600 2
+ CT1 CT2 CC O 9 180.000000 3.974800 3
+ C CT1 CT2A CC 9 180.000000 6.736240 1
+ C CT1 CT2A CC 9 180.000000 5.397360 2
+ C CT1 CT2A CC 9 180.000000 2.468560 3
+ CC CT2A CT1 NH1 9 180.000000 2.845120 1
+ CC CT2A CT1 NH1 9 180.000000 0.418400 2
+ CC CT2A CT1 NH1 9 0.000000 1.589920 3
+ CT1 CT2A CC OC 9 0.000000 3.514560 1
+ CT1 CT2A CC OC 9 180.000000 4.100320 2
+ CT1 CT2A CC OC 9 0.000000 6.108640 3
+ CT1 CT2 S HS 9 0.000000 0.836800 1
+ CT1 CT2 S HS 9 0.000000 2.719600 2
+ CT1 CT2 S HS 9 0.000000 0.920480 3
+ C CT1 CT2 S 9 180.000000 1.004160 1
+ C CT1 CT2 S 9 180.000000 3.138000 2
+ C CT1 CT2 S 9 180.000000 5.648400 3
+ NH1 CT1 CT2 S 9 0.000000 1.422560 1
+ NH1 CT1 CT2 S 9 180.000000 2.092000 2
+ NH1 CT1 CT2 S 9 0.000000 5.983120 3
+ CC CT2 CT2A CT1 9 180.000000 0.000000 1
+ CC CT2 CT2A CT1 9 180.000000 1.589920 2
+ CC CT2 CT2A CT1 9 180.000000 2.468560 3
+ C CT1 CT2A CT2 9 0.000000 0.460240 1
+ C CT1 CT2A CT2 9 180.000000 4.100320 2
+ C CT1 CT2A CT2 9 180.000000 6.694400 3
+ CC CT1 CT2A CT2 9 180.000000 6.694400 3
+ CT2 CT2A CT1 NH1 9 0.000000 1.255200 1
+ CT2 CT2A CT1 NH1 9 0.000000 1.464400 2
+ CT2 CT2A CT1 NH1 9 0.000000 7.363840 3
+ CPH1 CPH1 CT2 CT1 9 0.000000 7.280160 1
+ CPH1 CPH1 CT2 CT1 9 0.000000 0.627600 2
+ CPH1 CPH1 CT2 CT1 9 180.000000 3.221680 3
+ CT1 CT2 CPH1 NR1 9 0.000000 6.234160 1
+ CT1 CT2 CPH1 NR1 9 180.000000 0.376560 2
+ CT1 CT2 CPH1 NR1 9 180.000000 3.305360 3
+ CT1 CT2 CPH1 NR2 9 0.000000 4.560560 1
+ CT1 CT2 CPH1 NR2 9 0.000000 0.376560 2
+ CT1 CT2 CPH1 NR2 9 180.000000 2.803280 3
+ C CT1 CT2 CPH1 9 180.000000 0.753120 1
+ C CT1 CT2 CPH1 9 180.000000 2.677760 2
+ C CT1 CT2 CPH1 9 180.000000 3.640080 3
+ CPH1 CT2 CT1 NH1 9 0.000000 0.000000 1
+ CPH1 CT2 CT1 NH1 9 180.000000 0.000000 2
+ CPH1 CT2 CT1 NH1 9 0.000000 3.765600 3
+ CPH1 CPH1 CT2A CT1 9 0.000000 8.535360 1
+ CPH1 CPH1 CT2A CT1 9 0.000000 1.840960 2
+ CPH1 CPH1 CT2A CT1 9 180.000000 0.543920 3
+ CT1 CT2A CPH1 NR3 9 180.000000 2.217520 1
+ CT1 CT2A CPH1 NR3 9 180.000000 1.757280 2
+ CT1 CT2A CPH1 NR3 9 180.000000 1.255200 3
+ C CT1 CT2A CPH1 9 180.000000 7.322000 1
+ C CT1 CT2A CPH1 9 0.000000 0.543920 2
+ C CT1 CT2A CPH1 9 180.000000 7.782240 3
+ CPH1 CT2A CT1 NH1 9 180.000000 4.560560 1
+ CPH1 CT2A CT1 NH1 9 180.000000 0.920480 2
+ CPH1 CT2A CT1 NH1 9 0.000000 9.706880 3
+ CT1 CT1 CT2 CT3 9 180.000000 1.589920 1
+ CT1 CT1 CT2 CT3 9 180.000000 0.543920 2
+ CT1 CT1 CT2 CT3 9 180.000000 1.213360 3
+ C CT1 CT1 CT2 9 180.000000 0.418400 1
+ C CT1 CT1 CT2 9 180.000000 2.175680 2
+ C CT1 CT1 CT2 9 180.000000 1.213360 3
+ CT2 CT1 CT1 NH1 9 180.000000 0.502080 1
+ CT2 CT1 CT1 NH1 9 180.000000 1.506240 2
+ CT2 CT1 CT1 NH1 9 0.000000 1.715440 3
+ CT1 CT2 CT1 CT3 9 0.000000 0.209200 1
+ CT1 CT2 CT1 CT3 9 180.000000 0.418400 2
+ CT1 CT2 CT1 CT3 9 180.000000 0.041840 3
+ C CT1 CT2 CT1 9 180.000000 1.338880 1
+ C CT1 CT2 CT1 9 180.000000 2.552240 2
+ C CT1 CT2 CT1 9 180.000000 3.012480 3
+ CT1 CT2 CT1 NH1 9 180.000000 2.008320 1
+ CT1 CT2 CT1 NH1 9 180.000000 1.757280 2
+ CT1 CT2 CT1 NH1 9 0.000000 2.719600 3
+ CA CA CT2 CT1 9 0.000000 4.476880 1
+ CA CA CT2 CT1 9 180.000000 1.004160 2
+ CA CA CT2 CT1 9 180.000000 0.711280 3
+ C CT1 CT2 CA 9 180.000000 5.355520 1
+ C CT1 CT2 CA 9 180.000000 3.932960 2
+ C CT1 CT2 CA 9 180.000000 6.568880 3
+ CA CT2 CT1 NH1 9 180.000000 2.175680 1
+ CA CT2 CT1 NH1 9 180.000000 2.594080 2
+ CA CT2 CT1 NH1 9 0.000000 6.610720 3
+ CT1 CT2 OH1 H 9 0.000000 0.083680 1
+ CT1 CT2 OH1 H 9 0.000000 2.343040 2
+ CT1 CT2 OH1 H 9 0.000000 2.050160 3
+ C CT1 CT2 OH1 9 180.000000 2.719600 1
+ C CT1 CT2 OH1 9 180.000000 1.046000 2
+ C CT1 CT2 OH1 9 180.000000 4.895280 3
+ NH1 CT1 CT2 OH1 9 180.000000 0.753120 1
+ NH1 CT1 CT2 OH1 9 180.000000 0.794960 2
+ NH1 CT1 CT2 OH1 9 0.000000 6.108640 3
+ CT1 CT1 OH1 H 9 0.000000 0.753120 1
+ CT1 CT1 OH1 H 9 0.000000 0.251040 2
+ CT1 CT1 OH1 H 9 0.000000 1.046000 3
+ C CT1 CT1 OH1 9 180.000000 3.305360 1
+ C CT1 CT1 OH1 9 180.000000 1.631760 2
+ C CT1 CT1 OH1 9 180.000000 4.142160 3
+ NH1 CT1 CT1 OH1 9 0.000000 0.376560 1
+ NH1 CT1 CT1 OH1 9 180.000000 0.794960 2
+ NH1 CT1 CT1 OH1 9 0.000000 0.711280 3
+ CA CY CT2 CT1 9 0.000000 0.125520 1
+ CA CY CT2 CT1 9 0.000000 2.301200 2
+ CA CY CT2 CT1 9 180.000000 1.631760 3
+ CPT CY CT2 CT1 9 180.000000 1.506240 1
+ CPT CY CT2 CT1 9 0.000000 0.209200 2
+ CPT CY CT2 CT1 9 180.000000 0.794960 3
+ C CT1 CT2 CY 9 180.000000 4.560560 1
+ C CT1 CT2 CY 9 180.000000 2.092000 2
+ C CT1 CT2 CY 9 180.000000 4.895280 3
+ CY CT2 CT1 NH1 9 180.000000 1.213360 1
+ CY CT2 CT1 NH1 9 180.000000 2.761440 2
+ CY CT2 CT1 NH1 9 0.000000 4.895280 3
+ C CT1 CT1 CT3 9 180.000000 0.585760 1
+ C CT1 CT1 CT3 9 180.000000 1.087840 2
+ C CT1 CT1 CT3 9 180.000000 1.380720 3
+ CT3 CT1 CT1 NH1 9 0.000000 0.753120 1
+ CT3 CT1 CT1 NH1 9 0.000000 0.251040 2
+ CT3 CT1 CT1 NH1 9 0.000000 2.468560 3
+ H NH1 CT2A CC 9 0.000000 0.000000 1
+ HB1 CT1 CT2A CC 9 0.000000 0.836800 3
+ HA2 CT2A CC OC 9 180.000000 0.209200 6
+ NH3 CT1 CT2A HA2 9 0.000000 0.836800 3
+ NH3 CT1 CT2A CC 9 0.000000 0.836800 3
+ CC CT2A CT1 CC 9 0.000000 0.836800 3
+ CPH1 CT2A CT1 CC 9 0.000000 0.836800 3
+ CPH1 CT2A CT1 NH3 9 0.000000 0.836800 3
+ CPH1 CT2A CT1 CD 9 0.000000 0.836800 3
+ HA2 CT2A CT1 CD 9 0.000000 0.836800 3
+ CT2 CT2A CT1 CD 9 0.000000 0.836800 3
+ CG2R53 CG251O CG25C1 CG2R53 9 180.000000 26.777600 2
+ CG2R53 CG251O CG25C1 CG2RC0 9 180.000000 26.777600 2
+ NG2R53 CG251O CG25C1 CG2R53 9 180.000000 14.225600 2
+ NG2R53 CG251O CG25C1 CG2RC0 9 180.000000 14.225600 2
+ SG311 CG251O CG25C1 CG2R53 9 180.000000 26.777600 2
+ SG311 CG251O CG25C1 CG2RC0 9 180.000000 26.777600 2
+ CG2R53 CG251O CG2DC3 HGA5 9 180.000000 16.317600 2
+ NG2R53 CG251O CG2DC3 HGA5 9 180.000000 19.246400 2
+ SG311 CG251O CG2DC3 HGA5 9 180.000000 22.175200 2
+ CG25C1 CG251O CG2R53 NG2R53 9 180.000000 20.920000 2
+ CG25C1 CG251O CG2R53 OG2D1 9 180.000000 16.736000 2
+ CG2DC3 CG251O CG2R53 NG2R53 9 180.000000 0.836800 2
+ CG2DC3 CG251O CG2R53 OG2D1 9 180.000000 3.347200 2
+ NG2R53 CG251O CG2R53 NG2R53 9 180.000000 0.836800 2
+ NG2R53 CG251O CG2R53 OG2D1 9 180.000000 18.828000 2
+ SG311 CG251O CG2R53 NG2R53 9 180.000000 5.020800 2
+ SG311 CG251O CG2R53 OG2D1 9 180.000000 3.347200 2
+ CG25C1 CG251O NG2R53 CG2R53 9 180.000000 16.736000 2
+ CG25C1 CG251O NG2R53 HGP1 9 180.000000 1.673600 2
+ CG2DC3 CG251O NG2R53 CG2R53 9 180.000000 4.184000 2
+ CG2DC3 CG251O NG2R53 HGP1 9 180.000000 1.673600 2
+ CG2R53 CG251O NG2R53 CG2R53 9 180.000000 2.092000 2
+ CG2R53 CG251O NG2R53 HGP1 9 180.000000 1.673600 2
+ CG25C1 CG251O SG311 CG2R53 9 0.000000 16.736000 3
+ CG2DC3 CG251O SG311 CG2R53 9 0.000000 0.836800 3
+ CG2R53 CG251O SG311 CG2R53 9 180.000000 5.020800 3
+ CG2R53 CG252O CG25C2 CG2R53 9 180.000000 26.777600 2
+ CG2R53 CG252O CG25C2 CG2RC0 9 180.000000 26.777600 2
+ NG2R53 CG252O CG25C2 CG2R53 9 180.000000 14.225600 2
+ NG2R53 CG252O CG25C2 CG2RC0 9 180.000000 14.225600 2
+ SG311 CG252O CG25C2 CG2R53 9 180.000000 26.777600 2
+ SG311 CG252O CG25C2 CG2RC0 9 180.000000 26.777600 2
+ CG2R53 CG252O CG2DC3 HGA5 9 180.000000 16.317600 2
+ NG2R53 CG252O CG2DC3 HGA5 9 180.000000 19.246400 2
+ SG311 CG252O CG2DC3 HGA5 9 180.000000 22.175200 2
+ CG25C2 CG252O CG2R53 NG2R53 9 180.000000 20.920000 2
+ CG25C2 CG252O CG2R53 OG2D1 9 180.000000 16.736000 2
+ CG2DC3 CG252O CG2R53 NG2R53 9 180.000000 0.836800 2
+ CG2DC3 CG252O CG2R53 OG2D1 9 180.000000 3.347200 2
+ NG2R53 CG252O CG2R53 NG2R53 9 180.000000 0.836800 2
+ NG2R53 CG252O CG2R53 OG2D1 9 180.000000 18.828000 2
+ SG311 CG252O CG2R53 NG2R53 9 180.000000 5.020800 2
+ SG311 CG252O CG2R53 OG2D1 9 180.000000 3.347200 2
+ CG25C2 CG252O NG2R53 CG2R53 9 180.000000 16.736000 2
+ CG25C2 CG252O NG2R53 HGP1 9 180.000000 1.673600 2
+ CG2DC3 CG252O NG2R53 CG2R53 9 180.000000 4.184000 2
+ CG2DC3 CG252O NG2R53 HGP1 9 180.000000 1.673600 2
+ CG2R53 CG252O NG2R53 CG2R53 9 180.000000 2.092000 2
+ CG2R53 CG252O NG2R53 HGP1 9 180.000000 1.673600 2
+ CG25C2 CG252O SG311 CG2R53 9 0.000000 16.736000 3
+ CG2DC3 CG252O SG311 CG2R53 9 0.000000 0.836800 3
+ CG2R53 CG252O SG311 CG2R53 9 180.000000 5.020800 3
+ CG2R53 CG25C1 CG2DC3 HGA5 9 180.000000 18.409600 2
+ CG2RC0 CG25C1 CG2DC3 HGA5 9 180.000000 18.409600 2
+ CG251O CG25C1 CG2R53 NG2R51 9 180.000000 12.552000 2
+ CG251O CG25C1 CG2R53 OG2D1 9 180.000000 16.736000 2
+ CG2DC3 CG25C1 CG2R53 NG2R51 9 180.000000 0.418400 2
+ CG2DC3 CG25C1 CG2R53 OG2D1 9 180.000000 4.184000 2
+ CG2RC0 CG25C1 CG2R53 NG2R51 9 180.000000 5.020800 2
+ CG2RC0 CG25C1 CG2R53 OG2D1 9 180.000000 5.020800 2
+ CG251O CG25C1 CG2RC0 CG2R61 9 180.000000 16.736000 2
+ CG251O CG25C1 CG2RC0 CG2RC0 9 180.000000 16.736000 2
+ CG2DC3 CG25C1 CG2RC0 CG2R61 9 180.000000 0.418400 2
+ CG2DC3 CG25C1 CG2RC0 CG2RC0 9 180.000000 0.418400 2
+ CG2R53 CG25C1 CG2RC0 CG2R61 9 180.000000 12.552000 2
+ CG2R53 CG25C1 CG2RC0 CG2RC0 9 180.000000 14.644000 2
+ CG2R53 CG25C2 CG2DC3 HGA5 9 180.000000 18.409600 2
+ CG2RC0 CG25C2 CG2DC3 HGA5 9 180.000000 18.409600 2
+ CG252O CG25C2 CG2R53 NG2R51 9 180.000000 12.552000 2
+ CG252O CG25C2 CG2R53 OG2D1 9 180.000000 16.736000 2
+ CG2DC3 CG25C2 CG2R53 NG2R51 9 180.000000 0.418400 2
+ CG2DC3 CG25C2 CG2R53 OG2D1 9 180.000000 4.184000 2
+ CG2RC0 CG25C2 CG2R53 NG2R51 9 180.000000 5.020800 2
+ CG2RC0 CG25C2 CG2R53 OG2D1 9 180.000000 5.020800 2
+ CG252O CG25C2 CG2RC0 CG2R61 9 180.000000 16.736000 2
+ CG252O CG25C2 CG2RC0 CG2RC0 9 180.000000 16.736000 2
+ CG2DC3 CG25C2 CG2RC0 CG2R61 9 180.000000 0.418400 2
+ CG2DC3 CG25C2 CG2RC0 CG2RC0 9 180.000000 0.418400 2
+ CG2R53 CG25C2 CG2RC0 CG2R61 9 180.000000 12.552000 2
+ CG2R53 CG25C2 CG2RC0 CG2RC0 9 180.000000 14.644000 2
+ CG301 CG2D1 CG2D1 CG321 9 180.000000 1.882800 1
+ CG301 CG2D1 CG2D1 CG321 9 180.000000 35.564000 2
+ CG301 CG2D1 CG2D1 CG331 9 180.000000 41.840000 2
+ CG301 CG2D1 CG2D1 HGA4 9 180.000000 4.184000 2
+ CG321 CG2D1 CG2D1 CG321 9 180.000000 1.882800 1
+ CG321 CG2D1 CG2D1 CG321 9 180.000000 35.564000 2
+ CG321 CG2D1 CG2D1 CG331 9 180.000000 1.882800 1
+ CG321 CG2D1 CG2D1 CG331 9 180.000000 35.564000 2
+ CG321 CG2D1 CG2D1 HGA4 9 180.000000 4.184000 2
+ CG331 CG2D1 CG2D1 CG331 9 180.000000 1.882800 1
+ CG331 CG2D1 CG2D1 CG331 9 180.000000 35.564000 2
+ CG331 CG2D1 CG2D1 HGA4 9 180.000000 4.184000 2
+ HGA4 CG2D1 CG2D1 HGA4 9 180.000000 4.184000 2
+ CG321 CG2D1 CG2D1O NG301 9 180.000000 12.552000 2
+ CG321 CG2D1 CG2D1O NG311 9 180.000000 12.552000 2
+ CG321 CG2D1 CG2D1O OG3R60 9 180.000000 12.552000 2
+ CG321 CG2D1 CG2D1O HGA4 9 180.000000 25.104000 2
+ HGA4 CG2D1 CG2D1O NG301 9 180.000000 4.184000 2
+ HGA4 CG2D1 CG2D1O NG311 9 180.000000 4.184000 2
+ HGA4 CG2D1 CG2D1O OG3R60 9 180.000000 33.472000 2
+ HGA4 CG2D1 CG2D1O HGA4 9 180.000000 4.184000 2
+ CG321 CG2D1 CG2D2 HGA5 9 180.000000 21.756800 2
+ CG331 CG2D1 CG2D2 HGA5 9 180.000000 21.756800 2
+ HGA4 CG2D1 CG2D2 HGA5 9 180.000000 21.756800 2
+ CG321 CG2D1 CG2D2O NG301 9 180.000000 12.552000 2
+ CG321 CG2D1 CG2D2O NG311 9 180.000000 12.552000 2
+ CG321 CG2D1 CG2D2O OG3R60 9 180.000000 12.552000 2
+ CG321 CG2D1 CG2D2O HGA4 9 180.000000 25.104000 2
+ HGA4 CG2D1 CG2D2O NG301 9 180.000000 4.184000 2
+ HGA4 CG2D1 CG2D2O NG311 9 180.000000 4.184000 2
+ HGA4 CG2D1 CG2D2O OG3R60 9 180.000000 33.472000 2
+ HGA4 CG2D1 CG2D2O HGA4 9 180.000000 4.184000 2
+ CG2D1 CG2D1 CG301 CG311 9 180.000000 2.092000 1
+ CG2D1 CG2D1 CG301 CG311 9 180.000000 5.439200 3
+ CG2D1 CG2D1 CG301 CG321 9 180.000000 2.092000 1
+ CG2D1 CG2D1 CG301 CG321 9 180.000000 5.439200 3
+ CG2D1 CG2D1 CG301 CG331 9 180.000000 2.092000 1
+ CG2D1 CG2D1 CG301 CG331 9 180.000000 5.439200 3
+ CG321 CG2D1 CG301 CG311 9 180.000000 0.000000 3
+ CG321 CG2D1 CG301 CG321 9 180.000000 1.255200 3
+ CG321 CG2D1 CG301 CG331 9 180.000000 0.000000 3
+ CG331 CG2D1 CG301 CG321 9 0.000000 1.673600 3
+ CG331 CG2D1 CG301 CG331 9 0.000000 1.673600 3
+ CG2D1 CG2D1 CG321 CG2D1 9 180.000000 4.184000 1
+ CG2D1 CG2D1 CG321 CG2D1 9 0.000000 0.418400 2
+ CG2D1 CG2D1 CG321 CG2D1 9 180.000000 1.255200 3
+ CG2D1 CG2D1 CG321 CG2D1 9 0.000000 0.836800 4
+ CG2D1 CG2D1 CG321 CG311 9 180.000000 2.092000 1
+ CG2D1 CG2D1 CG321 CG311 9 180.000000 5.439200 3
+ CG2D1 CG2D1 CG321 CG321 9 180.000000 2.510400 1
+ CG2D1 CG2D1 CG321 CG331 9 180.000000 3.765600 1
+ CG2D1 CG2D1 CG321 CG331 9 180.000000 0.836800 2
+ CG2D1 CG2D1 CG321 HGA2 9 180.000000 1.255200 3
+ CG2D1O CG2D1 CG321 CG2D1 9 0.000000 2.092000 2
+ CG2D1O CG2D1 CG321 CG2D1 9 0.000000 1.882800 4
+ CG2D1O CG2D1 CG321 CG2DC1 9 180.000000 0.000000 3
+ CG2D1O CG2D1 CG321 HGA2 9 0.000000 0.418400 3
+ CG2D2 CG2D1 CG321 CG2D1 9 180.000000 5.020800 1
+ CG2D2 CG2D1 CG321 CG2D1 9 180.000000 1.673600 2
+ CG2D2 CG2D1 CG321 CG2D1 9 180.000000 5.439200 3
+ CG2D2 CG2D1 CG321 CG331 9 180.000000 2.092000 1
+ CG2D2 CG2D1 CG321 CG331 9 180.000000 5.439200 3
+ CG2D2 CG2D1 CG321 OG311 9 180.000000 7.949600 1
+ CG2D2 CG2D1 CG321 OG311 9 180.000000 1.673600 2
+ CG2D2 CG2D1 CG321 OG311 9 180.000000 2.510400 3
+ CG2D2 CG2D1 CG321 HGA2 9 0.000000 0.502080 3
+ CG2D2O CG2D1 CG321 CG2D1 9 0.000000 2.092000 2
+ CG2D2O CG2D1 CG321 CG2D1 9 0.000000 1.882800 4
+ CG2D2O CG2D1 CG321 CG2DC2 9 180.000000 0.000000 3
+ CG2D2O CG2D1 CG321 HGA2 9 0.000000 0.418400 3
+ CG301 CG2D1 CG321 CG311 9 180.000000 1.255200 3
+ CG301 CG2D1 CG321 HGA2 9 0.000000 0.125520 3
+ CG331 CG2D1 CG321 CG321 9 0.000000 0.794960 3
+ CG331 CG2D1 CG321 HGA2 9 0.000000 0.794960 3
+ HGA4 CG2D1 CG321 CG2D1 9 0.000000 0.000000 3
+ HGA4 CG2D1 CG321 CG2DC1 9 0.000000 0.000000 3
+ HGA4 CG2D1 CG321 CG2DC2 9 0.000000 0.000000 3
+ HGA4 CG2D1 CG321 CG311 9 0.000000 0.000000 3
+ HGA4 CG2D1 CG321 CG321 9 0.000000 0.502080 3
+ HGA4 CG2D1 CG321 CG331 9 0.000000 0.502080 3
+ HGA4 CG2D1 CG321 OG311 9 0.000000 0.836800 3
+ HGA4 CG2D1 CG321 HGA2 9 0.000000 0.000000 3
+ CG2D1 CG2D1 CG331 HGA3 9 180.000000 1.255200 3
+ CG2D2 CG2D1 CG331 HGA3 9 180.000000 0.209200 3
+ CG301 CG2D1 CG331 HGA3 9 0.000000 0.669440 3
+ CG321 CG2D1 CG331 HGA3 9 0.000000 0.669440 3
+ NG2D1 CG2D1 CG331 HGA3 9 180.000000 0.418400 3
+ NG2P1 CG2D1 CG331 HGA3 9 180.000000 0.627600 3
+ HGA4 CG2D1 CG331 HGA3 9 0.000000 0.000000 3
+ HGR52 CG2D1 CG331 HGA3 9 0.000000 0.627600 3
+ CG331 CG2D1 NG2D1 CG331 9 180.000000 50.208000 2
+ CG331 CG2D1 NG2D1 NG2S1 9 180.000000 50.208000 2
+ HGA4 CG2D1 NG2D1 CG331 9 180.000000 35.564000 2
+ HGA4 CG2D1 NG2D1 NG2S1 9 180.000000 16.736000 2
+ CG331 CG2D1 NG2P1 CG334 9 180.000000 29.288000 2
+ CG331 CG2D1 NG2P1 HGP2 9 180.000000 20.920000 2
+ HGR52 CG2D1 NG2P1 CG334 9 180.000000 35.564000 2
+ HGR52 CG2D1 NG2P1 HGP2 9 180.000000 20.920000 2
+ NG321 CG2D1O CG2D2 HGA5 9 180.000000 8.368000 2
+ OG301 CG2D1O CG2D2 HGA5 9 180.000000 37.656000 2
+ HGA4 CG2D1O CG2D2 HGA5 9 180.000000 8.368000 2
+ NG301 CG2D1O CG2DC1 CG2O1 9 180.000000 10.460000 2
+ NG301 CG2D1O CG2DC1 CG321 9 180.000000 10.460000 2
+ NG311 CG2D1O CG2DC1 CG2O1 9 180.000000 10.460000 2
+ NG311 CG2D1O CG2DC1 CG321 9 180.000000 10.460000 2
+ OG301 CG2D1O CG2DC1 CG2DC2 9 180.000000 6.276000 1
+ OG301 CG2D1O CG2DC1 CG2DC2 9 180.000000 62.760000 2
+ OG301 CG2D1O CG2DC1 HGA4 9 180.000000 12.552000 2
+ OG3R60 CG2D1O CG2DC1 CG2DC2 9 180.000000 8.368000 2
+ OG3R60 CG2D1O CG2DC1 HGA4 9 180.000000 29.288000 2
+ HGA4 CG2D1O CG2DC1 CG2DC2 9 180.000000 25.104000 2
+ HGA4 CG2D1O CG2DC1 CG2O1 9 180.000000 4.184000 2
+ HGA4 CG2D1O CG2DC1 CG321 9 180.000000 4.184000 2
+ HGA4 CG2D1O CG2DC1 HGA4 9 180.000000 10.460000 2
+ CG2D1 CG2D1O NG301 CG2D1O 9 180.000000 0.418400 2
+ CG2D1 CG2D1O NG301 CG3C51 9 180.000000 0.418400 2
+ CG2DC1 CG2D1O NG301 CG2D1O 9 180.000000 2.092000 2
+ CG2DC1 CG2D1O NG301 CG3C51 9 180.000000 0.418400 2
+ HGA4 CG2D1O NG301 CG2D1O 9 180.000000 0.418400 2
+ HGA4 CG2D1O NG301 CG3C51 9 180.000000 0.418400 2
+ CG2D1 CG2D1O NG311 CG2D1O 9 180.000000 0.418400 2
+ CG2D1 CG2D1O NG311 HGPAM1 9 180.000000 0.418400 2
+ CG2DC1 CG2D1O NG311 CG2D1O 9 180.000000 2.092000 2
+ CG2DC1 CG2D1O NG311 HGPAM1 9 180.000000 0.418400 2
+ HGA4 CG2D1O NG311 CG2D1O 9 180.000000 0.418400 2
+ HGA4 CG2D1O NG311 HGPAM1 9 180.000000 0.418400 2
+ CG2D2 CG2D1O NG321 HGPAM2 9 0.000000 7.112800 1
+ CG2D2 CG2D1O NG321 HGPAM2 9 180.000000 12.803040 2
+ CG2D2 CG2D1O NG321 HGPAM2 9 180.000000 0.962320 3
+ CG2D2 CG2D1O NG321 HGPAM2 9 0.000000 0.502080 4
+ HGA4 CG2D1O NG321 HGPAM2 9 0.000000 0.669440 3
+ CG2D2 CG2D1O OG301 CG331 9 180.000000 3.765600 1
+ CG2D2 CG2D1O OG301 CG331 9 180.000000 12.970400 2
+ CG2D2 CG2D1O OG301 CG331 9 180.000000 5.020800 3
+ CG2DC1 CG2D1O OG301 CG331 9 180.000000 3.347200 1
+ CG2DC1 CG2D1O OG301 CG331 9 180.000000 12.552000 2
+ CG2DC1 CG2D1O OG301 CG331 9 180.000000 4.602400 3
+ HGA4 CG2D1O OG301 CG331 9 180.000000 0.000000 2
+ CG2D1 CG2D1O OG3R60 CG2D1O 9 180.000000 12.552000 2
+ CG2D1 CG2D1O OG3R60 CG2D2O 9 180.000000 12.552000 2
+ CG2DC1 CG2D1O OG3R60 CG321 9 0.000000 8.368000 2
+ HGA4 CG2D1O OG3R60 CG2D1O 9 180.000000 0.000000 2
+ HGA4 CG2D1O OG3R60 CG2D2O 9 180.000000 0.000000 2
+ HGA4 CG2D1O OG3R60 CG321 9 180.000000 0.000000 2
+ HGA5 CG2D2 CG2D2 HGA5 9 180.000000 20.501600 2
+ HGA5 CG2D2 CG2D2O NG321 9 180.000000 8.368000 2
+ HGA5 CG2D2 CG2D2O OG301 9 180.000000 37.656000 2
+ HGA5 CG2D2 CG2D2O HGA4 9 180.000000 8.368000 2
+ NG301 CG2D2O CG2DC2 CG2O1 9 180.000000 10.460000 2
+ NG301 CG2D2O CG2DC2 CG321 9 180.000000 10.460000 2
+ NG311 CG2D2O CG2DC2 CG2O1 9 180.000000 10.460000 2
+ NG311 CG2D2O CG2DC2 CG321 9 180.000000 10.460000 2
+ OG301 CG2D2O CG2DC2 CG2DC1 9 180.000000 6.276000 1
+ OG301 CG2D2O CG2DC2 CG2DC1 9 180.000000 62.760000 2
+ OG301 CG2D2O CG2DC2 HGA4 9 180.000000 12.552000 2
+ OG3R60 CG2D2O CG2DC2 CG2DC1 9 180.000000 8.368000 2
+ OG3R60 CG2D2O CG2DC2 HGA4 9 180.000000 29.288000 2
+ HGA4 CG2D2O CG2DC2 CG2DC1 9 180.000000 25.104000 2
+ HGA4 CG2D2O CG2DC2 CG2O1 9 180.000000 4.184000 2
+ HGA4 CG2D2O CG2DC2 CG321 9 180.000000 4.184000 2
+ HGA4 CG2D2O CG2DC2 HGA4 9 180.000000 10.460000 2
+ CG2D1 CG2D2O NG301 CG2D2O 9 180.000000 0.418400 2
+ CG2D1 CG2D2O NG301 CG3C51 9 180.000000 0.418400 2
+ CG2DC2 CG2D2O NG301 CG2D2O 9 180.000000 2.092000 2
+ CG2DC2 CG2D2O NG301 CG3C51 9 180.000000 0.418400 2
+ HGA4 CG2D2O NG301 CG2D2O 9 180.000000 0.418400 2
+ HGA4 CG2D2O NG301 CG3C51 9 180.000000 0.418400 2
+ CG2D1 CG2D2O NG311 CG2D2O 9 180.000000 0.418400 2
+ CG2D1 CG2D2O NG311 HGPAM1 9 180.000000 0.418400 2
+ CG2DC2 CG2D2O NG311 CG2D2O 9 180.000000 2.092000 2
+ CG2DC2 CG2D2O NG311 HGPAM1 9 180.000000 0.418400 2
+ HGA4 CG2D2O NG311 CG2D2O 9 180.000000 0.418400 2
+ HGA4 CG2D2O NG311 HGPAM1 9 180.000000 0.418400 2
+ CG2D2 CG2D2O NG321 HGPAM2 9 0.000000 7.112800 1
+ CG2D2 CG2D2O NG321 HGPAM2 9 180.000000 12.803040 2
+ CG2D2 CG2D2O NG321 HGPAM2 9 180.000000 0.962320 3
+ CG2D2 CG2D2O NG321 HGPAM2 9 0.000000 0.502080 4
+ HGA4 CG2D2O NG321 HGPAM2 9 0.000000 0.669440 3
+ CG2D2 CG2D2O OG301 CG331 9 180.000000 3.765600 1
+ CG2D2 CG2D2O OG301 CG331 9 180.000000 12.970400 2
+ CG2D2 CG2D2O OG301 CG331 9 180.000000 5.020800 3
+ CG2DC2 CG2D2O OG301 CG331 9 180.000000 3.347200 1
+ CG2DC2 CG2D2O OG301 CG331 9 180.000000 12.552000 2
+ CG2DC2 CG2D2O OG301 CG331 9 180.000000 4.602400 3
+ HGA4 CG2D2O OG301 CG331 9 180.000000 0.000000 2
+ CG2D1 CG2D2O OG3R60 CG2D1O 9 180.000000 12.552000 2
+ CG2D1 CG2D2O OG3R60 CG2D2O 9 180.000000 12.552000 2
+ CG2DC2 CG2D2O OG3R60 CG321 9 0.000000 8.368000 2
+ HGA4 CG2D2O OG3R60 CG2D1O 9 180.000000 0.000000 2
+ HGA4 CG2D2O OG3R60 CG2D2O 9 180.000000 0.000000 2
+ HGA4 CG2D2O OG3R60 CG321 9 180.000000 0.000000 2
+ CG2DC2 CG2DC1 CG2DC1 CG2DC2 9 180.000000 2.343040 1
+ CG2DC2 CG2DC1 CG2DC1 CG2DC2 9 180.000000 29.288000 2
+ CG2DC2 CG2DC1 CG2DC1 CG2O1 9 180.000000 2.343040 1
+ CG2DC2 CG2DC1 CG2DC1 CG2O1 9 180.000000 29.288000 2
+ CG2DC2 CG2DC1 CG2DC1 CG2O3 9 180.000000 2.343040 1
+ CG2DC2 CG2DC1 CG2DC1 CG2O3 9 180.000000 29.288000 2
+ CG2DC2 CG2DC1 CG2DC1 CG2O4 9 180.000000 2.343040 1
+ CG2DC2 CG2DC1 CG2DC1 CG2O4 9 180.000000 29.288000 2
+ CG2DC2 CG2DC1 CG2DC1 CG321 9 180.000000 2.343040 1
+ CG2DC2 CG2DC1 CG2DC1 CG321 9 180.000000 29.288000 2
+ CG2DC2 CG2DC1 CG2DC1 CG331 9 180.000000 2.343040 1
+ CG2DC2 CG2DC1 CG2DC1 CG331 9 180.000000 29.288000 2
+ CG2DC2 CG2DC1 CG2DC1 HGA4 9 180.000000 21.756800 2
+ CG2O1 CG2DC1 CG2DC1 CG331 9 180.000000 2.343040 1
+ CG2O1 CG2DC1 CG2DC1 CG331 9 180.000000 29.288000 2
+ CG2O3 CG2DC1 CG2DC1 CG331 9 180.000000 2.343040 1
+ CG2O3 CG2DC1 CG2DC1 CG331 9 180.000000 29.288000 2
+ CG2O4 CG2DC1 CG2DC1 CG331 9 180.000000 2.343040 1
+ CG2O4 CG2DC1 CG2DC1 CG331 9 180.000000 29.288000 2
+ CG301 CG2DC1 CG2DC1 CG321 9 180.000000 41.840000 2
+ CG301 CG2DC1 CG2DC1 CG331 9 180.000000 41.840000 2
+ CG321 CG2DC1 CG2DC1 CG331 9 180.000000 41.840000 2
+ CG321 CG2DC1 CG2DC1 HGA4 9 180.000000 21.756800 2
+ CG331 CG2DC1 CG2DC1 HGA4 9 180.000000 21.756800 2
+ HGA4 CG2DC1 CG2DC1 HGA4 9 180.000000 21.756800 2
+ CG2D1O CG2DC1 CG2DC2 CG2DC2 9 180.000000 6.276000 1
+ CG2D1O CG2DC1 CG2DC2 CG2DC2 9 180.000000 4.184000 2
+ CG2D1O CG2DC1 CG2DC2 CG2DC2 9 0.000000 6.276000 3
+ CG2D1O CG2DC1 CG2DC2 CG2DC3 9 180.000000 6.276000 1
+ CG2D1O CG2DC1 CG2DC2 CG2DC3 9 180.000000 4.184000 2
+ CG2D1O CG2DC1 CG2DC2 CG2DC3 9 0.000000 6.276000 3
+ CG2D1O CG2DC1 CG2DC2 HGA4 9 180.000000 4.184000 2
+ CG2DC1 CG2DC1 CG2DC2 CG2D2O 9 180.000000 6.276000 1
+ CG2DC1 CG2DC1 CG2DC2 CG2D2O 9 180.000000 4.184000 2
+ CG2DC1 CG2DC1 CG2DC2 CG2D2O 9 0.000000 6.276000 3
+ CG2DC1 CG2DC1 CG2DC2 CG2DC2 9 180.000000 2.092000 1
+ CG2DC1 CG2DC1 CG2DC2 CG2DC2 9 0.000000 8.368000 2
+ CG2DC1 CG2DC1 CG2DC2 CG2DC2 9 0.000000 4.184000 3
+ CG2DC1 CG2DC1 CG2DC2 CG2DC3 9 180.000000 2.092000 1
+ CG2DC1 CG2DC1 CG2DC2 CG2DC3 9 0.000000 8.368000 2
+ CG2DC1 CG2DC1 CG2DC2 CG2DC3 9 0.000000 4.184000 3
+ CG2DC1 CG2DC1 CG2DC2 CG301 9 0.000000 3.765600 1
+ CG2DC1 CG2DC1 CG2DC2 CG301 9 180.000000 8.786400 2
+ CG2DC1 CG2DC1 CG2DC2 CG301 9 0.000000 0.920480 3
+ CG2DC1 CG2DC1 CG2DC2 CG301 9 180.000000 1.046000 5
+ CG2DC1 CG2DC1 CG2DC2 CG301 9 0.000000 0.418400 6
+ CG2DC1 CG2DC1 CG2DC2 CG331 9 180.000000 4.602400 1
+ CG2DC1 CG2DC1 CG2DC2 CG331 9 180.000000 2.928800 2
+ CG2DC1 CG2DC1 CG2DC2 HGA4 9 180.000000 4.184000 2
+ CG2DC3 CG2DC1 CG2DC2 CG2D2O 9 180.000000 6.276000 1
+ CG2DC3 CG2DC1 CG2DC2 CG2D2O 9 180.000000 4.184000 2
+ CG2DC3 CG2DC1 CG2DC2 CG2D2O 9 0.000000 6.276000 3
+ CG2DC3 CG2DC1 CG2DC2 CG2DC2 9 180.000000 2.092000 1
+ CG2DC3 CG2DC1 CG2DC2 CG2DC2 9 0.000000 8.368000 2
+ CG2DC3 CG2DC1 CG2DC2 CG2DC2 9 0.000000 4.184000 3
+ CG2DC3 CG2DC1 CG2DC2 CG2DC3 9 180.000000 1.673600 1
+ CG2DC3 CG2DC1 CG2DC2 CG2DC3 9 180.000000 1.673600 2
+ CG2DC3 CG2DC1 CG2DC2 CG2DC3 9 0.000000 5.439200 3
+ CG2DC3 CG2DC1 CG2DC2 CG301 9 0.000000 3.765600 1
+ CG2DC3 CG2DC1 CG2DC2 CG301 9 180.000000 8.786400 2
+ CG2DC3 CG2DC1 CG2DC2 CG301 9 0.000000 0.920480 3
+ CG2DC3 CG2DC1 CG2DC2 CG301 9 180.000000 1.046000 5
+ CG2DC3 CG2DC1 CG2DC2 CG301 9 0.000000 0.418400 6
+ CG2DC3 CG2DC1 CG2DC2 CG331 9 180.000000 4.602400 1
+ CG2DC3 CG2DC1 CG2DC2 CG331 9 180.000000 2.928800 2
+ CG2DC3 CG2DC1 CG2DC2 NG2P1 9 0.000000 2.092000 1
+ CG2DC3 CG2DC1 CG2DC2 NG2P1 9 180.000000 9.204800 2
+ CG2DC3 CG2DC1 CG2DC2 NG2P1 9 0.000000 4.602400 3
+ CG2DC3 CG2DC1 CG2DC2 NG2P1 9 0.000000 2.510400 4
+ CG2DC3 CG2DC1 CG2DC2 HGA4 9 180.000000 4.184000 2
+ CG2DC3 CG2DC1 CG2DC2 HGR52 9 180.000000 4.184000 2
+ CG301 CG2DC1 CG2DC2 CG2DC2 9 0.000000 3.765600 1
+ CG301 CG2DC1 CG2DC2 CG2DC2 9 180.000000 8.786400 2
+ CG301 CG2DC1 CG2DC2 CG2DC2 9 0.000000 0.920480 3
+ CG301 CG2DC1 CG2DC2 CG2DC2 9 180.000000 1.046000 5
+ CG301 CG2DC1 CG2DC2 CG2DC2 9 0.000000 0.418400 6
+ CG301 CG2DC1 CG2DC2 CG2DC3 9 0.000000 3.765600 1
+ CG301 CG2DC1 CG2DC2 CG2DC3 9 180.000000 8.786400 2
+ CG301 CG2DC1 CG2DC2 CG2DC3 9 0.000000 0.920480 3
+ CG301 CG2DC1 CG2DC2 CG2DC3 9 180.000000 1.046000 5
+ CG301 CG2DC1 CG2DC2 CG2DC3 9 0.000000 0.418400 6
+ CG301 CG2DC1 CG2DC2 HGA4 9 180.000000 4.184000 2
+ CG331 CG2DC1 CG2DC2 CG2DC2 9 180.000000 4.602400 1
+ CG331 CG2DC1 CG2DC2 CG2DC2 9 180.000000 2.928800 2
+ CG331 CG2DC1 CG2DC2 CG2DC3 9 180.000000 4.602400 1
+ CG331 CG2DC1 CG2DC2 CG2DC3 9 180.000000 2.928800 2
+ CG331 CG2DC1 CG2DC2 HGA4 9 180.000000 4.184000 2
+ NG2P1 CG2DC1 CG2DC2 CG2DC3 9 0.000000 2.092000 1
+ NG2P1 CG2DC1 CG2DC2 CG2DC3 9 180.000000 9.204800 2
+ NG2P1 CG2DC1 CG2DC2 CG2DC3 9 0.000000 4.602400 3
+ NG2P1 CG2DC1 CG2DC2 CG2DC3 9 0.000000 2.510400 4
+ NG2P1 CG2DC1 CG2DC2 HGA4 9 180.000000 4.184000 2
+ HGA4 CG2DC1 CG2DC2 CG2D2O 9 180.000000 4.184000 2
+ HGA4 CG2DC1 CG2DC2 CG2DC2 9 180.000000 4.184000 2
+ HGA4 CG2DC1 CG2DC2 CG2DC3 9 180.000000 4.184000 2
+ HGA4 CG2DC1 CG2DC2 CG301 9 180.000000 4.184000 2
+ HGA4 CG2DC1 CG2DC2 CG331 9 180.000000 4.184000 2
+ HGA4 CG2DC1 CG2DC2 NG2P1 9 180.000000 4.184000 2
+ HGA4 CG2DC1 CG2DC2 HGA4 9 180.000000 0.000000 2
+ HGA4 CG2DC1 CG2DC2 HGR52 9 180.000000 0.000000 2
+ HGR52 CG2DC1 CG2DC2 CG2DC3 9 180.000000 4.184000 2
+ HGR52 CG2DC1 CG2DC2 HGA4 9 180.000000 0.000000 2
+ CG2DC2 CG2DC1 CG2DC3 HGA5 9 180.000000 20.920000 2
+ CG2O3 CG2DC1 CG2DC3 HGA5 9 180.000000 17.572800 2
+ CG2O4 CG2DC1 CG2DC3 HGA5 9 180.000000 13.388800 2
+ CG2O5 CG2DC1 CG2DC3 HGA5 9 180.000000 13.388800 2
+ CG2R61 CG2DC1 CG2DC3 HGA5 9 180.000000 14.644000 2
+ CG331 CG2DC1 CG2DC3 HGA5 9 180.000000 21.756800 2
+ HGA4 CG2DC1 CG2DC3 HGA5 9 180.000000 21.756800 2
+ CG2D1O CG2DC1 CG2O1 NG2S2 9 180.000000 4.602400 1
+ CG2D1O CG2DC1 CG2O1 NG2S2 9 180.000000 8.158800 2
+ CG2D1O CG2DC1 CG2O1 OG2D1 9 0.000000 1.255200 1
+ CG2D1O CG2DC1 CG2O1 OG2D1 9 180.000000 8.158800 2
+ CG2DC1 CG2DC1 CG2O1 NG2S1 9 0.000000 2.928800 1
+ CG2DC1 CG2DC1 CG2O1 NG2S1 9 180.000000 5.020800 2
+ CG2DC1 CG2DC1 CG2O1 NG2S1 9 0.000000 0.418400 3
+ CG2DC1 CG2DC1 CG2O1 NG2S1 9 0.000000 0.627600 4
+ CG2DC1 CG2DC1 CG2O1 OG2D1 9 180.000000 2.928800 1
+ CG2DC1 CG2DC1 CG2O1 OG2D1 9 180.000000 5.020800 2
+ CG2DC1 CG2DC1 CG2O1 OG2D1 9 180.000000 0.418400 3
+ CG2DC1 CG2DC1 CG2O1 OG2D1 9 0.000000 0.836800 4
+ CG321 CG2DC1 CG2O1 NG2S2 9 180.000000 2.092000 2
+ CG321 CG2DC1 CG2O1 NG2S2 9 180.000000 1.464400 3
+ CG321 CG2DC1 CG2O1 NG2S2 9 0.000000 1.673600 6
+ CG321 CG2DC1 CG2O1 OG2D1 9 180.000000 4.184000 2
+ CG321 CG2DC1 CG2O1 OG2D1 9 0.000000 4.184000 3
+ CG321 CG2DC1 CG2O1 OG2D1 9 0.000000 1.673600 6
+ HGA4 CG2DC1 CG2O1 NG2S1 9 180.000000 1.255200 3
+ HGA4 CG2DC1 CG2O1 OG2D1 9 180.000000 1.255200 3
+ CG2DC1 CG2DC1 CG2O3 OG2D2 9 180.000000 5.439200 2
+ CG2DC3 CG2DC1 CG2O3 OG2D2 9 180.000000 5.439200 2
+ HGA4 CG2DC1 CG2O3 OG2D2 9 180.000000 0.000000 2
+ CG2DC1 CG2DC1 CG2O4 OG2D1 9 180.000000 4.184000 2
+ CG2DC1 CG2DC1 CG2O4 HGR52 9 180.000000 13.388800 2
+ CG2DC3 CG2DC1 CG2O4 OG2D1 9 180.000000 4.184000 2
+ CG2DC3 CG2DC1 CG2O4 HGR52 9 180.000000 13.388800 2
+ HGA4 CG2DC1 CG2O4 OG2D1 9 180.000000 0.000000 2
+ HGA4 CG2DC1 CG2O4 HGR52 9 180.000000 0.000000 2
+ CG2DC3 CG2DC1 CG2O5 CG331 9 180.000000 5.857600 2
+ CG2DC3 CG2DC1 CG2O5 OG2D3 9 180.000000 5.857600 2
+ HGA4 CG2DC1 CG2O5 CG331 9 180.000000 0.000000 2
+ HGA4 CG2DC1 CG2O5 OG2D3 9 180.000000 0.000000 2
+ CG2DC3 CG2DC1 CG2R61 CG2R61 9 180.000000 3.138000 2
+ CG2DC3 CG2DC1 CG2R61 CG2R61 9 0.000000 0.794960 4
+ NG2D1 CG2DC1 CG2R61 CG2R61 9 180.000000 6.694400 2
+ HGA4 CG2DC1 CG2R61 CG2R61 9 180.000000 2.510400 2
+ CG2DC1 CG2DC1 CG301 CG321 9 0.000000 2.092000 2
+ CG2DC1 CG2DC1 CG301 CG321 9 0.000000 1.255200 3
+ CG2DC1 CG2DC1 CG301 CG331 9 0.000000 2.092000 2
+ CG2DC1 CG2DC1 CG301 CG331 9 0.000000 1.673600 3
+ CG2DC2 CG2DC1 CG301 CG321 9 0.000000 1.255200 3
+ CG2DC2 CG2DC1 CG301 CG331 9 0.000000 1.255200 3
+ CG2D1O CG2DC1 CG321 CG2D1 9 180.000000 0.000000 3
+ CG2D1O CG2DC1 CG321 HGA2 9 180.000000 0.000000 3
+ CG2DC1 CG2DC1 CG321 CG321 9 0.000000 2.092000 2
+ CG2DC1 CG2DC1 CG321 CG321 9 0.000000 1.255200 3
+ CG2DC1 CG2DC1 CG321 OG311 9 180.000000 7.949600 1
+ CG2DC1 CG2DC1 CG321 OG311 9 180.000000 1.673600 2
+ CG2DC1 CG2DC1 CG321 OG311 9 180.000000 2.510400 3
+ CG2DC1 CG2DC1 CG321 OG3R60 9 0.000000 2.928800 3
+ CG2DC1 CG2DC1 CG321 HGA2 9 0.000000 0.125520 3
+ CG2O1 CG2DC1 CG321 CG2D1 9 0.000000 0.000000 3
+ CG2O1 CG2DC1 CG321 HGA2 9 0.000000 0.000000 3
+ CG331 CG2DC1 CG321 CG321 9 0.000000 0.794960 3
+ CG331 CG2DC1 CG321 HGA2 9 0.000000 0.794960 3
+ HGA4 CG2DC1 CG321 OG311 9 0.000000 0.836800 3
+ HGA4 CG2DC1 CG321 OG3R60 9 0.000000 0.836800 3
+ HGA4 CG2DC1 CG321 HGA2 9 0.000000 0.836800 3
+ CG2DC1 CG2DC1 CG331 HGA3 9 180.000000 1.255200 3
+ CG2DC2 CG2DC1 CG331 HGA3 9 180.000000 1.255200 3
+ CG2DC3 CG2DC1 CG331 HGA3 9 0.000000 1.255200 3
+ CG321 CG2DC1 CG331 HGA3 9 0.000000 0.669440 3
+ CG331 CG2DC1 CG331 HGA3 9 0.000000 1.255200 3
+ HGA4 CG2DC1 CG331 HGA3 9 0.000000 0.000000 3
+ CG2R61 CG2DC1 NG2D1 NG2S1 9 180.000000 50.208000 2
+ HGA4 CG2DC1 NG2D1 NG2S1 9 180.000000 16.736000 2
+ CG2DC2 CG2DC1 NG2P1 CG334 9 180.000000 29.288000 2
+ CG2DC2 CG2DC1 NG2P1 HGP2 9 180.000000 20.920000 2
+ HGR52 CG2DC1 NG2P1 CG334 9 180.000000 35.564000 2
+ HGR52 CG2DC1 NG2P1 HGP2 9 180.000000 20.920000 2
+ CG2DC1 CG2DC2 CG2DC2 CG2DC1 9 180.000000 2.343040 1
+ CG2DC1 CG2DC2 CG2DC2 CG2DC1 9 180.000000 29.288000 2
+ CG2DC1 CG2DC2 CG2DC2 CG2O1 9 180.000000 2.343040 1
+ CG2DC1 CG2DC2 CG2DC2 CG2O1 9 180.000000 29.288000 2
+ CG2DC1 CG2DC2 CG2DC2 CG2O3 9 180.000000 2.343040 1
+ CG2DC1 CG2DC2 CG2DC2 CG2O3 9 180.000000 29.288000 2
+ CG2DC1 CG2DC2 CG2DC2 CG2O4 9 180.000000 2.343040 1
+ CG2DC1 CG2DC2 CG2DC2 CG2O4 9 180.000000 29.288000 2
+ CG2DC1 CG2DC2 CG2DC2 CG321 9 180.000000 2.343040 1
+ CG2DC1 CG2DC2 CG2DC2 CG321 9 180.000000 29.288000 2
+ CG2DC1 CG2DC2 CG2DC2 CG331 9 180.000000 2.343040 1
+ CG2DC1 CG2DC2 CG2DC2 CG331 9 180.000000 29.288000 2
+ CG2DC1 CG2DC2 CG2DC2 HGA4 9 180.000000 21.756800 2
+ CG2O1 CG2DC2 CG2DC2 CG331 9 180.000000 2.343040 1
+ CG2O1 CG2DC2 CG2DC2 CG331 9 180.000000 29.288000 2
+ CG2O3 CG2DC2 CG2DC2 CG331 9 180.000000 2.343040 1
+ CG2O3 CG2DC2 CG2DC2 CG331 9 180.000000 29.288000 2
+ CG2O4 CG2DC2 CG2DC2 CG331 9 180.000000 2.343040 1
+ CG2O4 CG2DC2 CG2DC2 CG331 9 180.000000 29.288000 2
+ CG301 CG2DC2 CG2DC2 CG321 9 180.000000 41.840000 2
+ CG301 CG2DC2 CG2DC2 CG331 9 180.000000 41.840000 2
+ CG321 CG2DC2 CG2DC2 CG331 9 180.000000 41.840000 2
+ CG321 CG2DC2 CG2DC2 HGA4 9 180.000000 21.756800 2
+ CG331 CG2DC2 CG2DC2 HGA4 9 180.000000 21.756800 2
+ HGA4 CG2DC2 CG2DC2 HGA4 9 180.000000 21.756800 2
+ CG2DC1 CG2DC2 CG2DC3 HGA5 9 180.000000 20.920000 2
+ CG2O3 CG2DC2 CG2DC3 HGA5 9 180.000000 17.572800 2
+ CG2O4 CG2DC2 CG2DC3 HGA5 9 180.000000 13.388800 2
+ CG2O5 CG2DC2 CG2DC3 HGA5 9 180.000000 13.388800 2
+ CG2R61 CG2DC2 CG2DC3 HGA5 9 180.000000 14.644000 2
+ CG331 CG2DC2 CG2DC3 HGA5 9 180.000000 21.756800 2
+ HGA4 CG2DC2 CG2DC3 HGA5 9 180.000000 21.756800 2
+ CG2D2O CG2DC2 CG2O1 NG2S2 9 180.000000 4.602400 1
+ CG2D2O CG2DC2 CG2O1 NG2S2 9 180.000000 8.158800 2
+ CG2D2O CG2DC2 CG2O1 OG2D1 9 0.000000 1.255200 1
+ CG2D2O CG2DC2 CG2O1 OG2D1 9 180.000000 8.158800 2
+ CG2DC2 CG2DC2 CG2O1 NG2S1 9 0.000000 2.928800 1
+ CG2DC2 CG2DC2 CG2O1 NG2S1 9 180.000000 5.020800 2
+ CG2DC2 CG2DC2 CG2O1 NG2S1 9 0.000000 0.418400 3
+ CG2DC2 CG2DC2 CG2O1 NG2S1 9 0.000000 0.627600 4
+ CG2DC2 CG2DC2 CG2O1 OG2D1 9 180.000000 2.928800 1
+ CG2DC2 CG2DC2 CG2O1 OG2D1 9 180.000000 5.020800 2
+ CG2DC2 CG2DC2 CG2O1 OG2D1 9 180.000000 0.418400 3
+ CG2DC2 CG2DC2 CG2O1 OG2D1 9 0.000000 0.836800 4
+ CG321 CG2DC2 CG2O1 NG2S2 9 180.000000 2.092000 2
+ CG321 CG2DC2 CG2O1 NG2S2 9 180.000000 1.464400 3
+ CG321 CG2DC2 CG2O1 NG2S2 9 0.000000 1.673600 6
+ CG321 CG2DC2 CG2O1 OG2D1 9 180.000000 4.184000 2
+ CG321 CG2DC2 CG2O1 OG2D1 9 0.000000 4.184000 3
+ CG321 CG2DC2 CG2O1 OG2D1 9 0.000000 1.673600 6
+ HGA4 CG2DC2 CG2O1 NG2S1 9 180.000000 1.255200 3
+ HGA4 CG2DC2 CG2O1 OG2D1 9 180.000000 1.255200 3
+ CG2DC2 CG2DC2 CG2O3 OG2D2 9 180.000000 5.439200 2
+ CG2DC3 CG2DC2 CG2O3 OG2D2 9 180.000000 5.439200 2
+ HGA4 CG2DC2 CG2O3 OG2D2 9 180.000000 0.000000 2
+ CG2DC2 CG2DC2 CG2O4 OG2D1 9 180.000000 4.184000 2
+ CG2DC2 CG2DC2 CG2O4 HGR52 9 180.000000 13.388800 2
+ CG2DC3 CG2DC2 CG2O4 OG2D1 9 180.000000 4.184000 2
+ CG2DC3 CG2DC2 CG2O4 HGR52 9 180.000000 13.388800 2
+ HGA4 CG2DC2 CG2O4 OG2D1 9 180.000000 0.000000 2
+ HGA4 CG2DC2 CG2O4 HGR52 9 180.000000 0.000000 2
+ CG2DC3 CG2DC2 CG2O5 CG331 9 180.000000 5.857600 2
+ CG2DC3 CG2DC2 CG2O5 OG2D3 9 180.000000 5.857600 2
+ HGA4 CG2DC2 CG2O5 CG331 9 180.000000 0.000000 2
+ HGA4 CG2DC2 CG2O5 OG2D3 9 180.000000 0.000000 2
+ CG2DC3 CG2DC2 CG2R61 CG2R61 9 180.000000 3.138000 2
+ CG2DC3 CG2DC2 CG2R61 CG2R61 9 0.000000 0.794960 4
+ NG2D1 CG2DC2 CG2R61 CG2R61 9 180.000000 6.694400 2
+ HGA4 CG2DC2 CG2R61 CG2R61 9 180.000000 2.510400 2
+ CG2DC1 CG2DC2 CG301 CG321 9 0.000000 1.255200 3
+ CG2DC1 CG2DC2 CG301 CG331 9 0.000000 1.255200 3
+ CG2DC2 CG2DC2 CG301 CG321 9 0.000000 2.092000 2
+ CG2DC2 CG2DC2 CG301 CG321 9 0.000000 1.255200 3
+ CG2DC2 CG2DC2 CG301 CG331 9 0.000000 2.092000 2
+ CG2DC2 CG2DC2 CG301 CG331 9 0.000000 1.673600 3
+ CG2D2O CG2DC2 CG321 CG2D1 9 180.000000 0.000000 3
+ CG2D2O CG2DC2 CG321 HGA2 9 180.000000 0.000000 3
+ CG2DC2 CG2DC2 CG321 CG321 9 0.000000 2.092000 2
+ CG2DC2 CG2DC2 CG321 CG321 9 0.000000 1.255200 3
+ CG2DC2 CG2DC2 CG321 OG311 9 180.000000 7.949600 1
+ CG2DC2 CG2DC2 CG321 OG311 9 180.000000 1.673600 2
+ CG2DC2 CG2DC2 CG321 OG311 9 180.000000 2.510400 3
+ CG2DC2 CG2DC2 CG321 OG3R60 9 0.000000 2.928800 3
+ CG2DC2 CG2DC2 CG321 HGA2 9 0.000000 0.125520 3
+ CG2O1 CG2DC2 CG321 CG2D1 9 0.000000 0.000000 3
+ CG2O1 CG2DC2 CG321 HGA2 9 0.000000 0.000000 3
+ CG331 CG2DC2 CG321 CG321 9 0.000000 0.794960 3
+ CG331 CG2DC2 CG321 HGA2 9 0.000000 0.794960 3
+ HGA4 CG2DC2 CG321 OG311 9 0.000000 0.836800 3
+ HGA4 CG2DC2 CG321 OG3R60 9 0.000000 0.836800 3
+ HGA4 CG2DC2 CG321 HGA2 9 0.000000 0.836800 3
+ CG2DC1 CG2DC2 CG331 HGA3 9 180.000000 1.255200 3
+ CG2DC2 CG2DC2 CG331 HGA3 9 180.000000 1.255200 3
+ CG2DC3 CG2DC2 CG331 HGA3 9 0.000000 1.255200 3
+ CG321 CG2DC2 CG331 HGA3 9 0.000000 0.669440 3
+ CG331 CG2DC2 CG331 HGA3 9 0.000000 1.255200 3
+ HGA4 CG2DC2 CG331 HGA3 9 0.000000 0.000000 3
+ CG2R61 CG2DC2 NG2D1 NG2S1 9 180.000000 50.208000 2
+ HGA4 CG2DC2 NG2D1 NG2S1 9 180.000000 16.736000 2
+ CG2DC1 CG2DC2 NG2P1 CG334 9 180.000000 29.288000 2
+ CG2DC1 CG2DC2 NG2P1 HGP2 9 180.000000 20.920000 2
+ HGR52 CG2DC2 NG2P1 CG334 9 180.000000 35.564000 2
+ HGR52 CG2DC2 NG2P1 HGP2 9 180.000000 20.920000 2
+ NG311 CG2N1 NG2D1 HGP1 9 180.000000 21.756800 2
+ NG321 CG2N1 NG2D1 CG331 9 180.000000 27.196000 2
+ NG321 CG2N1 NG2D1 HGP1 9 180.000000 21.756800 2
+ NG2P1 CG2N1 NG2P1 CG324 9 180.000000 9.414000 2
+ NG2P1 CG2N1 NG2P1 CG334 9 180.000000 9.414000 2
+ NG2P1 CG2N1 NG2P1 HGP2 9 180.000000 9.414000 2
+ NG2D1 CG2N1 NG311 CG331 9 180.000000 2.092000 2
+ NG2D1 CG2N1 NG311 HGPAM1 9 180.000000 11.715200 2
+ NG321 CG2N1 NG311 CG331 9 180.000000 2.092000 2
+ NG321 CG2N1 NG311 HGPAM1 9 180.000000 11.715200 2
+ NG2D1 CG2N1 NG321 HGPAM2 9 180.000000 0.836800 2
+ NG2D1 CG2N1 NG321 HGPAM2 9 0.000000 0.627600 6
+ NG311 CG2N1 NG321 HGPAM2 9 180.000000 0.836800 2
+ NG311 CG2N1 NG321 HGPAM2 9 0.000000 0.627600 6
+ NG321 CG2N1 NG321 HGPAM2 9 180.000000 0.836800 2
+ NG321 CG2N1 NG321 HGPAM2 9 0.000000 0.627600 6
+ NG2P1 CG2N2 CG2R61 CG2R61 9 180.000000 3.430880 2
+ NG2P1 CG2N2 CG2R61 CG2R61 9 0.000000 1.213360 4
+ NG2P1 CG2N2 CG2R61 CG2R61 9 0.000000 0.376560 6
+ NG2P1 CG2N2 CG331 HGA3 9 0.000000 1.046000 3
+ CG2R61 CG2N2 NG2P1 HGP2 9 180.000000 8.368000 2
+ CG331 CG2N2 NG2P1 HGP2 9 180.000000 14.644000 2
+ NG2P1 CG2N2 NG2P1 HGP2 9 180.000000 14.644000 2
+ NG2S1 CG2O1 CG2R61 CG2R61 9 180.000000 4.184000 2
+ NG2S1 CG2O1 CG2R61 CG2RC0 9 180.000000 4.184000 2
+ NG2S2 CG2O1 CG2R61 CG2R61 9 180.000000 4.184000 2
+ OG2D1 CG2O1 CG2R61 CG2R61 9 180.000000 4.184000 2
+ OG2D1 CG2O1 CG2R61 CG2RC0 9 180.000000 4.184000 2
+ NG2S2 CG2O1 CG2R62 CG2R62 9 180.000000 1.464400 1
+ NG2S2 CG2O1 CG2R62 CG2R62 9 0.000000 2.594080 2
+ OG2D1 CG2O1 CG2R62 CG2R62 9 180.000000 9.957920 2
+ NG2S0 CG2O1 CG311 CG311 9 0.000000 0.000000 1
+ NG2S0 CG2O1 CG311 CG321 9 0.000000 0.000000 1
+ NG2S0 CG2O1 CG311 CG323 9 0.000000 0.000000 1
+ NG2S0 CG2O1 CG311 CG331 9 0.000000 0.000000 1
+ NG2S0 CG2O1 CG311 NG2S1 9 0.000000 1.673600 1
+ NG2S0 CG2O1 CG311 HGA1 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG311 CG311 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG311 CG321 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG311 CG323 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG311 CG331 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG311 NG2S1 9 0.000000 2.510400 1
+ NG2S1 CG2O1 CG311 HGA1 9 0.000000 0.000000 1
+ NG2S2 CG2O1 CG311 CG311 9 0.000000 0.000000 1
+ NG2S2 CG2O1 CG311 CG321 9 0.000000 0.000000 1
+ NG2S2 CG2O1 CG311 CG323 9 0.000000 0.000000 1
+ NG2S2 CG2O1 CG311 CG331 9 0.000000 0.000000 1
+ NG2S2 CG2O1 CG311 NG2S1 9 0.000000 2.510400 1
+ NG2S2 CG2O1 CG311 HGA1 9 0.000000 0.000000 1
+ OG2D1 CG2O1 CG311 CG311 9 0.000000 5.857600 1
+ OG2D1 CG2O1 CG311 CG321 9 0.000000 5.857600 1
+ OG2D1 CG2O1 CG311 CG323 9 0.000000 5.857600 1
+ OG2D1 CG2O1 CG311 CG331 9 0.000000 5.857600 1
+ OG2D1 CG2O1 CG311 NG2S1 9 0.000000 0.000000 1
+ OG2D1 CG2O1 CG311 HGA1 9 0.000000 0.000000 1
+ NG2S0 CG2O1 CG314 CG311 9 0.000000 0.000000 1
+ NG2S0 CG2O1 CG314 CG321 9 0.000000 0.000000 1
+ NG2S0 CG2O1 CG314 CG323 9 0.000000 0.000000 1
+ NG2S0 CG2O1 CG314 CG331 9 0.000000 0.000000 1
+ NG2S0 CG2O1 CG314 NG3P3 9 0.000000 1.673600 1
+ NG2S0 CG2O1 CG314 HGA1 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG314 CG311 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG314 CG321 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG314 CG323 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG314 CG331 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG314 NG3P3 9 0.000000 2.510400 1
+ NG2S1 CG2O1 CG314 HGA1 9 0.000000 0.000000 1
+ NG2S2 CG2O1 CG314 CG311 9 0.000000 0.000000 1
+ NG2S2 CG2O1 CG314 CG321 9 0.000000 0.000000 1
+ NG2S2 CG2O1 CG314 CG323 9 0.000000 0.000000 1
+ NG2S2 CG2O1 CG314 CG331 9 0.000000 0.000000 1
+ NG2S2 CG2O1 CG314 NG3P3 9 0.000000 2.510400 1
+ NG2S2 CG2O1 CG314 HGA1 9 0.000000 0.000000 1
+ OG2D1 CG2O1 CG314 CG311 9 0.000000 5.857600 1
+ OG2D1 CG2O1 CG314 CG321 9 0.000000 5.857600 1
+ OG2D1 CG2O1 CG314 CG323 9 0.000000 5.857600 1
+ OG2D1 CG2O1 CG314 CG331 9 0.000000 5.857600 1
+ OG2D1 CG2O1 CG314 NG3P3 9 0.000000 0.000000 1
+ OG2D1 CG2O1 CG314 HGA1 9 0.000000 0.000000 1
+ NG2S0 CG2O1 CG321 CG331 9 0.000000 6.276000 1
+ NG2S0 CG2O1 CG321 NG2S1 9 0.000000 1.673600 1
+ NG2S0 CG2O1 CG321 HGA2 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG321 CG321 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG321 NG2S1 9 0.000000 2.510400 1
+ NG2S1 CG2O1 CG321 HGA1 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG321 HGA2 9 0.000000 0.000000 3
+ NG2S2 CG2O1 CG321 CG311 9 180.000000 0.209200 6
+ NG2S2 CG2O1 CG321 CG314 9 180.000000 0.209200 6
+ NG2S2 CG2O1 CG321 CG321 9 180.000000 0.209200 6
+ NG2S2 CG2O1 CG321 CG331 9 180.000000 0.209200 6
+ NG2S2 CG2O1 CG321 NG2S1 9 0.000000 2.510400 1
+ NG2S2 CG2O1 CG321 HGA2 9 180.000000 0.000000 3
+ OG2D1 CG2O1 CG321 CG311 9 180.000000 0.209200 6
+ OG2D1 CG2O1 CG321 CG314 9 180.000000 0.209200 6
+ OG2D1 CG2O1 CG321 CG321 9 180.000000 0.209200 6
+ OG2D1 CG2O1 CG321 CG331 9 180.000000 0.209200 6
+ OG2D1 CG2O1 CG321 NG2S1 9 0.000000 0.000000 1
+ OG2D1 CG2O1 CG321 HGA2 9 180.000000 0.000000 3
+ NG2S0 CG2O1 CG324 NG3P3 9 0.000000 1.673600 1
+ NG2S0 CG2O1 CG324 HGA2 9 0.000000 0.000000 1
+ NG2S1 CG2O1 CG324 NG3P3 9 0.000000 1.673600 1
+ NG2S1 CG2O1 CG324 HGA2 9 0.000000 0.000000 3
+ NG2S2 CG2O1 CG324 NG3P3 9 0.000000 1.673600 1
+ NG2S2 CG2O1 CG324 HGA2 9 180.000000 0.000000 3
+ OG2D1 CG2O1 CG324 NG3P3 9 0.000000 0.000000 1
+ OG2D1 CG2O1 CG324 HGA2 9 180.000000 0.000000 3
+ NG2S0 CG2O1 CG331 HGA3 9 0.000000 0.000000 3
+ NG2S1 CG2O1 CG331 HGA3 9 0.000000 0.000000 3
+ NG2S2 CG2O1 CG331 HGA3 9 0.000000 0.000000 3
+ OG2D1 CG2O1 CG331 HGA3 9 180.000000 0.000000 3
+ NG2S0 CG2O1 CG3C51 CG3C52 9 0.000000 1.673600 1
+ NG2S0 CG2O1 CG3C51 CG3C52 9 0.000000 2.510400 2
+ NG2S0 CG2O1 CG3C51 NG2S0 9 0.000000 1.255200 1
+ NG2S0 CG2O1 CG3C51 NG2S0 9 0.000000 -1.255200 4
+ NG2S0 CG2O1 CG3C51 HGA1 9 180.000000 1.673600 1
+ NG2S0 CG2O1 CG3C51 HGA1 9 0.000000 2.510400 2
+ NG2S1 CG2O1 CG3C51 CG3C52 9 0.000000 1.673600 1
+ NG2S1 CG2O1 CG3C51 CG3C52 9 0.000000 2.510400 2
+ NG2S1 CG2O1 CG3C51 NG2S0 9 0.000000 1.255200 1
+ NG2S1 CG2O1 CG3C51 NG2S0 9 0.000000 -1.255200 4
+ NG2S1 CG2O1 CG3C51 HGA1 9 180.000000 1.673600 1
+ NG2S1 CG2O1 CG3C51 HGA1 9 0.000000 2.510400 2
+ NG2S2 CG2O1 CG3C51 CG3C52 9 0.000000 1.673600 1
+ NG2S2 CG2O1 CG3C51 CG3C52 9 0.000000 2.510400 2
+ NG2S2 CG2O1 CG3C51 NG2S0 9 0.000000 1.255200 1
+ NG2S2 CG2O1 CG3C51 NG2S0 9 0.000000 -1.255200 4
+ NG2S2 CG2O1 CG3C51 HGA1 9 180.000000 1.673600 1
+ NG2S2 CG2O1 CG3C51 HGA1 9 0.000000 2.510400 2
+ OG2D1 CG2O1 CG3C51 CG3C52 9 180.000000 1.673600 1
+ OG2D1 CG2O1 CG3C51 CG3C52 9 0.000000 2.510400 2
+ OG2D1 CG2O1 CG3C51 NG2S0 9 0.000000 -1.255200 4
+ OG2D1 CG2O1 CG3C51 HGA1 9 0.000000 1.673600 1
+ OG2D1 CG2O1 CG3C51 HGA1 9 0.000000 2.510400 2
+ NG2S0 CG2O1 CG3C53 CG3C52 9 0.000000 1.673600 1
+ NG2S0 CG2O1 CG3C53 CG3C52 9 0.000000 2.510400 2
+ NG2S0 CG2O1 CG3C53 NG3P2 9 0.000000 1.255200 1
+ NG2S0 CG2O1 CG3C53 HGA1 9 180.000000 1.673600 1
+ NG2S0 CG2O1 CG3C53 HGA1 9 0.000000 2.510400 2
+ NG2S1 CG2O1 CG3C53 CG3C52 9 0.000000 1.673600 1
+ NG2S1 CG2O1 CG3C53 CG3C52 9 0.000000 2.510400 2
+ NG2S1 CG2O1 CG3C53 NG3P2 9 0.000000 1.255200 1
+ NG2S1 CG2O1 CG3C53 HGA1 9 180.000000 1.673600 1
+ NG2S1 CG2O1 CG3C53 HGA1 9 0.000000 2.510400 2
+ NG2S2 CG2O1 CG3C53 CG3C52 9 0.000000 1.673600 1
+ NG2S2 CG2O1 CG3C53 CG3C52 9 0.000000 2.510400 2
+ NG2S2 CG2O1 CG3C53 NG3P2 9 0.000000 1.255200 1
+ NG2S2 CG2O1 CG3C53 HGA1 9 180.000000 1.673600 1
+ NG2S2 CG2O1 CG3C53 HGA1 9 0.000000 2.510400 2
+ OG2D1 CG2O1 CG3C53 CG3C52 9 180.000000 1.673600 1
+ OG2D1 CG2O1 CG3C53 CG3C52 9 0.000000 2.510400 2
+ OG2D1 CG2O1 CG3C53 NG3P2 9 0.000000 0.585760 3
+ OG2D1 CG2O1 CG3C53 HGA1 9 0.000000 1.673600 1
+ OG2D1 CG2O1 CG3C53 HGA1 9 0.000000 2.510400 2
+ CG311 CG2O1 NG2S0 CG3C51 9 180.000000 11.506000 2
+ CG311 CG2O1 NG2S0 CG3C51 9 0.000000 1.255200 4
+ CG311 CG2O1 NG2S0 CG3C52 9 180.000000 11.506000 2
+ CG311 CG2O1 NG2S0 CG3C52 9 0.000000 1.255200 4
+ CG314 CG2O1 NG2S0 CG3C51 9 180.000000 11.506000 2
+ CG314 CG2O1 NG2S0 CG3C51 9 0.000000 1.255200 4
+ CG314 CG2O1 NG2S0 CG3C52 9 180.000000 11.506000 2
+ CG314 CG2O1 NG2S0 CG3C52 9 0.000000 1.255200 4
+ CG321 CG2O1 NG2S0 CG331 9 180.000000 10.878400 2
+ CG321 CG2O1 NG2S0 CG3C51 9 180.000000 11.506000 2
+ CG321 CG2O1 NG2S0 CG3C51 9 0.000000 1.255200 4
+ CG321 CG2O1 NG2S0 CG3C52 9 180.000000 11.506000 2
+ CG321 CG2O1 NG2S0 CG3C52 9 0.000000 1.255200 4
+ CG324 CG2O1 NG2S0 CG3C51 9 180.000000 11.506000 2
+ CG324 CG2O1 NG2S0 CG3C51 9 0.000000 1.255200 4
+ CG324 CG2O1 NG2S0 CG3C52 9 180.000000 11.506000 2
+ CG324 CG2O1 NG2S0 CG3C52 9 0.000000 1.255200 4
+ CG331 CG2O1 NG2S0 CG331 9 180.000000 10.878400 2
+ CG331 CG2O1 NG2S0 CG3C51 9 180.000000 11.506000 2
+ CG331 CG2O1 NG2S0 CG3C51 9 0.000000 1.255200 4
+ CG331 CG2O1 NG2S0 CG3C52 9 180.000000 11.506000 2
+ CG331 CG2O1 NG2S0 CG3C52 9 0.000000 1.255200 4
+ CG3C51 CG2O1 NG2S0 CG3C51 9 180.000000 11.506000 2
+ CG3C51 CG2O1 NG2S0 CG3C51 9 0.000000 1.255200 4
+ CG3C51 CG2O1 NG2S0 CG3C52 9 180.000000 11.506000 2
+ CG3C51 CG2O1 NG2S0 CG3C52 9 0.000000 1.255200 4
+ CG3C53 CG2O1 NG2S0 CG3C51 9 180.000000 11.506000 2
+ CG3C53 CG2O1 NG2S0 CG3C51 9 0.000000 1.255200 4
+ CG3C53 CG2O1 NG2S0 CG3C52 9 180.000000 11.506000 2
+ CG3C53 CG2O1 NG2S0 CG3C52 9 0.000000 1.255200 4
+ OG2D1 CG2O1 NG2S0 CG331 9 180.000000 10.878400 2
+ OG2D1 CG2O1 NG2S0 CG3C51 9 180.000000 11.506000 2
+ OG2D1 CG2O1 NG2S0 CG3C51 9 0.000000 1.255200 4
+ OG2D1 CG2O1 NG2S0 CG3C52 9 180.000000 11.506000 2
+ OG2D1 CG2O1 NG2S0 CG3C52 9 0.000000 1.255200 4
+ HGR52 CG2O1 NG2S0 CG331 9 180.000000 10.878400 2
+ CG2DC1 CG2O1 NG2S1 CG2R61 9 0.000000 6.694400 1
+ CG2DC1 CG2O1 NG2S1 CG2R61 9 180.000000 10.460000 2
+ CG2DC1 CG2O1 NG2S1 CG331 9 0.000000 6.694400 1
+ CG2DC1 CG2O1 NG2S1 CG331 9 180.000000 10.460000 2
+ CG2DC1 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG2DC2 CG2O1 NG2S1 CG2R61 9 0.000000 6.694400 1
+ CG2DC2 CG2O1 NG2S1 CG2R61 9 180.000000 10.460000 2
+ CG2DC2 CG2O1 NG2S1 CG331 9 0.000000 6.694400 1
+ CG2DC2 CG2O1 NG2S1 CG331 9 180.000000 10.460000 2
+ CG2DC2 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG2R61 CG2O1 NG2S1 CG321 9 0.000000 6.694400 1
+ CG2R61 CG2O1 NG2S1 CG321 9 180.000000 16.736000 2
+ CG2R61 CG2O1 NG2S1 NG2D1 9 0.000000 6.694400 1
+ CG2R61 CG2O1 NG2S1 NG2D1 9 180.000000 16.736000 2
+ CG2R61 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG311 CG2O1 NG2S1 CG311 9 0.000000 6.694400 1
+ CG311 CG2O1 NG2S1 CG311 9 180.000000 10.460000 2
+ CG311 CG2O1 NG2S1 CG321 9 0.000000 6.694400 1
+ CG311 CG2O1 NG2S1 CG321 9 180.000000 10.460000 2
+ CG311 CG2O1 NG2S1 CG331 9 0.000000 6.694400 1
+ CG311 CG2O1 NG2S1 CG331 9 180.000000 10.460000 2
+ CG311 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG314 CG2O1 NG2S1 CG311 9 0.000000 6.694400 1
+ CG314 CG2O1 NG2S1 CG311 9 180.000000 10.460000 2
+ CG314 CG2O1 NG2S1 CG321 9 0.000000 6.694400 1
+ CG314 CG2O1 NG2S1 CG321 9 180.000000 10.460000 2
+ CG314 CG2O1 NG2S1 CG331 9 0.000000 6.694400 1
+ CG314 CG2O1 NG2S1 CG331 9 180.000000 10.460000 2
+ CG314 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG321 CG2O1 NG2S1 CG2R61 9 0.000000 6.694400 1
+ CG321 CG2O1 NG2S1 CG2R61 9 180.000000 10.460000 2
+ CG321 CG2O1 NG2S1 CG2R64 9 0.000000 6.694400 1
+ CG321 CG2O1 NG2S1 CG2R64 9 180.000000 10.460000 2
+ CG321 CG2O1 NG2S1 CG311 9 0.000000 6.694400 1
+ CG321 CG2O1 NG2S1 CG311 9 180.000000 10.460000 2
+ CG321 CG2O1 NG2S1 CG321 9 0.000000 6.694400 1
+ CG321 CG2O1 NG2S1 CG321 9 180.000000 10.460000 2
+ CG321 CG2O1 NG2S1 CG331 9 0.000000 6.694400 1
+ CG321 CG2O1 NG2S1 CG331 9 180.000000 10.460000 2
+ CG321 CG2O1 NG2S1 NG2D1 9 0.000000 3.765600 1
+ CG321 CG2O1 NG2S1 NG2D1 9 180.000000 14.644000 2
+ CG321 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG324 CG2O1 NG2S1 CG311 9 0.000000 6.694400 1
+ CG324 CG2O1 NG2S1 CG311 9 180.000000 10.460000 2
+ CG324 CG2O1 NG2S1 CG321 9 0.000000 6.694400 1
+ CG324 CG2O1 NG2S1 CG321 9 180.000000 10.460000 2
+ CG324 CG2O1 NG2S1 CG331 9 0.000000 6.694400 1
+ CG324 CG2O1 NG2S1 CG331 9 180.000000 10.460000 2
+ CG324 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG331 CG2O1 NG2S1 CG2R61 9 0.000000 6.694400 1
+ CG331 CG2O1 NG2S1 CG2R61 9 180.000000 10.460000 2
+ CG331 CG2O1 NG2S1 CG2R64 9 0.000000 6.694400 1
+ CG331 CG2O1 NG2S1 CG2R64 9 180.000000 10.460000 2
+ CG331 CG2O1 NG2S1 CG311 9 0.000000 6.694400 1
+ CG331 CG2O1 NG2S1 CG311 9 180.000000 10.460000 2
+ CG331 CG2O1 NG2S1 CG321 9 0.000000 6.694400 1
+ CG331 CG2O1 NG2S1 CG321 9 180.000000 10.460000 2
+ CG331 CG2O1 NG2S1 CG331 9 0.000000 6.694400 1
+ CG331 CG2O1 NG2S1 CG331 9 180.000000 10.460000 2
+ CG331 CG2O1 NG2S1 NG2D1 9 0.000000 3.765600 1
+ CG331 CG2O1 NG2S1 NG2D1 9 180.000000 14.644000 2
+ CG331 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG3C51 CG2O1 NG2S1 CG311 9 0.000000 6.694400 1
+ CG3C51 CG2O1 NG2S1 CG311 9 180.000000 10.460000 2
+ CG3C51 CG2O1 NG2S1 CG321 9 0.000000 6.694400 1
+ CG3C51 CG2O1 NG2S1 CG321 9 180.000000 10.460000 2
+ CG3C51 CG2O1 NG2S1 CG331 9 0.000000 6.694400 1
+ CG3C51 CG2O1 NG2S1 CG331 9 180.000000 10.460000 2
+ CG3C51 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG3C53 CG2O1 NG2S1 CG311 9 0.000000 6.694400 1
+ CG3C53 CG2O1 NG2S1 CG311 9 180.000000 10.460000 2
+ CG3C53 CG2O1 NG2S1 CG321 9 0.000000 6.694400 1
+ CG3C53 CG2O1 NG2S1 CG321 9 180.000000 10.460000 2
+ CG3C53 CG2O1 NG2S1 CG331 9 0.000000 6.694400 1
+ CG3C53 CG2O1 NG2S1 CG331 9 180.000000 10.460000 2
+ CG3C53 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ OG2D1 CG2O1 NG2S1 CG2R61 9 180.000000 10.460000 2
+ OG2D1 CG2O1 NG2S1 CG2R64 9 180.000000 10.460000 2
+ OG2D1 CG2O1 NG2S1 CG311 9 180.000000 10.460000 2
+ OG2D1 CG2O1 NG2S1 CG321 9 180.000000 10.460000 2
+ OG2D1 CG2O1 NG2S1 CG331 9 180.000000 10.460000 2
+ OG2D1 CG2O1 NG2S1 NG2D1 9 180.000000 10.460000 2
+ OG2D1 CG2O1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG2DC1 CG2O1 NG2S2 HGP1 9 180.000000 10.460000 2
+ CG2DC2 CG2O1 NG2S2 HGP1 9 180.000000 10.460000 2
+ CG2R61 CG2O1 NG2S2 HGP1 9 180.000000 4.184000 2
+ CG2R62 CG2O1 NG2S2 HGP1 9 180.000000 10.460000 2
+ CG311 CG2O1 NG2S2 HGP1 9 180.000000 10.460000 2
+ CG314 CG2O1 NG2S2 HGP1 9 180.000000 10.460000 2
+ CG321 CG2O1 NG2S2 HGP1 9 180.000000 5.857600 2
+ CG324 CG2O1 NG2S2 HGP1 9 180.000000 5.857600 2
+ CG331 CG2O1 NG2S2 HGP1 9 180.000000 5.857600 2
+ CG3C51 CG2O1 NG2S2 HGP1 9 180.000000 10.460000 2
+ CG3C53 CG2O1 NG2S2 HGP1 9 180.000000 10.460000 2
+ OG2D1 CG2O1 NG2S2 HGP1 9 180.000000 5.857600 2
+ HGR52 CG2O1 NG2S2 HGP1 9 180.000000 5.857600 2
+ OG2D1 CG2O2 CG2R61 CG2R61 9 180.000000 4.288600 2
+ OG302 CG2O2 CG2R61 CG2R61 9 180.000000 3.556400 2
+ OG311 CG2O2 CG2R61 CG2R61 9 180.000000 4.288600 2
+ OG2D1 CG2O2 CG311 CG321 9 180.000000 0.209200 6
+ OG2D1 CG2O2 CG311 NG2R53 9 0.000000 0.000000 1
+ OG2D1 CG2O2 CG311 NG2S1 9 0.000000 0.000000 1
+ OG2D1 CG2O2 CG311 HGA1 9 0.000000 0.000000 3
+ OG302 CG2O2 CG311 CG321 9 180.000000 0.209200 6
+ OG302 CG2O2 CG311 NG2R53 9 0.000000 0.000000 1
+ OG302 CG2O2 CG311 NG2S1 9 0.000000 0.000000 1
+ OG302 CG2O2 CG311 HGA1 9 0.000000 0.000000 1
+ OG311 CG2O2 CG311 CG321 9 180.000000 0.209200 6
+ OG311 CG2O2 CG311 NG2R53 9 0.000000 0.000000 1
+ OG311 CG2O2 CG311 HGA1 9 180.000000 0.209200 6
+ OG2D1 CG2O2 CG321 CG311 9 180.000000 0.000000 6
+ OG2D1 CG2O2 CG321 CG321 9 180.000000 0.209200 6
+ OG2D1 CG2O2 CG321 CG331 9 180.000000 0.209200 6
+ OG2D1 CG2O2 CG321 NG321 9 180.000000 0.000000 6
+ OG2D1 CG2O2 CG321 HGA2 9 180.000000 0.000000 6
+ OG302 CG2O2 CG321 CG321 9 180.000000 2.217520 2
+ OG302 CG2O2 CG321 CG331 9 180.000000 -0.627600 1
+ OG302 CG2O2 CG321 HGA2 9 0.000000 0.000000 3
+ OG311 CG2O2 CG321 CG311 9 180.000000 0.000000 6
+ OG311 CG2O2 CG321 NG321 9 180.000000 0.000000 6
+ OG311 CG2O2 CG321 HGA2 9 180.000000 0.000000 6
+ OG2D1 CG2O2 CG331 HGA3 9 180.000000 0.000000 6
+ OG302 CG2O2 CG331 HGA3 9 0.000000 0.000000 3
+ OG311 CG2O2 CG331 HGA3 9 180.000000 0.000000 6
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+ NG3C51 CG2R51 CG2R51 HGR51 9 180.000000 14.644000 2
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+ HGR51 CG2R51 CG2R52 NG2R52 9 180.000000 18.828000 2
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+ HGR51 CG2R51 CG3C52 CG3C52 9 180.000000 8.368000 2
+ HGR51 CG2R51 CG3C52 CG3C54 9 180.000000 6.276000 2
+ HGR51 CG2R51 CG3C52 NG2R50 9 180.000000 17.991200 2
+ HGR51 CG2R51 CG3C52 NG3C51 9 180.000000 12.970400 2
+ HGR51 CG2R51 CG3C52 OG3C51 9 180.000000 12.970400 2
+ HGR51 CG2R51 CG3C52 HGA2 9 0.000000 0.000000 3
+ CG2R51 CG2R51 CG3C54 NG2R52 9 180.000000 11.715200 2
+ CG2R51 CG2R51 CG3C54 NG3P2 9 180.000000 3.765600 3
+ CG2R51 CG2R51 CG3C54 HGA2 9 0.000000 0.000000 3
+ HGR51 CG2R51 CG3C54 NG2R52 9 180.000000 20.920000 2
+ HGR51 CG2R51 CG3C54 NG3P2 9 180.000000 7.112800 2
+ HGR51 CG2R51 CG3C54 HGA2 9 0.000000 0.000000 3
+ CG2R51 CG2R51 NG2R50 CG2R52 9 180.000000 22.593600 2
+ CG2R51 CG2R51 NG2R50 CG2R53 9 180.000000 58.576000 2
+ CG2R51 CG2R51 NG2R50 NG2R50 9 180.000000 35.564000 2
+ CG321 CG2R51 NG2R50 CG2R53 9 180.000000 12.552000 2
+ HGR52 CG2R51 NG2R50 CG2R52 9 180.000000 8.368000 2
+ HGR52 CG2R51 NG2R50 CG2R53 9 180.000000 12.552000 2
+ HGR52 CG2R51 NG2R50 NG2R50 9 180.000000 23.012000 2
+ CG2R51 CG2R51 NG2R51 CG2R51 9 180.000000 41.840000 2
+ CG2R51 CG2R51 NG2R51 CG2R53 9 180.000000 58.576000 2
+ CG2R51 CG2R51 NG2R51 CG2RC0 9 180.000000 20.920000 2
+ CG2R51 CG2R51 NG2R51 CG321 9 0.000000 0.000000 1
+ CG2R51 CG2R51 NG2R51 CG3C51 9 0.000000 0.000000 1
+ CG2R51 CG2R51 NG2R51 NG2R50 9 180.000000 41.840000 2
+ CG2R51 CG2R51 NG2R51 HGP1 9 180.000000 4.184000 2
+ CG2R57 CG2R51 NG2R51 CG2R51 9 180.000000 41.840000 2
+ CG2R57 CG2R51 NG2R51 HGP1 9 180.000000 4.184000 2
+ CG2RC0 CG2R51 NG2R51 CG2R51 9 180.000000 25.104000 2
+ CG2RC0 CG2R51 NG2R51 HGP1 9 180.000000 4.184000 2
+ CG321 CG2R51 NG2R51 CG2R53 9 180.000000 12.552000 2
+ CG321 CG2R51 NG2R51 HGP1 9 180.000000 4.184000 2
+ CG331 CG2R51 NG2R51 CG2R53 9 180.000000 12.552000 2
+ CG331 CG2R51 NG2R51 HGP1 9 180.000000 4.184000 2
+ HGR52 CG2R51 NG2R51 CG2R51 9 180.000000 10.878400 2
+ HGR52 CG2R51 NG2R51 CG2R53 9 180.000000 12.552000 2
+ HGR52 CG2R51 NG2R51 CG2RC0 9 180.000000 10.878400 2
+ HGR52 CG2R51 NG2R51 CG321 9 180.000000 0.000000 2
+ HGR52 CG2R51 NG2R51 CG3C51 9 180.000000 0.000000 2
+ HGR52 CG2R51 NG2R51 NG2R50 9 180.000000 12.552000 2
+ HGR52 CG2R51 NG2R51 HGP1 9 180.000000 4.184000 2
+ CG2R51 CG2R51 NG2R52 CG2R53 9 180.000000 50.208000 2
+ CG2R51 CG2R51 NG2R52 HGP2 9 180.000000 5.857600 2
+ CG321 CG2R51 NG2R52 CG2R53 9 180.000000 10.460000 2
+ CG321 CG2R51 NG2R52 HGP2 9 180.000000 12.552000 2
+ HGR52 CG2R51 NG2R52 CG2R53 9 180.000000 10.460000 2
+ HGR52 CG2R51 NG2R52 HGP2 9 180.000000 12.552000 2
+ CG2R51 CG2R51 NG2R57 CG2R51 9 180.000000 41.840000 2
+ CG2R51 CG2R51 NG2R57 CG2R57 9 180.000000 0.836800 2
+ CG2R51 CG2R51 NG2R57 NG2R57 9 180.000000 0.836800 2
+ HGR52 CG2R51 NG2R57 CG2R51 9 180.000000 10.878400 2
+ HGR52 CG2R51 NG2R57 CG2R57 9 180.000000 6.276000 2
+ HGR52 CG2R51 NG2R57 NG2R57 9 180.000000 4.602400 2
+ CG2R51 CG2R51 NG2RC0 CG2R61 9 180.000000 12.552000 2
+ CG2R51 CG2R51 NG2RC0 CG2RC0 9 180.000000 37.656000 2
+ HGR52 CG2R51 NG2RC0 CG2R61 9 180.000000 5.857600 2
+ HGR52 CG2R51 NG2RC0 CG2RC0 9 180.000000 5.857600 2
+ CG2R51 CG2R51 NG3C51 CG3C52 9 180.000000 33.472000 2
+ CG2R51 CG2R51 NG3C51 HGP1 9 0.000000 0.000000 3
+ HGR52 CG2R51 NG3C51 CG3C52 9 180.000000 12.552000 2
+ HGR52 CG2R51 NG3C51 HGP1 9 0.000000 0.000000 3
+ CG2R51 CG2R51 NG3P2 CG3C54 9 0.000000 1.255200 3
+ CG2R51 CG2R51 NG3P2 HGP2 9 180.000000 1.255200 3
+ HGR52 CG2R51 NG3P2 CG3C54 9 180.000000 0.000000 3
+ HGR52 CG2R51 NG3P2 HGP2 9 180.000000 0.000000 3
+ CG2R51 CG2R51 OG2R50 CG2R51 9 180.000000 31.380000 2
+ CG2R51 CG2R51 OG2R50 CG2R53 9 180.000000 35.564000 2
+ CG2R51 CG2R51 OG2R50 CG2RC0 9 180.000000 35.564000 2
+ CG2R51 CG2R51 OG2R50 NG2R50 9 180.000000 35.564000 2
+ HGR52 CG2R51 OG2R50 CG2R51 9 180.000000 15.899200 2
+ HGR52 CG2R51 OG2R50 CG2R53 9 180.000000 15.899200 2
+ HGR52 CG2R51 OG2R50 CG2RC0 9 180.000000 12.552000 2
+ HGR52 CG2R51 OG2R50 NG2R50 9 180.000000 23.012000 2
+ CG2R51 CG2R51 OG3C51 CG2R53 9 180.000000 5.150504 2
+ CG2R51 CG2R51 OG3C51 CG2R53 9 180.000000 9.598096 3
+ CG2R51 CG2R51 OG3C51 CG3C52 9 180.000000 18.158560 2
+ HGR52 CG2R51 OG3C51 CG2R53 9 180.000000 8.786400 2
+ HGR52 CG2R51 OG3C51 CG3C52 9 180.000000 8.786400 2
+ CG2R51 CG2R51 SG2R50 CG2R51 9 180.000000 35.564000 2
+ CG2R51 CG2R51 SG2R50 CG2R53 9 180.000000 35.564000 2
+ CG2R51 CG2R51 SG2R50 CG2RC0 9 180.000000 35.564000 2
+ CG2R51 CG2R51 SG2R50 NG2R50 9 180.000000 37.656000 2
+ HGR52 CG2R51 SG2R50 CG2R51 9 180.000000 16.736000 2
+ HGR52 CG2R51 SG2R50 CG2R53 9 180.000000 23.012000 2
+ HGR52 CG2R51 SG2R50 CG2RC0 9 180.000000 16.317600 2
+ HGR52 CG2R51 SG2R50 NG2R50 9 180.000000 18.828000 2
+ NG2R50 CG2R52 CG2R52 NG2R50 9 180.000000 39.748000 2
+ NG2R50 CG2R52 CG2R52 HGR52 9 180.000000 16.317600 2
+ HGR52 CG2R52 CG2R52 HGR52 9 180.000000 0.711280 2
+ NG2R50 CG2R52 CG2RC0 CG2R61 9 180.000000 8.368000 2
+ NG2R50 CG2R52 CG2RC0 CG2RC0 9 180.000000 33.472000 2
+ HGR52 CG2R52 CG2RC0 CG2R61 9 180.000000 10.041600 2
+ HGR52 CG2R52 CG2RC0 CG2RC0 9 180.000000 10.041600 2
+ NG2R50 CG2R52 CG3C52 CG2R51 9 180.000000 14.644000 3
+ NG2R50 CG2R52 CG3C52 CG2RC0 9 180.000000 14.644000 3
+ NG2R50 CG2R52 CG3C52 CG3C52 9 180.000000 11.715200 3
+ NG2R50 CG2R52 CG3C52 HGA2 9 0.000000 5.857600 3
+ HGR52 CG2R52 CG3C52 CG2R51 9 0.000000 5.439200 3
+ HGR52 CG2R52 CG3C52 CG2RC0 9 0.000000 8.368000 3
+ HGR52 CG2R52 CG3C52 CG3C52 9 180.000000 16.736000 2
+ HGR52 CG2R52 CG3C52 HGA2 9 0.000000 0.000000 3
+ CG2R51 CG2R52 NG2R50 CG3C52 9 180.000000 23.012000 2
+ CG2R51 CG2R52 NG2R50 NG2R51 9 180.000000 50.208000 2
+ CG2R51 CG2R52 NG2R50 OG2R50 9 180.000000 50.208000 2
+ CG2R51 CG2R52 NG2R50 SG2R50 9 180.000000 35.564000 2
+ CG2R52 CG2R52 NG2R50 NG2R51 9 180.000000 50.208000 2
+ CG2RC0 CG2R52 NG2R50 NG2R51 9 180.000000 56.484000 2
+ CG3C52 CG2R52 NG2R50 CG2R51 9 180.000000 27.196000 2
+ CG3C52 CG2R52 NG2R50 CG2RC0 9 180.000000 54.392000 2
+ CG3C52 CG2R52 NG2R50 NG3C51 9 180.000000 71.128000 2
+ HGR52 CG2R52 NG2R50 CG2R51 9 180.000000 20.920000 2
+ HGR52 CG2R52 NG2R50 CG2RC0 9 180.000000 16.736000 2
+ HGR52 CG2R52 NG2R50 CG3C52 9 180.000000 31.798400 2
+ HGR52 CG2R52 NG2R50 NG2R51 9 180.000000 15.899200 2
+ HGR52 CG2R52 NG2R50 NG3C51 9 180.000000 20.920000 2
+ HGR52 CG2R52 NG2R50 OG2R50 9 180.000000 23.012000 2
+ HGR52 CG2R52 NG2R50 SG2R50 9 180.000000 18.828000 2
+ CG2R51 CG2R52 NG2R52 CG3C54 9 180.000000 25.104000 2
+ CG2R51 CG2R52 NG2R52 HGP2 9 180.000000 11.296800 2
+ HGR52 CG2R52 NG2R52 CG3C54 9 180.000000 37.656000 2
+ HGR52 CG2R52 NG2R52 HGP2 9 180.000000 0.000000 2
+ NG2R43 CG2R53 CG3C41 CG3C41 9 0.000000 12.552000 3
+ NG2R43 CG2R53 CG3C41 HGA2 9 0.000000 2.384880 3
+ OG2D1 CG2R53 CG3C41 CG3C41 9 0.000000 2.384880 3
+ OG2D1 CG2R53 CG3C41 HGA2 9 0.000000 2.384880 3
+ NG2R53 CG2R53 CG3C52 CG3C52 9 180.000000 4.393200 3
+ NG2R53 CG2R53 CG3C52 HGA2 9 180.000000 0.000000 3
+ OG2D1 CG2R53 CG3C52 CG2R51 9 0.000000 0.334720 3
+ OG2D1 CG2R53 CG3C52 CG3C52 9 0.000000 0.334720 3
+ OG2D1 CG2R53 CG3C52 HGA2 9 0.000000 0.000000 3
+ OG3C51 CG2R53 CG3C52 CG2R51 9 0.000000 0.916296 3
+ OG3C51 CG2R53 CG3C52 CG2R51 9 0.000000 1.209176 4
+ OG3C51 CG2R53 CG3C52 CG3C52 9 0.000000 9.916080 2
+ OG3C51 CG2R53 CG3C52 HGA2 9 180.000000 0.000000 3
+ CG3C41 CG2R53 NG2R43 CG3C41 9 180.000000 6.276000 2
+ CG3C41 CG2R53 NG2R43 HGP1 9 0.000000 0.000000 1
+ OG2D1 CG2R53 NG2R43 CG3C41 9 180.000000 10.460000 2
+ OG2D1 CG2R53 NG2R43 HGP1 9 180.000000 10.460000 2
+ NG2R50 CG2R53 NG2R50 CG2R53 9 180.000000 41.840000 2
+ NG2R50 CG2R53 NG2R50 NG2R51 9 180.000000 50.208000 2
+ NG2R50 CG2R53 NG2R50 OG2R50 9 180.000000 50.208000 2
+ NG2R51 CG2R53 NG2R50 CG2R51 9 180.000000 58.576000 2
+ NG2R51 CG2R53 NG2R50 CG2R53 9 180.000000 50.208000 2
+ NG2R51 CG2R53 NG2R50 CG2RC0 9 180.000000 58.576000 2
+ NG3C51 CG2R53 NG2R50 CG3C52 9 180.000000 75.312000 2
+ OG2R50 CG2R53 NG2R50 CG2R51 9 180.000000 58.576000 2
+ OG2R50 CG2R53 NG2R50 CG2R53 9 180.000000 50.208000 2
+ SG2R50 CG2R53 NG2R50 CG2R51 9 180.000000 25.104000 2
+ SG2R50 CG2R53 NG2R50 CG2RC0 9 180.000000 52.300000 2
+ HGR52 CG2R53 NG2R50 CG2R51 9 180.000000 8.368000 2
+ HGR52 CG2R53 NG2R50 CG2R53 9 180.000000 23.012000 2
+ HGR52 CG2R53 NG2R50 CG2RC0 9 180.000000 21.756800 2
+ HGR52 CG2R53 NG2R50 CG3C52 9 180.000000 47.697600 2
+ HGR52 CG2R53 NG2R50 NG2R51 9 180.000000 13.807200 2
+ HGR52 CG2R53 NG2R50 OG2R50 9 180.000000 15.899200 2
+ CG25C1 CG2R53 NG2R51 CG2RC0 9 180.000000 8.368000 2
+ CG25C1 CG2R53 NG2R51 HGP1 9 180.000000 1.255200 2
+ CG25C2 CG2R53 NG2R51 CG2RC0 9 180.000000 8.368000 2
+ CG25C2 CG2R53 NG2R51 HGP1 9 180.000000 1.255200 2
+ NG2R50 CG2R53 NG2R51 CG2R51 9 180.000000 58.576000 2
+ NG2R50 CG2R53 NG2R51 CG2RC0 9 180.000000 25.104000 2
+ NG2R50 CG2R53 NG2R51 CG331 9 180.000000 46.024000 2
+ NG2R50 CG2R53 NG2R51 CG3C51 9 180.000000 46.024000 2
+ NG2R50 CG2R53 NG2R51 CG3RC1 9 180.000000 6.276000 2
+ NG2R50 CG2R53 NG2R51 NG2R50 9 180.000000 41.840000 2
+ NG2R50 CG2R53 NG2R51 HGP1 9 180.000000 4.184000 2
+ OG2D1 CG2R53 NG2R51 CG2RC0 9 180.000000 10.460000 2
+ OG2D1 CG2R53 NG2R51 HGP1 9 180.000000 3.598240 2
+ HGR52 CG2R53 NG2R51 CG2R51 9 180.000000 12.552000 2
+ HGR52 CG2R53 NG2R51 CG2RC0 9 180.000000 23.430400 2
+ HGR52 CG2R53 NG2R51 CG331 9 180.000000 0.000000 2
+ HGR52 CG2R53 NG2R51 CG3C51 9 180.000000 0.000000 2
+ HGR52 CG2R53 NG2R51 CG3RC1 9 180.000000 6.276000 2
+ HGR52 CG2R53 NG2R51 NG2R50 9 180.000000 7.112800 2
+ HGR52 CG2R53 NG2R51 HGP1 9 180.000000 4.184000 2
+ NG2R52 CG2R53 NG2R52 CG2R51 9 180.000000 50.208000 2
+ NG2R52 CG2R53 NG2R52 CG3C54 9 180.000000 32.216800 2
+ NG2R52 CG2R53 NG2R52 HGP2 9 180.000000 5.857600 2
+ HGR53 CG2R53 NG2R52 CG2R51 9 180.000000 12.552000 2
+ HGR53 CG2R53 NG2R52 CG3C54 9 180.000000 26.359200 2
+ HGR53 CG2R53 NG2R52 HGP2 9 180.000000 0.000000 2
+ CG251O CG2R53 NG2R53 CG2R53 9 180.000000 6.276000 2
+ CG251O CG2R53 NG2R53 CG311 9 0.000000 6.694400 1
+ CG251O CG2R53 NG2R53 CG311 9 180.000000 10.460000 2
+ CG251O CG2R53 NG2R53 HGP1 9 180.000000 7.112800 2
+ CG252O CG2R53 NG2R53 CG2R53 9 180.000000 6.276000 2
+ CG252O CG2R53 NG2R53 CG311 9 0.000000 6.694400 1
+ CG252O CG2R53 NG2R53 CG311 9 180.000000 10.460000 2
+ CG252O CG2R53 NG2R53 HGP1 9 180.000000 7.112800 2
+ CG3C52 CG2R53 NG2R53 CG3C52 9 180.000000 1.673600 2
+ CG3C52 CG2R53 NG2R53 HGP1 9 180.000000 5.313680 2
+ NG2R53 CG2R53 NG2R53 CG251O 9 180.000000 2.092000 2
+ NG2R53 CG2R53 NG2R53 CG252O 9 180.000000 2.092000 2
+ NG2R53 CG2R53 NG2R53 CG2R53 9 180.000000 2.092000 2
+ NG2R53 CG2R53 NG2R53 CG311 9 180.000000 2.092000 2
+ NG2R53 CG2R53 NG2R53 HGP1 9 180.000000 3.347200 2
+ OG2D1 CG2R53 NG2R53 CG251O 9 180.000000 25.104000 2
+ OG2D1 CG2R53 NG2R53 CG252O 9 180.000000 25.104000 2
+ OG2D1 CG2R53 NG2R53 CG2R53 9 180.000000 4.602400 2
+ OG2D1 CG2R53 NG2R53 CG311 9 180.000000 10.460000 2
+ OG2D1 CG2R53 NG2R53 CG3C52 9 180.000000 10.836560 2
+ OG2D1 CG2R53 NG2R53 HGP1 9 180.000000 3.598240 2
+ SG2D1 CG2R53 NG2R53 CG2R53 9 180.000000 6.276000 2
+ SG2D1 CG2R53 NG2R53 CG311 9 180.000000 6.276000 2
+ SG2D1 CG2R53 NG2R53 HGP1 9 180.000000 4.184000 2
+ SG311 CG2R53 NG2R53 CG2R53 9 180.000000 6.276000 2
+ SG311 CG2R53 NG2R53 CG311 9 180.000000 6.276000 2
+ SG311 CG2R53 NG2R53 HGP1 9 180.000000 7.112800 2
+ NG2R50 CG2R53 NG3C51 CG3C52 9 180.000000 16.736000 2
+ NG2R50 CG2R53 NG3C51 HGP1 9 0.000000 5.020800 3
+ HGR52 CG2R53 NG3C51 CG3C52 9 180.000000 0.000000 2
+ HGR52 CG2R53 NG3C51 HGP1 9 0.000000 0.000000 3
+ NG2R50 CG2R53 OG2R50 CG2R51 9 180.000000 35.564000 2
+ NG2R50 CG2R53 OG2R50 NG2R50 9 180.000000 37.656000 2
+ HGR52 CG2R53 OG2R50 CG2R51 9 180.000000 15.899200 2
+ HGR52 CG2R53 OG2R50 NG2R50 9 180.000000 16.736000 2
+ CG2R51 CG2R53 OG3C51 CG3C52 9 180.000000 5.188160 2
+ CG2R51 CG2R53 OG3C51 CG3C52 9 180.000000 9.497680 3
+ CG3C52 CG2R53 OG3C51 CG2R51 9 180.000000 1.238464 2
+ CG3C52 CG2R53 OG3C51 CG2R51 9 180.000000 2.142208 3
+ CG3C52 CG2R53 OG3C51 CG3C52 9 180.000000 15.899200 2
+ OG2D1 CG2R53 OG3C51 CG2R51 9 180.000000 18.158560 2
+ OG2D1 CG2R53 OG3C51 CG3C52 9 180.000000 18.158560 2
+ NG2R50 CG2R53 SG2R50 CG2R51 9 180.000000 35.564000 2
+ NG2R50 CG2R53 SG2R50 CG2RC0 9 180.000000 12.552000 2
+ HGR52 CG2R53 SG2R50 CG2R51 9 180.000000 23.012000 2
+ HGR52 CG2R53 SG2R50 CG2RC0 9 180.000000 12.552000 2
+ NG2R53 CG2R53 SG311 CG251O 9 0.000000 1.046000 1
+ NG2R53 CG2R53 SG311 CG251O 9 180.000000 5.439200 2
+ NG2R53 CG2R53 SG311 CG252O 9 0.000000 1.046000 1
+ NG2R53 CG2R53 SG311 CG252O 9 180.000000 5.439200 2
+ OG2D1 CG2R53 SG311 CG251O 9 0.000000 1.046000 1
+ OG2D1 CG2R53 SG311 CG251O 9 180.000000 5.439200 2
+ OG2D1 CG2R53 SG311 CG252O 9 0.000000 1.046000 1
+ OG2D1 CG2R53 SG311 CG252O 9 180.000000 5.439200 2
+ SG2D1 CG2R53 SG311 CG251O 9 180.000000 1.046000 1
+ SG2D1 CG2R53 SG311 CG251O 9 180.000000 2.510400 2
+ SG2D1 CG2R53 SG311 CG252O 9 180.000000 1.046000 1
+ SG2D1 CG2R53 SG311 CG252O 9 180.000000 2.510400 2
+ CG2R51 CG2R57 CG2R57 CG2R51 9 180.000000 1.882800 2
+ CG2R51 CG2R57 CG2R57 CG2R51 9 0.000000 0.334720 4
+ CG2R51 CG2R57 NG2R57 CG2R51 9 180.000000 1.338880 2
+ CG2R51 CG2R57 NG2R57 CG2R51 9 0.000000 0.502080 4
+ CG2R51 CG2R57 NG2R57 CG2R51 9 0.000000 0.062760 6
+ CG1N1 CG2R61 CG2R61 CG2R61 9 180.000000 8.368000 2
+ CG1N1 CG2R61 CG2R61 CG2RC0 9 180.000000 5.439200 2
+ CG1N1 CG2R61 CG2R61 NG2R60 9 180.000000 4.184000 2
+ CG1N1 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG1N1 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ CG2DC1 CG2R61 CG2R61 CG2R61 9 180.000000 12.970400 2
+ CG2DC1 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG2DC2 CG2R61 CG2R61 CG2R61 9 180.000000 12.970400 2
+ CG2DC2 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG2N2 CG2R61 CG2R61 CG2R61 9 180.000000 12.970400 2
+ CG2N2 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG2O1 CG2R61 CG2R61 CG2R61 9 180.000000 12.970400 2
+ CG2O1 CG2R61 CG2R61 NG2R60 9 180.000000 20.920000 2
+ CG2O1 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG2O1 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ CG2O2 CG2R61 CG2R61 CG2R61 9 180.000000 12.970400 2
+ CG2O2 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG2O3 CG2R61 CG2R61 CG2R61 9 180.000000 12.970400 2
+ CG2O3 CG2R61 CG2R61 NG2R60 9 180.000000 4.184000 2
+ CG2O3 CG2R61 CG2R61 NG2S1 9 180.000000 10.041600 2
+ CG2O3 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG2O3 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ CG2O4 CG2R61 CG2R61 CG2R61 9 180.000000 12.970400 2
+ CG2O4 CG2R61 CG2R61 NG2R60 9 180.000000 4.184000 2
+ CG2O4 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG2O4 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ CG2O5 CG2R61 CG2R61 CG2R61 9 180.000000 12.970400 2
+ CG2O5 CG2R61 CG2R61 NG2R60 9 180.000000 20.920000 2
+ CG2O5 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG2O5 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ CG2R61 CG2R61 CG2R61 CG2R61 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 CG2R62 9 180.000000 2.092000 2
+ CG2R61 CG2R61 CG2R61 CG2R63 9 180.000000 13.388800 2
+ CG2R61 CG2R61 CG2R61 CG2R64 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 CG2R66 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 CG2R67 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 CG2RC0 9 180.000000 12.552000 2
+ CG2R61 CG2R61 CG2R61 CG311 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 CG312 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 CG321 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 CG324 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 CG331 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 NG2O1 9 180.000000 8.368000 2
+ CG2R61 CG2R61 CG2R61 NG2R60 9 180.000000 5.020800 2
+ CG2R61 CG2R61 CG2R61 NG2R61 9 180.000000 15.480800 2
+ CG2R61 CG2R61 CG2R61 NG2R62 9 180.000000 5.020800 2
+ CG2R61 CG2R61 CG2R61 NG2RC0 9 180.000000 6.276000 2
+ CG2R61 CG2R61 CG2R61 NG2S1 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 NG2S3 9 180.000000 20.920000 2
+ CG2R61 CG2R61 CG2R61 NG311 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 NG3N1 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 OG301 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 OG303 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 OG311 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 OG312 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 OG3R60 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 SG311 9 180.000000 18.828000 2
+ CG2R61 CG2R61 CG2R61 SG3O1 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R61 SG3O2 9 180.000000 12.552000 2
+ CG2R61 CG2R61 CG2R61 CLGR1 9 180.000000 12.552000 2
+ CG2R61 CG2R61 CG2R61 BRGR1 9 180.000000 12.552000 2
+ CG2R61 CG2R61 CG2R61 IGR1 9 180.000000 8.786400 2
+ CG2R61 CG2R61 CG2R61 HGR61 9 180.000000 17.572800 2
+ CG2R61 CG2R61 CG2R61 HGR62 9 180.000000 17.572800 2
+ CG2R62 CG2R61 CG2R61 HGR61 9 180.000000 17.572800 2
+ CG2R63 CG2R61 CG2R61 NG2R61 9 180.000000 2.092000 2
+ CG2R63 CG2R61 CG2R61 NG2R62 9 180.000000 5.020800 2
+ CG2R63 CG2R61 CG2R61 HGR61 9 180.000000 4.184000 2
+ CG2R63 CG2R61 CG2R61 HGR62 9 180.000000 2.092000 2
+ CG2R64 CG2R61 CG2R61 CG331 9 180.000000 12.970400 2
+ CG2R64 CG2R61 CG2R61 NG2R62 9 180.000000 5.020800 2
+ CG2R64 CG2R61 CG2R61 HGR61 9 180.000000 4.184000 2
+ CG2R64 CG2R61 CG2R61 HGR62 9 180.000000 2.092000 2
+ CG2R66 CG2R61 CG2R61 NG2S1 9 180.000000 12.970400 2
+ CG2R66 CG2R61 CG2R61 HGR61 9 180.000000 17.572800 2
+ CG2R67 CG2R61 CG2R61 HGR61 9 180.000000 17.572800 2
+ CG2RC0 CG2R61 CG2R61 BRGR1 9 180.000000 12.970400 2
+ CG2RC0 CG2R61 CG2R61 HGR61 9 180.000000 12.552000 2
+ CG2RC0 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ CG311 CG2R61 CG2R61 OG311 9 180.000000 10.041600 2
+ CG311 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG312 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG321 CG2R61 CG2R61 NG2R60 9 180.000000 4.184000 2
+ CG321 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG321 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ CG324 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG331 CG2R61 CG2R61 CG331 9 180.000000 10.041600 2
+ CG331 CG2R61 CG2R61 NG2R60 9 180.000000 4.184000 2
+ CG331 CG2R61 CG2R61 NG2S1 9 180.000000 10.041600 2
+ CG331 CG2R61 CG2R61 OG301 9 180.000000 10.041600 2
+ CG331 CG2R61 CG2R61 OG311 9 180.000000 10.041600 2
+ CG331 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ CG331 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ NG2O1 CG2R61 CG2R61 HGR61 9 180.000000 4.184000 2
+ NG2R60 CG2R61 CG2R61 NG2R60 9 180.000000 3.765600 2
+ NG2R60 CG2R61 CG2R61 NG2R62 9 180.000000 12.552000 2
+ NG2R60 CG2R61 CG2R61 NG2S1 9 180.000000 20.920000 2
+ NG2R60 CG2R61 CG2R61 NG2S3 9 180.000000 20.920000 2
+ NG2R60 CG2R61 CG2R61 OG311 9 180.000000 4.184000 2
+ NG2R60 CG2R61 CG2R61 BRGR1 9 180.000000 12.552000 2
+ NG2R60 CG2R61 CG2R61 HGR61 9 180.000000 11.715200 2
+ NG2R60 CG2R61 CG2R61 HGR62 9 180.000000 25.104000 2
+ NG2R61 CG2R61 CG2R61 HGR61 9 180.000000 3.347200 2
+ NG2R61 CG2R61 CG2R61 HGR62 9 180.000000 3.347200 2
+ NG2R62 CG2R61 CG2R61 NG2R62 9 180.000000 2.092000 2
+ NG2R62 CG2R61 CG2R61 HGR61 9 180.000000 11.715200 2
+ NG2R62 CG2R61 CG2R61 HGR62 9 180.000000 25.104000 2
+ NG2RC0 CG2R61 CG2R61 HGR61 9 180.000000 3.347200 2
+ NG2S1 CG2R61 CG2R61 OG301 9 180.000000 10.041600 2
+ NG2S1 CG2R61 CG2R61 OG311 9 180.000000 10.041600 2
+ NG2S1 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ NG2S1 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ NG2S3 CG2R61 CG2R61 NG2S3 9 180.000000 12.970400 2
+ NG2S3 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ NG2S3 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ NG311 CG2R61 CG2R61 OG3R60 9 180.000000 10.794720 2
+ NG311 CG2R61 CG2R61 SG311 9 180.000000 14.936880 2
+ NG311 CG2R61 CG2R61 SG3O2 9 180.000000 10.041600 2
+ NG311 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ NG3N1 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ OG301 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ OG303 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ OG311 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ OG311 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ OG312 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ OG3R60 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ SG311 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ SG3O1 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ SG3O2 CG2R61 CG2R61 HGR61 9 180.000000 8.786400 2
+ CLGR1 CG2R61 CG2R61 HGR62 9 180.000000 12.552000 2
+ BRGR1 CG2R61 CG2R61 HGR62 9 180.000000 12.552000 2
+ IGR1 CG2R61 CG2R61 HGR62 9 180.000000 12.552000 2
+ HGR61 CG2R61 CG2R61 HGR61 9 180.000000 10.041600 2
+ HGR61 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ HGR62 CG2R61 CG2R61 HGR62 9 180.000000 10.041600 2
+ CG2R61 CG2R61 CG2R62 CG2R62 9 180.000000 2.092000 2
+ CG2R61 CG2R61 CG2R62 CG2R63 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R62 NG2R61 9 180.000000 29.288000 2
+ CG2R61 CG2R61 CG2R62 NG2R62 9 180.000000 5.020800 2
+ CG2R61 CG2R61 CG2R62 OG3R60 9 180.000000 12.970400 2
+ HGR61 CG2R61 CG2R62 CG2R62 9 180.000000 12.970400 2
+ HGR61 CG2R61 CG2R62 CG2R63 9 180.000000 4.184000 2
+ HGR61 CG2R61 CG2R62 NG2R61 9 180.000000 1.673600 2
+ HGR61 CG2R61 CG2R62 NG2R62 9 180.000000 11.715200 2
+ HGR61 CG2R61 CG2R62 OG3R60 9 180.000000 10.041600 2
+ CG2R61 CG2R61 CG2R63 NG2R61 9 180.000000 2.092000 2
+ CG2R61 CG2R61 CG2R63 NG2R67 9 180.000000 2.092000 2
+ CG2R61 CG2R61 CG2R63 SG2D1 9 180.000000 18.828000 2
+ HGR62 CG2R61 CG2R63 NG2R61 9 180.000000 4.184000 2
+ HGR62 CG2R61 CG2R63 NG2R67 9 180.000000 4.184000 2
+ HGR62 CG2R61 CG2R63 SG2D1 9 180.000000 10.041600 2
+ CG2R61 CG2R61 CG2R64 NG2R60 9 180.000000 5.020800 2
+ CG2R61 CG2R61 CG2R64 NG2R62 9 180.000000 5.020800 2
+ CG2R61 CG2R61 CG2R64 NG2S1 9 180.000000 12.970400 2
+ NG2R60 CG2R61 CG2R64 NG2R62 9 0.000000 6.276000 2
+ OG311 CG2R61 CG2R64 NG2R60 9 180.000000 12.970400 2
+ OG311 CG2R61 CG2R64 NG2S1 9 180.000000 10.041600 2
+ HGR61 CG2R61 CG2R64 NG2R60 9 180.000000 11.715200 2
+ HGR61 CG2R61 CG2R64 NG2S1 9 180.000000 10.041600 2
+ CG2R61 CG2R61 CG2R66 CG2R61 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R66 FGR1 9 180.000000 18.828000 2
+ CG2R66 CG2R61 CG2R66 CG2R61 9 180.000000 12.970400 2
+ CG2R66 CG2R61 CG2R66 FGR1 9 180.000000 18.828000 2
+ CG331 CG2R61 CG2R66 CG2R61 9 180.000000 12.970400 2
+ CG331 CG2R61 CG2R66 FGR1 9 180.000000 18.828000 2
+ NG2R60 CG2R61 CG2R66 CG2R61 9 180.000000 5.020800 2
+ NG2R60 CG2R61 CG2R66 FGR1 9 180.000000 12.970400 2
+ NG2S1 CG2R61 CG2R66 CG2R61 9 180.000000 12.970400 2
+ NG2S1 CG2R61 CG2R66 FGR1 9 180.000000 10.041600 2
+ HGR62 CG2R61 CG2R66 CG2R61 9 180.000000 17.572800 2
+ HGR62 CG2R61 CG2R66 FGR1 9 180.000000 10.041600 2
+ CG2R61 CG2R61 CG2R67 CG2R61 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R67 CG2R67 9 180.000000 12.970400 2
+ CG2R61 CG2R61 CG2R67 CG2RC0 9 180.000000 1.046000 2
+ CG2R61 CG2R61 CG2R67 NG2R60 9 180.000000 5.020800 2
+ CG2R61 CG2R61 CG2R67 NG2R67 9 180.000000 12.970400 2
+ NG2R60 CG2R61 CG2R67 CG2R61 9 180.000000 5.020800 2
+ NG2R60 CG2R61 CG2R67 CG2R67 9 180.000000 4.184000 2
+ HGR61 CG2R61 CG2R67 CG2R61 9 180.000000 17.572800 2
+ HGR61 CG2R61 CG2R67 CG2R67 9 180.000000 17.572800 2
+ HGR61 CG2R61 CG2R67 CG2RC0 9 180.000000 12.552000 2
+ HGR61 CG2R61 CG2R67 NG2R60 9 180.000000 11.715200 2
+ HGR61 CG2R61 CG2R67 NG2R67 9 180.000000 11.715200 2
+ HGR62 CG2R61 CG2R67 CG2R61 9 180.000000 17.572800 2
+ HGR62 CG2R61 CG2R67 CG2R67 9 180.000000 17.572800 2
+ CG2O1 CG2R61 CG2RC0 CG2RC0 9 180.000000 12.970400 2
+ CG2O1 CG2R61 CG2RC0 NG2R51 9 180.000000 11.715200 2
+ CG2R61 CG2R61 CG2RC0 CG25C1 9 180.000000 12.552000 2
+ CG2R61 CG2R61 CG2RC0 CG25C2 9 180.000000 12.552000 2
+ CG2R61 CG2R61 CG2RC0 CG2R51 9 180.000000 16.736000 2
+ CG2R61 CG2R61 CG2RC0 CG2R52 9 180.000000 6.276000 2
+ CG2R61 CG2R61 CG2RC0 CG2R67 9 180.000000 1.046000 2
+ CG2R61 CG2R61 CG2RC0 CG2RC0 9 180.000000 12.552000 2
+ CG2R61 CG2R61 CG2RC0 CG3C52 9 180.000000 0.000000 2
+ CG2R61 CG2R61 CG2RC0 NG2R50 9 180.000000 6.276000 2
+ CG2R61 CG2R61 CG2RC0 NG2R51 9 180.000000 12.552000 2
+ CG2R61 CG2R61 CG2RC0 NG2RC0 9 180.000000 14.644000 2
+ CG2R61 CG2R61 CG2RC0 NG3C51 9 180.000000 25.104000 2
+ CG2R61 CG2R61 CG2RC0 OG2R50 9 180.000000 0.000000 2
+ CG2R61 CG2R61 CG2RC0 OG3C51 9 180.000000 8.368000 2
+ CG2R61 CG2R61 CG2RC0 SG2R50 9 180.000000 0.000000 2
+ NG2R62 CG2R61 CG2RC0 CG2RC0 9 180.000000 9.204800 2
+ NG2R62 CG2R61 CG2RC0 NG2R50 9 180.000000 0.000000 2
+ NG2R62 CG2R61 CG2RC0 NG2R51 9 180.000000 0.000000 2
+ HGR61 CG2R61 CG2RC0 CG25C1 9 180.000000 12.552000 2
+ HGR61 CG2R61 CG2RC0 CG25C2 9 180.000000 12.552000 2
+ HGR61 CG2R61 CG2RC0 CG2R51 9 180.000000 16.736000 2
+ HGR61 CG2R61 CG2RC0 CG2R52 9 180.000000 0.000000 2
+ HGR61 CG2R61 CG2RC0 CG2R67 9 180.000000 12.552000 2
+ HGR61 CG2R61 CG2RC0 CG2RC0 9 180.000000 12.552000 2
+ HGR61 CG2R61 CG2RC0 CG3C52 9 180.000000 0.000000 2
+ HGR61 CG2R61 CG2RC0 NG2R50 9 180.000000 3.347200 2
+ HGR61 CG2R61 CG2RC0 NG2R51 9 180.000000 12.552000 2
+ HGR61 CG2R61 CG2RC0 NG2RC0 9 180.000000 0.000000 2
+ HGR61 CG2R61 CG2RC0 NG3C51 9 180.000000 0.000000 2
+ HGR61 CG2R61 CG2RC0 OG2R50 9 180.000000 0.000000 2
+ HGR61 CG2R61 CG2RC0 OG3C51 9 180.000000 10.041600 2
+ HGR61 CG2R61 CG2RC0 SG2R50 9 180.000000 0.000000 2
+ HGR62 CG2R61 CG2RC0 CG25C1 9 180.000000 10.041600 2
+ HGR62 CG2R61 CG2RC0 CG25C2 9 180.000000 10.041600 2
+ HGR62 CG2R61 CG2RC0 CG2RC0 9 180.000000 17.572800 2
+ HGR62 CG2R61 CG2RC0 NG2R50 9 180.000000 4.184000 2
+ HGR62 CG2R61 CG2RC0 NG2R51 9 180.000000 0.000000 2
+ CG2R61 CG2R61 CG311 CG2O3 9 180.000000 0.962320 2
+ CG2R61 CG2R61 CG311 CG321 9 180.000000 0.962320 2
+ CG2R61 CG2R61 CG311 CG331 9 180.000000 0.962320 2
+ CG2R61 CG2R61 CG311 HGA1 9 180.000000 0.418400 6
+ CG2R61 CG2R61 CG312 PG1 9 180.000000 0.627600 2
+ CG2R61 CG2R61 CG312 PG2 9 180.000000 0.627600 2
+ CG2R61 CG2R61 CG312 FGA2 9 0.000000 1.255200 2
+ CG2R61 CG2R61 CG321 CG2R61 9 180.000000 0.962320 2
+ CG2R61 CG2R61 CG321 CG311 9 180.000000 0.962320 2
+ CG2R61 CG2R61 CG321 CG314 9 180.000000 0.962320 2
+ CG2R61 CG2R61 CG321 CG321 9 180.000000 0.962320 2
+ CG2R61 CG2R61 CG321 CG331 9 180.000000 0.962320 2
+ CG2R61 CG2R61 CG321 NG2S1 9 0.000000 0.497896 2
+ CG2R61 CG2R61 CG321 NG2S1 9 180.000000 0.552288 4
+ CG2R61 CG2R61 CG321 NG2S1 9 180.000000 0.054392 6
+ CG2R61 CG2R61 CG321 OG302 9 0.000000 0.000000 2
+ CG2R61 CG2R61 CG321 OG311 9 0.000000 0.000000 2
+ CG2R61 CG2R61 CG321 PG1 9 180.000000 0.836800 2
+ CG2R61 CG2R61 CG321 PG2 9 180.000000 0.836800 2
+ CG2R61 CG2R61 CG321 HGA2 9 0.000000 0.008368 6
+ NG2R60 CG2R61 CG321 CG321 9 180.000000 0.962320 2
+ NG2R60 CG2R61 CG321 HGA2 9 0.000000 0.008368 6
+ CG2R61 CG2R61 CG324 NG3P1 9 180.000000 0.627600 2
+ CG2R61 CG2R61 CG324 HGA2 9 0.000000 0.000000 2
+ CG2R61 CG2R61 CG331 HGA3 9 0.000000 0.008368 6
+ CG2R66 CG2R61 CG331 HGA3 9 0.000000 0.008368 6
+ NG2R60 CG2R61 CG331 HGA3 9 180.000000 0.012552 6
+ CG2R61 CG2R61 NG2O1 OG2N1 9 180.000000 3.765600 2
+ CG2R61 CG2R61 NG2R60 CG2R61 9 180.000000 5.020800 2
+ CG2R61 CG2R61 NG2R60 CG2R64 9 180.000000 5.020800 2
+ CG2R61 CG2R61 NG2R60 CG2R67 9 180.000000 5.020800 2
+ CG2R64 CG2R61 NG2R60 CG2R61 9 180.000000 9.204800 2
+ CG2R66 CG2R61 NG2R60 CG2R61 9 180.000000 5.020800 2
+ CG2R67 CG2R61 NG2R60 CG2R61 9 180.000000 5.020800 2
+ CG321 CG2R61 NG2R60 CG2R61 9 180.000000 12.970400 2
+ CG331 CG2R61 NG2R60 CG2R61 9 180.000000 12.970400 2
+ CG331 CG2R61 NG2R60 CG2R64 9 180.000000 12.970400 2
+ BRGR1 CG2R61 NG2R60 CG2R61 9 180.000000 12.552000 2
+ HGR62 CG2R61 NG2R60 CG2R61 9 180.000000 24.267200 2
+ HGR62 CG2R61 NG2R60 CG2R64 9 180.000000 24.267200 2
+ HGR62 CG2R61 NG2R60 CG2R67 9 180.000000 21.966000 2
+ CG2R61 CG2R61 NG2R61 CG2R63 9 180.000000 2.092000 2
+ CG2R61 CG2R61 NG2R61 HGP1 9 180.000000 4.184000 2
+ HGR62 CG2R61 NG2R61 CG2R63 9 180.000000 19.246400 2
+ HGR62 CG2R61 NG2R61 HGP1 9 180.000000 5.020800 2
+ CG2R61 CG2R61 NG2R62 CG2R64 9 180.000000 8.368000 2
+ CG2R61 CG2R61 NG2R62 NG2R62 9 180.000000 3.347200 2
+ CG2RC0 CG2R61 NG2R62 CG2R64 9 180.000000 9.204800 2
+ HGR62 CG2R61 NG2R62 CG2R64 9 180.000000 30.543200 2
+ HGR62 CG2R61 NG2R62 NG2R62 9 180.000000 11.715200 2
+ CG2R61 CG2R61 NG2RC0 CG2R51 9 180.000000 0.000000 2
+ CG2R61 CG2R61 NG2RC0 CG2RC0 9 180.000000 2.092000 2
+ HGR62 CG2R61 NG2RC0 CG2R51 9 180.000000 0.000000 2
+ HGR62 CG2R61 NG2RC0 CG2RC0 9 180.000000 7.949600 2
+ CG2R61 CG2R61 NG2S1 CG2O1 9 180.000000 5.020800 2
+ CG2R61 CG2R61 NG2S1 HGP1 9 180.000000 2.092000 2
+ CG2R66 CG2R61 NG2S1 CG2O1 9 180.000000 5.020800 2
+ CG2R66 CG2R61 NG2S1 CG2O1 9 180.000000 4.184000 3
+ CG2R66 CG2R61 NG2S1 HGP1 9 180.000000 2.092000 2
+ CG2R61 CG2R61 NG2S3 HGP4 9 180.000000 5.648400 2
+ CG2R61 CG2R61 NG311 CG2R61 9 0.000000 1.840960 2
+ CG2R61 CG2R61 NG311 CG321 9 180.000000 5.020800 2
+ CG2R61 CG2R61 NG311 CG321 9 0.000000 1.255200 4
+ CG2R61 CG2R61 NG311 SG3O2 9 180.000000 0.836800 2
+ CG2R61 CG2R61 NG311 HGP1 9 180.000000 2.092000 2
+ CG2R61 CG2R61 NG311 HGPAM1 9 180.000000 1.338880 2
+ CG2R61 CG2R61 NG3N1 NG3N1 9 180.000000 9.916080 2
+ CG2R61 CG2R61 NG3N1 HGP1 9 0.000000 0.000000 2
+ CG2R61 CG2R61 OG301 CG2R61 9 180.000000 5.020800 2
+ CG2R61 CG2R61 OG301 CG321 9 180.000000 6.778080 2
+ CG2R61 CG2R61 OG301 CG321 9 180.000000 0.794960 4
+ CG2R61 CG2R61 OG301 CG331 9 180.000000 7.280160 2
+ CG2R61 CG2R61 OG303 PG1 9 180.000000 5.857600 2
+ CG2R61 CG2R61 OG303 SG3O2 9 180.000000 2.133840 2
+ CG2R61 CG2R61 OG303 SG3O2 9 0.000000 0.627600 4
+ CG2R61 CG2R61 OG311 HGP1 9 180.000000 4.142160 2
+ CG2R64 CG2R61 OG311 HGP1 9 180.000000 4.142160 2
+ CG2R61 CG2R61 OG3R60 CG2R61 9 0.000000 3.179840 2
+ CG2R61 CG2R61 SG311 CG2R61 9 0.000000 7.322000 2
+ CG2R61 CG2R61 SG3O1 OG2P1 9 0.000000 0.016736 6
+ CG2R61 CG2R61 SG3O2 NG311 9 0.000000 0.920480 2
+ CG2R61 CG2R61 SG3O2 NG321 9 0.000000 1.464400 2
+ CG2R61 CG2R61 SG3O2 OG2P1 9 0.000000 0.000000 6
+ CG2O1 CG2R62 CG2R62 CG2R62 9 180.000000 12.552000 2
+ CG2O1 CG2R62 CG2R62 NG2R61 9 180.000000 10.460000 2
+ CG2O1 CG2R62 CG2R62 HGR63 9 180.000000 4.184000 2
+ CG2R61 CG2R62 CG2R62 CG2R61 9 180.000000 10.460000 2
+ CG2R61 CG2R62 CG2R62 CG2R62 9 180.000000 8.368000 2
+ CG2R61 CG2R62 CG2R62 CG2R63 9 180.000000 15.480800 2
+ CG2R61 CG2R62 CG2R62 NG2R61 9 180.000000 14.644000 2
+ CG2R61 CG2R62 CG2R62 NG2R62 9 180.000000 12.970400 2
+ CG2R61 CG2R62 CG2R62 OG3R60 9 180.000000 16.317600 2
+ CG2R61 CG2R62 CG2R62 HGR62 9 180.000000 4.184000 2
+ CG2R62 CG2R62 CG2R62 CG2R62 9 180.000000 25.104000 2
+ CG2R62 CG2R62 CG2R62 CG2R63 9 180.000000 12.552000 2
+ CG2R62 CG2R62 CG2R62 NG2R61 9 180.000000 29.288000 2
+ CG2R62 CG2R62 CG2R62 NG2R67 9 180.000000 14.644000 2
+ CG2R62 CG2R62 CG2R62 OG3R60 9 180.000000 1.673600 2
+ CG2R62 CG2R62 CG2R62 HGR62 9 180.000000 4.184000 2
+ CG2R62 CG2R62 CG2R62 HGR63 9 180.000000 4.184000 2
+ CG2R63 CG2R62 CG2R62 NG2R61 9 180.000000 12.552000 2
+ CG2R63 CG2R62 CG2R62 NG2R62 9 180.000000 2.092000 2
+ CG2R63 CG2R62 CG2R62 NG2R67 9 180.000000 12.552000 2
+ CG2R63 CG2R62 CG2R62 HGR62 9 180.000000 4.184000 2
+ CG2R64 CG2R62 CG2R62 NG2R61 9 180.000000 25.104000 2
+ CG2R64 CG2R62 CG2R62 HGR62 9 180.000000 16.736000 2
+ CG331 CG2R62 CG2R62 NG2R61 9 180.000000 16.736000 2
+ CG331 CG2R62 CG2R62 HGR62 9 180.000000 16.736000 2
+ NG2R61 CG2R62 CG2R62 HGR62 9 180.000000 14.225600 2
+ NG2R61 CG2R62 CG2R62 HGR63 9 180.000000 29.288000 2
+ NG2R62 CG2R62 CG2R62 HGR62 9 180.000000 25.104000 2
+ NG2R67 CG2R62 CG2R62 HGR62 9 180.000000 14.225600 2
+ HGR62 CG2R62 CG2R62 HGR62 9 180.000000 12.552000 2
+ HGR63 CG2R62 CG2R62 HGR63 9 180.000000 8.368000 2
+ CG2R61 CG2R62 CG2R63 NG2R61 9 180.000000 7.531200 2
+ CG2R61 CG2R62 CG2R63 OG2D4 9 180.000000 4.184000 2
+ CG2R61 CG2R62 CG2R63 SG2D1 9 180.000000 18.828000 2
+ CG2R62 CG2R62 CG2R63 CG2R62 9 180.000000 6.694400 2
+ CG2R62 CG2R62 CG2R63 NG2R61 9 180.000000 7.531200 2
+ CG2R62 CG2R62 CG2R63 NG2R67 9 180.000000 7.531200 2
+ CG2R62 CG2R62 CG2R63 OG2D4 9 180.000000 4.184000 2
+ CG2R62 CG2R62 CG2R63 OG3R60 9 180.000000 1.673600 2
+ CG2R62 CG2R62 CG2R63 SG2D1 9 180.000000 18.828000 2
+ CG331 CG2R62 CG2R63 NG2R61 9 180.000000 23.430400 2
+ CG331 CG2R62 CG2R63 OG2D4 9 180.000000 4.184000 2
+ HGR62 CG2R62 CG2R63 CG2R62 9 180.000000 2.092000 2
+ HGR62 CG2R62 CG2R63 NG2R61 9 180.000000 4.184000 2
+ HGR62 CG2R62 CG2R63 NG2R67 9 180.000000 3.347200 2
+ HGR62 CG2R62 CG2R63 OG2D4 9 180.000000 25.104000 2
+ HGR62 CG2R62 CG2R63 OG3R60 9 180.000000 10.041600 2
+ HGR62 CG2R62 CG2R63 SG2D1 9 180.000000 10.041600 2
+ CG2R62 CG2R62 CG2R64 NG2R62 9 180.000000 2.510400 2
+ CG2R62 CG2R62 CG2R64 NG2S3 9 180.000000 8.368000 2
+ HGR62 CG2R62 CG2R64 NG2R62 9 180.000000 14.225600 2
+ HGR62 CG2R62 CG2R64 NG2S3 9 180.000000 8.368000 2
+ CG2R62 CG2R62 CG331 HGA3 9 0.000000 1.924640 3
+ CG2R63 CG2R62 CG331 HGA3 9 0.000000 1.924640 3
+ CG2R61 CG2R62 NG2R61 CG2R63 9 180.000000 2.510400 2
+ CG2R61 CG2R62 NG2R61 HGP1 9 180.000000 4.184000 2
+ CG2R62 CG2R62 NG2R61 CG2R62 9 180.000000 16.736000 2
+ CG2R62 CG2R62 NG2R61 CG2R63 9 180.000000 2.510400 2
+ CG2R62 CG2R62 NG2R61 CG331 9 180.000000 46.024000 2
+ CG2R62 CG2R62 NG2R61 CG3C51 9 180.000000 46.024000 2
+ CG2R62 CG2R62 NG2R61 CG3C53 9 180.000000 46.024000 2
+ CG2R62 CG2R62 NG2R61 CG3RC1 9 180.000000 4.184000 2
+ CG2R62 CG2R62 NG2R61 HGP1 9 180.000000 4.184000 2
+ CG2R62 CG2R62 NG2R61 HGP2 9 180.000000 4.184000 2
+ HGR62 CG2R62 NG2R61 CG2R62 9 180.000000 23.430400 2
+ HGR62 CG2R62 NG2R61 CG2R63 9 180.000000 19.246400 2
+ HGR62 CG2R62 NG2R61 CG331 9 180.000000 1.255200 2
+ HGR62 CG2R62 NG2R61 CG3C51 9 180.000000 1.255200 2
+ HGR62 CG2R62 NG2R61 CG3RC1 9 180.000000 4.184000 2
+ HGR62 CG2R62 NG2R61 HGP1 9 180.000000 5.020800 2
+ HGR63 CG2R62 NG2R61 CG2R62 9 180.000000 29.288000 2
+ HGR63 CG2R62 NG2R61 CG3C53 9 180.000000 4.184000 2
+ HGR63 CG2R62 NG2R61 HGP2 9 180.000000 12.552000 2
+ CG2R61 CG2R62 NG2R62 CG2R64 9 180.000000 8.368000 2
+ CG2R62 CG2R62 NG2R62 CG2R64 9 180.000000 2.092000 2
+ HGR62 CG2R62 NG2R62 CG2R64 9 180.000000 30.543200 2
+ CG2R62 CG2R62 NG2R67 CG2R62 9 180.000000 16.736000 2
+ CG2R62 CG2R62 NG2R67 CG2R63 9 180.000000 2.510400 2
+ CG2R62 CG2R62 NG2R67 CG2R67 9 180.000000 16.736000 2
+ HGR62 CG2R62 NG2R67 CG2R62 9 180.000000 11.715200 2
+ HGR62 CG2R62 NG2R67 CG2R63 9 180.000000 19.246400 2
+ HGR62 CG2R62 NG2R67 CG2R67 9 180.000000 4.184000 2
+ CG2R61 CG2R62 OG3R60 CG2R63 9 0.000000 3.179840 2
+ CG2R62 CG2R62 OG3R60 CG2R63 9 0.000000 3.932960 2
+ NG2R61 CG2R63 CG2RC0 CG2RC0 9 180.000000 0.836800 2
+ NG2R61 CG2R63 CG2RC0 NG2R50 9 180.000000 8.368000 2
+ OG2D4 CG2R63 CG2RC0 CG2RC0 9 180.000000 58.576000 2
+ OG2D4 CG2R63 CG2RC0 NG2R50 9 180.000000 0.000000 2
+ CG2R61 CG2R63 NG2R61 CG2R63 9 180.000000 2.092000 2
+ CG2R61 CG2R63 NG2R61 CG2R64 9 180.000000 6.276000 2
+ CG2R61 CG2R63 NG2R61 HGP1 9 180.000000 20.083200 2
+ CG2R62 CG2R63 NG2R61 CG2R62 9 180.000000 6.276000 2
+ CG2R62 CG2R63 NG2R61 CG2R63 9 180.000000 6.276000 2
+ CG2R62 CG2R63 NG2R61 CG2R64 9 180.000000 2.092000 2
+ CG2R62 CG2R63 NG2R61 HGP1 9 180.000000 20.083200 2
+ CG2RC0 CG2R63 NG2R61 CG2R64 9 180.000000 0.836800 2
+ CG2RC0 CG2R63 NG2R61 HGP1 9 180.000000 15.062400 2
+ NG2R61 CG2R63 NG2R61 CG2R61 9 180.000000 2.092000 2
+ NG2R61 CG2R63 NG2R61 CG2R62 9 180.000000 6.276000 2
+ NG2R61 CG2R63 NG2R61 CG2R63 9 180.000000 12.552000 2
+ NG2R61 CG2R63 NG2R61 CG331 9 180.000000 46.024000 2
+ NG2R61 CG2R63 NG2R61 CG3C51 9 180.000000 46.024000 2
+ NG2R61 CG2R63 NG2R61 CG3RC1 9 180.000000 4.184000 2
+ NG2R61 CG2R63 NG2R61 HGP1 9 180.000000 13.807200 2
+ NG2R62 CG2R63 NG2R61 CG2R62 9 180.000000 2.510400 2
+ NG2R62 CG2R63 NG2R61 CG3C51 9 180.000000 46.024000 2
+ NG2R62 CG2R63 NG2R61 CG3RC1 9 180.000000 3.765600 2
+ NG2R67 CG2R63 NG2R61 CG2R61 9 180.000000 6.276000 2
+ NG2R67 CG2R63 NG2R61 CG2R62 9 180.000000 6.276000 2
+ NG2R67 CG2R63 NG2R61 HGP1 9 180.000000 13.807200 2
+ OG2D4 CG2R63 NG2R61 CG2R62 9 180.000000 6.694400 2
+ OG2D4 CG2R63 NG2R61 CG2R63 9 180.000000 3.765600 2
+ OG2D4 CG2R63 NG2R61 CG2R64 9 180.000000 58.576000 2
+ OG2D4 CG2R63 NG2R61 CG331 9 180.000000 46.024000 2
+ OG2D4 CG2R63 NG2R61 CG3C51 9 180.000000 46.024000 2
+ OG2D4 CG2R63 NG2R61 CG3RC1 9 180.000000 4.184000 2
+ OG2D4 CG2R63 NG2R61 HGP1 9 180.000000 0.000000 2
+ SG2D1 CG2R63 NG2R61 CG2R61 9 180.000000 6.694400 2
+ SG2D1 CG2R63 NG2R61 CG2R62 9 180.000000 6.694400 2
+ SG2D1 CG2R63 NG2R61 CG2R63 9 180.000000 3.765600 2
+ SG2D1 CG2R63 NG2R61 CG2R64 9 180.000000 58.576000 2
+ SG2D1 CG2R63 NG2R61 HGP1 9 180.000000 2.092000 2
+ NG2R61 CG2R63 NG2R62 CG2R64 9 180.000000 2.510400 2
+ OG2D4 CG2R63 NG2R62 CG2R64 9 180.000000 6.694400 2
+ CG2R61 CG2R63 NG2R67 CG2R63 9 180.000000 6.276000 2
+ CG2R61 CG2R63 NG2R67 CG2R64 9 180.000000 6.276000 2
+ CG2R61 CG2R63 NG2R67 CG2R67 9 180.000000 6.276000 2
+ CG2R62 CG2R63 NG2R67 CG2R62 9 180.000000 6.276000 2
+ CG2R62 CG2R63 NG2R67 CG2R63 9 180.000000 6.276000 2
+ CG2R62 CG2R63 NG2R67 CG2R64 9 180.000000 2.092000 2
+ CG2R62 CG2R63 NG2R67 CG2R67 9 180.000000 6.276000 2
+ NG2R61 CG2R63 NG2R67 CG2R63 9 180.000000 12.552000 2
+ NG2R61 CG2R63 NG2R67 CG2R67 9 180.000000 46.024000 2
+ OG2D4 CG2R63 NG2R67 CG2R62 9 180.000000 6.694400 2
+ OG2D4 CG2R63 NG2R67 CG2R63 9 180.000000 3.765600 2
+ OG2D4 CG2R63 NG2R67 CG2R64 9 180.000000 58.576000 2
+ OG2D4 CG2R63 NG2R67 CG2R67 9 180.000000 6.694400 2
+ SG2D1 CG2R63 NG2R67 CG2R63 9 180.000000 3.765600 2
+ SG2D1 CG2R63 NG2R67 CG2R64 9 180.000000 3.765600 2
+ SG2D1 CG2R63 NG2R67 CG2R67 9 180.000000 6.694400 2
+ CG2R62 CG2R63 OG3R60 CG2R62 9 0.000000 2.510400 2
+ OG2D4 CG2R63 OG3R60 CG2R62 9 0.000000 3.179840 2
+ NG2R62 CG2R64 CG2RC0 CG2RC0 9 180.000000 7.531200 2
+ NG2R62 CG2R64 CG2RC0 NG2R50 9 180.000000 8.368000 2
+ NG2S3 CG2R64 CG2RC0 CG2RC0 9 180.000000 16.736000 2
+ NG2S3 CG2R64 CG2RC0 NG2R50 9 180.000000 0.000000 2
+ CG2R61 CG2R64 NG2R60 CG2R61 9 180.000000 5.020800 2
+ NG2S1 CG2R64 NG2R60 CG2R61 9 180.000000 12.970400 2
+ NG2R62 CG2R64 NG2R61 CG2R63 9 180.000000 0.836800 2
+ NG2R62 CG2R64 NG2R61 HGP1 9 180.000000 15.062400 2
+ NG2S3 CG2R64 NG2R61 CG2R63 9 180.000000 16.736000 2
+ NG2S3 CG2R64 NG2R61 HGP1 9 180.000000 0.000000 2
+ SG311 CG2R64 NG2R61 CG2R63 9 180.000000 16.736000 2
+ SG311 CG2R64 NG2R61 HGP1 9 180.000000 0.000000 2
+ HGR62 CG2R64 NG2R61 CG2R63 9 180.000000 23.012000 2
+ HGR62 CG2R64 NG2R61 HGP1 9 180.000000 2.092000 2
+ CG2R61 CG2R64 NG2R62 CG2R61 9 180.000000 8.368000 2
+ CG2R61 CG2R64 NG2R62 CG2R64 9 0.000000 8.368000 2
+ CG2R62 CG2R64 NG2R62 CG2R63 9 180.000000 25.104000 2
+ CG2RC0 CG2R64 NG2R62 CG2R64 9 180.000000 7.531200 2
+ NG2R61 CG2R64 NG2R62 CG2R61 9 180.000000 8.368000 2
+ NG2R61 CG2R64 NG2R62 CG2R62 9 180.000000 16.736000 2
+ NG2R61 CG2R64 NG2R62 CG2RC0 9 180.000000 8.368000 2
+ NG2R62 CG2R64 NG2R62 CG2R61 9 180.000000 8.368000 2
+ NG2R62 CG2R64 NG2R62 CG2R64 9 180.000000 7.531200 2
+ NG2R62 CG2R64 NG2R62 CG2RC0 9 180.000000 8.368000 2
+ NG2R62 CG2R64 NG2R62 NG2R62 9 180.000000 2.092000 2
+ NG2R67 CG2R64 NG2R62 CG2R61 9 180.000000 8.368000 2
+ NG2R67 CG2R64 NG2R62 CG2R62 9 180.000000 16.736000 2
+ NG2S3 CG2R64 NG2R62 CG2R63 9 180.000000 8.368000 2
+ NG2S3 CG2R64 NG2R62 CG2R64 9 180.000000 7.531200 2
+ NG2S3 CG2R64 NG2R62 CG2RC0 9 180.000000 16.736000 2
+ SG311 CG2R64 NG2R62 CG2R61 9 180.000000 42.676800 2
+ SG311 CG2R64 NG2R62 CG2R62 9 180.000000 8.368000 2
+ HGR62 CG2R64 NG2R62 CG2R61 9 180.000000 30.543200 2
+ HGR62 CG2R64 NG2R62 CG2R62 9 180.000000 30.543200 2
+ HGR62 CG2R64 NG2R62 CG2R64 9 180.000000 35.564000 2
+ HGR62 CG2R64 NG2R62 CG2RC0 9 180.000000 35.564000 2
+ HGR62 CG2R64 NG2R62 NG2R62 9 180.000000 25.104000 2
+ NG2R62 CG2R64 NG2R67 CG2R63 9 180.000000 0.836800 2
+ NG2R62 CG2R64 NG2R67 CG2R67 9 180.000000 0.836800 2
+ HGR62 CG2R64 NG2R67 CG2R63 9 180.000000 23.012000 2
+ HGR62 CG2R64 NG2R67 CG2R67 9 180.000000 4.184000 2
+ CG2R61 CG2R64 NG2S1 CG2O1 9 180.000000 5.020800 2
+ CG2R61 CG2R64 NG2S1 HGP1 9 180.000000 2.092000 2
+ NG2R60 CG2R64 NG2S1 CG2O1 9 180.000000 6.276000 1
+ NG2R60 CG2R64 NG2S1 CG2O1 9 180.000000 10.878400 2
+ NG2R60 CG2R64 NG2S1 CG2O1 9 180.000000 0.753120 3
+ NG2R60 CG2R64 NG2S1 HGP1 9 180.000000 2.092000 2
+ CG2R62 CG2R64 NG2S3 HGP4 9 180.000000 8.368000 2
+ CG2RC0 CG2R64 NG2S3 HGP4 9 180.000000 2.092000 2
+ NG2R61 CG2R64 NG2S3 HGP4 9 180.000000 5.020800 2
+ NG2R62 CG2R64 NG2S3 HGP4 9 180.000000 4.184000 2
+ NG2R61 CG2R64 SG311 CG331 9 0.000000 6.066800 1
+ NG2R62 CG2R64 SG311 CG331 9 180.000000 8.870080 2
+ NG2R62 CG2R64 SG311 CG331 9 180.000000 0.794960 4
+ CG2R61 CG2R67 CG2R67 CG2R61 9 180.000000 3.723760 2
+ CG2R61 CG2R67 CG2R67 CG2RC0 9 180.000000 8.368000 2
+ CG2R61 CG2R67 CG2R67 NG2R60 9 0.000000 1.569000 1
+ CG2R61 CG2R67 CG2R67 NG2R60 9 180.000000 3.932960 2
+ CG2R61 CG2R67 CG2R67 NG2R60 9 180.000000 0.794960 3
+ CG2R61 CG2R67 CG2R67 NG2R60 9 0.000000 0.669440 4
+ CG2RC0 CG2R67 CG2R67 CG2RC0 9 180.000000 6.276000 2
+ NG2R60 CG2R67 CG2R67 NG2R60 9 180.000000 1.569000 1
+ NG2R60 CG2R67 CG2R67 NG2R60 9 180.000000 3.932960 2
+ NG2R60 CG2R67 CG2R67 NG2R60 9 0.000000 0.794960 3
+ NG2R60 CG2R67 CG2R67 NG2R60 9 0.000000 0.669440 4
+ CG2R61 CG2R67 CG2RC0 CG2R61 9 180.000000 0.209200 2
+ CG2R61 CG2R67 CG2RC0 CG3C52 9 180.000000 28.242000 2
+ CG2R61 CG2R67 CG2RC0 NG2R51 9 180.000000 12.552000 2
+ CG2R67 CG2R67 CG2RC0 CG2R61 9 180.000000 14.644000 2
+ CG2R67 CG2R67 CG2RC0 CG3C52 9 180.000000 20.920000 3
+ CG2R67 CG2R67 CG2RC0 NG2R51 9 180.000000 1.046000 2
+ CG2R61 CG2R67 NG2R60 CG2R61 9 180.000000 5.020800 2
+ CG2R67 CG2R67 NG2R60 CG2R61 9 180.000000 12.970400 2
+ CG2R61 CG2R67 NG2R67 CG2R62 9 180.000000 1.548080 2
+ CG2R61 CG2R67 NG2R67 CG2R62 9 0.000000 1.129680 4
+ CG2R61 CG2R67 NG2R67 CG2R62 9 0.000000 0.083680 6
+ CG2R61 CG2R67 NG2R67 CG2R63 9 180.000000 6.066800 2
+ CG2R61 CG2R67 NG2R67 CG2R63 9 180.000000 0.585760 4
+ CG2R61 CG2R67 NG2R67 CG2R64 9 180.000000 1.548080 2
+ CG2R61 CG2R67 NG2R67 CG2R64 9 0.000000 1.087840 4
+ CG2R71 CG2R71 CG2R71 CG2R71 9 180.000000 6.694400 2
+ CG2R71 CG2R71 CG2R71 CG2RC7 9 180.000000 6.694400 2
+ CG2R71 CG2R71 CG2R71 HGR71 9 180.000000 13.388800 2
+ CG2RC7 CG2R71 CG2R71 HGR71 9 180.000000 17.572800 2
+ HGR71 CG2R71 CG2R71 HGR71 9 180.000000 10.041600 2
+ CG2R71 CG2R71 CG2RC7 CG2R51 9 180.000000 12.552000 2
+ CG2R71 CG2R71 CG2RC7 CG2RC7 9 180.000000 12.552000 2
+ HGR71 CG2R71 CG2RC7 CG2R51 9 180.000000 12.970400 2
+ HGR71 CG2R71 CG2RC7 CG2RC7 9 180.000000 12.970400 2
+ CG25C1 CG2RC0 CG2RC0 CG2R61 9 180.000000 6.276000 2
+ CG25C1 CG2RC0 CG2RC0 NG2R51 9 180.000000 4.184000 2
+ CG25C2 CG2RC0 CG2RC0 CG2R61 9 180.000000 6.276000 2
+ CG25C2 CG2RC0 CG2RC0 NG2R51 9 180.000000 4.184000 2
+ CG2R51 CG2RC0 CG2RC0 CG2R51 9 180.000000 0.000000 2
+ CG2R51 CG2RC0 CG2RC0 CG2R61 9 180.000000 6.276000 2
+ CG2R51 CG2RC0 CG2RC0 CG3C52 9 180.000000 20.920000 2
+ CG2R51 CG2RC0 CG2RC0 NG2R51 9 180.000000 27.196000 2
+ CG2R51 CG2RC0 CG2RC0 OG2R50 9 180.000000 35.564000 2
+ CG2R51 CG2RC0 CG2RC0 SG2R50 9 180.000000 35.564000 2
+ CG2R52 CG2RC0 CG2RC0 CG2R61 9 180.000000 6.276000 2
+ CG2R52 CG2RC0 CG2RC0 NG2R51 9 180.000000 50.208000 2
+ CG2R61 CG2RC0 CG2RC0 CG2R61 9 180.000000 12.552000 2
+ CG2R61 CG2RC0 CG2RC0 CG3C52 9 180.000000 27.196000 2
+ CG2R61 CG2RC0 CG2RC0 NG2R50 9 180.000000 6.276000 2
+ CG2R61 CG2RC0 CG2RC0 NG2R51 9 180.000000 6.276000 2
+ CG2R61 CG2RC0 CG2RC0 NG2R62 9 180.000000 0.000000 2
+ CG2R61 CG2RC0 CG2RC0 NG3C51 9 180.000000 25.104000 2
+ CG2R61 CG2RC0 CG2RC0 OG2R50 9 180.000000 0.000000 2
+ CG2R61 CG2RC0 CG2RC0 OG3C51 9 180.000000 16.736000 2
+ CG2R61 CG2RC0 CG2RC0 SG2R50 9 180.000000 0.000000 2
+ CG2R63 CG2RC0 CG2RC0 NG2R51 9 180.000000 41.840000 2
+ CG2R63 CG2RC0 CG2RC0 NG2R62 9 180.000000 8.368000 2
+ CG2R64 CG2RC0 CG2RC0 NG2R51 9 180.000000 29.288000 2
+ CG2R64 CG2RC0 CG2RC0 NG2R62 9 180.000000 8.368000 2
+ CG3C52 CG2RC0 CG2RC0 NG2R50 9 180.000000 27.196000 2
+ CG3C52 CG2RC0 CG2RC0 NG3C51 9 180.000000 25.104000 2
+ NG2R50 CG2RC0 CG2RC0 NG2R51 9 180.000000 41.840000 2
+ NG2R50 CG2RC0 CG2RC0 NG2R62 9 180.000000 29.288000 2
+ NG2R50 CG2RC0 CG2RC0 SG2R50 9 180.000000 16.736000 2
+ NG2R51 CG2RC0 CG2RC0 NG2R62 9 180.000000 35.564000 2
+ OG3C51 CG2RC0 CG2RC0 OG3C51 9 180.000000 32.216800 2
+ CG2R61 CG2RC0 CG3C52 CG2R51 9 0.000000 3.765600 3
+ CG2R61 CG2RC0 CG3C52 CG2R52 9 0.000000 14.644000 3
+ CG2R61 CG2RC0 CG3C52 CG2RC0 9 0.000000 3.765600 3
+ CG2R61 CG2RC0 CG3C52 CG3C52 9 180.000000 12.552000 2
+ CG2R61 CG2RC0 CG3C52 HGA2 9 180.000000 2.092000 3
+ CG2R67 CG2RC0 CG3C52 CG2RC0 9 180.000000 3.138000 3
+ CG2R67 CG2RC0 CG3C52 HGA2 9 0.000000 2.092000 3
+ CG2RC0 CG2RC0 CG3C52 CG2R51 9 180.000000 4.184000 3
+ CG2RC0 CG2RC0 CG3C52 CG2R52 9 180.000000 8.368000 3
+ CG2RC0 CG2RC0 CG3C52 CG3C52 9 180.000000 4.309520 3
+ CG2RC0 CG2RC0 CG3C52 HGA2 9 0.000000 2.092000 3
+ CG2R61 CG2RC0 NG2R50 CG2R52 9 180.000000 16.736000 2
+ CG2R61 CG2RC0 NG2R50 CG2R53 9 180.000000 62.760000 2
+ CG2R63 CG2RC0 NG2R50 CG2R53 9 180.000000 8.368000 2
+ CG2R64 CG2RC0 NG2R50 CG2R53 9 180.000000 8.368000 2
+ CG2RC0 CG2RC0 NG2R50 CG2R52 9 180.000000 16.736000 2
+ CG2RC0 CG2RC0 NG2R50 CG2R53 9 180.000000 25.104000 2
+ NG2R62 CG2RC0 NG2R50 CG2R53 9 180.000000 8.368000 2
+ CG2R61 CG2RC0 NG2R51 CG2R51 9 180.000000 6.276000 2
+ CG2R61 CG2RC0 NG2R51 CG2R53 9 180.000000 79.496000 2
+ CG2R61 CG2RC0 NG2R51 CG2RC0 9 180.000000 2.092000 2
+ CG2R61 CG2RC0 NG2R51 NG2R50 9 180.000000 12.552000 2
+ CG2R61 CG2RC0 NG2R51 HGP1 9 180.000000 0.836800 2
+ CG2R67 CG2RC0 NG2R51 CG2RC0 9 180.000000 2.092000 2
+ CG2R67 CG2RC0 NG2R51 HGP1 9 180.000000 1.046000 2
+ CG2RC0 CG2RC0 NG2R51 CG2R51 9 180.000000 6.276000 2
+ CG2RC0 CG2RC0 NG2R51 CG2R53 9 180.000000 25.104000 2
+ CG2RC0 CG2RC0 NG2R51 CG331 9 180.000000 46.024000 2
+ CG2RC0 CG2RC0 NG2R51 CG3C51 9 180.000000 46.024000 2
+ CG2RC0 CG2RC0 NG2R51 CG3RC1 9 180.000000 5.020800 2
+ CG2RC0 CG2RC0 NG2R51 NG2R50 9 180.000000 27.196000 2
+ CG2RC0 CG2RC0 NG2R51 HGP1 9 180.000000 3.556400 2
+ NG2R62 CG2RC0 NG2R51 CG2R53 9 180.000000 8.368000 2
+ NG2R62 CG2RC0 NG2R51 CG331 9 180.000000 46.024000 2
+ NG2R62 CG2RC0 NG2R51 CG3C51 9 180.000000 46.024000 2
+ NG2R62 CG2RC0 NG2R51 CG3RC1 9 180.000000 5.020800 2
+ NG2R62 CG2RC0 NG2R51 HGP1 9 180.000000 5.020800 2
+ CG2RC0 CG2RC0 NG2R62 CG2R64 9 180.000000 0.836800 2
+ NG2R50 CG2RC0 NG2R62 CG2R64 9 180.000000 8.368000 2
+ NG2R51 CG2RC0 NG2R62 CG2R64 9 180.000000 8.368000 2
+ CG2R51 CG2RC0 NG2RC0 CG2R51 9 180.000000 33.472000 2
+ CG2R51 CG2RC0 NG2RC0 CG2R61 9 180.000000 4.184000 2
+ CG2R61 CG2RC0 NG2RC0 CG2R51 9 180.000000 4.184000 2
+ CG2R61 CG2RC0 NG2RC0 CG2R61 9 180.000000 3.347200 2
+ CG2R61 CG2RC0 NG3C51 CG3C52 9 180.000000 16.736000 2
+ CG2R61 CG2RC0 NG3C51 HGP1 9 0.000000 0.000000 3
+ CG2RC0 CG2RC0 NG3C51 CG3C52 9 0.000000 8.200640 3
+ CG2RC0 CG2RC0 NG3C51 HGP1 9 0.000000 0.000000 3
+ CG2R61 CG2RC0 OG2R50 CG2R51 9 180.000000 35.564000 2
+ CG2RC0 CG2RC0 OG2R50 CG2R51 9 180.000000 35.564000 2
+ CG2R61 CG2RC0 OG3C51 CG3C52 9 180.000000 1.255200 2
+ CG2RC0 CG2RC0 OG3C51 CG3C52 9 180.000000 1.255200 2
+ CG2R61 CG2RC0 SG2R50 CG2R51 9 180.000000 35.564000 2
+ CG2R61 CG2RC0 SG2R50 CG2R53 9 180.000000 12.552000 2
+ CG2RC0 CG2RC0 SG2R50 CG2R51 9 180.000000 35.564000 2
+ CG2RC0 CG2RC0 SG2R50 CG2R53 9 180.000000 12.552000 2
+ CG2R51 CG2RC7 CG2RC7 CG2R51 9 180.000000 12.552000 2
+ CG2R51 CG2RC7 CG2RC7 CG2R71 9 180.000000 0.000000 2
+ CG2R71 CG2RC7 CG2RC7 CG2R71 9 180.000000 0.000000 2
+ CG2D1 CG301 CG311 CG311 9 0.000000 0.836800 3
+ CG2D1 CG301 CG311 CG321 9 0.000000 0.836800 3
+ CG2D1 CG301 CG311 HGA1 9 0.000000 0.815880 3
+ CG311 CG301 CG311 CG311 9 0.000000 0.836800 3
+ CG311 CG301 CG311 CG321 9 0.000000 0.836800 3
+ CG311 CG301 CG311 HGA1 9 0.000000 0.815880 3
+ CG321 CG301 CG311 CG311 9 0.000000 0.836800 3
+ CG321 CG301 CG311 CG321 9 0.000000 0.836800 3
+ CG321 CG301 CG311 HGA1 9 0.000000 0.815880 3
+ CG331 CG301 CG311 CG311 9 0.000000 0.836800 3
+ CG331 CG301 CG311 CG321 9 0.000000 0.836800 3
+ CG331 CG301 CG311 HGA1 9 0.000000 0.815880 3
+ CG2D1 CG301 CG321 CG321 9 0.000000 0.836800 3
+ CG2D1 CG301 CG321 HGA2 9 0.000000 0.815880 3
+ CG2DC1 CG301 CG321 CG321 9 0.000000 0.836800 3
+ CG2DC1 CG301 CG321 HGA2 9 0.000000 0.794960 3
+ CG2DC2 CG301 CG321 CG321 9 0.000000 0.836800 3
+ CG2DC2 CG301 CG321 HGA2 9 0.000000 0.794960 3
+ CG311 CG301 CG321 CG321 9 0.000000 0.836800 3
+ CG311 CG301 CG321 HGA2 9 0.000000 0.815880 3
+ CG321 CG301 CG321 CG321 9 0.000000 0.836800 3
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+ CG331 CG301 CG321 CG321 9 0.000000 0.836800 3
+ CG331 CG301 CG321 CG331 9 0.000000 1.840960 1
+ CG331 CG301 CG321 CG331 9 180.000000 0.083680 2
+ CG331 CG301 CG321 CG331 9 180.000000 3.054320 3
+ CG331 CG301 CG321 HGA2 9 0.000000 0.815880 3
+ OG301 CG301 CG321 CG331 9 0.000000 3.347200 3
+ OG301 CG301 CG321 HGA2 9 0.000000 0.669440 3
+ CG2D1 CG301 CG331 HGA3 9 0.000000 0.669440 3
+ CG2DC1 CG301 CG331 HGA3 9 0.000000 0.669440 3
+ CG2DC2 CG301 CG331 HGA3 9 0.000000 0.669440 3
+ CG2O3 CG301 CG331 HGA3 9 0.000000 0.836800 3
+ CG311 CG301 CG331 HGA3 9 0.000000 0.669440 3
+ CG321 CG301 CG331 HGA3 9 0.000000 0.669440 3
+ CG331 CG301 CG331 HGA3 9 0.000000 0.669440 3
+ OG301 CG301 CG331 HGA3 9 0.000000 0.669440 3
+ OG302 CG301 CG331 HGA3 9 0.000000 0.669440 3
+ OG311 CG301 CG331 HGA3 9 0.000000 0.585760 3
+ CLGA3 CG301 CG331 HGA3 9 0.000000 1.129680 3
+ BRGA3 CG301 CG331 HGA3 9 0.000000 1.087840 3
+ CG2O3 CG301 OG301 CG331 9 0.000000 0.836800 3
+ CG321 CG301 OG301 CG331 9 0.000000 4.811600 1
+ CG321 CG301 OG301 CG331 9 180.000000 0.962320 2
+ CG321 CG301 OG301 CG331 9 0.000000 2.050160 3
+ CG331 CG301 OG301 CG331 9 0.000000 1.673600 1
+ CG331 CG301 OG301 CG331 9 0.000000 2.050160 3
+ OG301 CG301 OG301 CG331 9 0.000000 2.133840 1
+ OG301 CG301 OG301 CG331 9 0.000000 2.803280 2
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+ OG311 CG301 OG301 CG331 9 0.000000 3.723760 2
+ OG311 CG301 OG301 CG331 9 0.000000 0.209200 3
+ CG331 CG301 OG302 CG2O2 9 0.000000 0.000000 3
+ CG2O3 CG301 OG311 HGP1 9 180.000000 3.430880 3
+ CG331 CG301 OG311 HGP1 9 0.000000 4.727920 1
+ CG331 CG301 OG311 HGP1 9 0.000000 0.585760 2
+ CG331 CG301 OG311 HGP1 9 0.000000 1.004160 3
+ OG301 CG301 OG311 HGP1 9 0.000000 6.485200 1
+ OG301 CG301 OG311 HGP1 9 0.000000 4.895280 2
+ OG301 CG301 OG311 HGP1 9 0.000000 4.476880 3
+ FGA3 CG302 CG321 OG311 9 0.000000 1.046000 3
+ FGA3 CG302 CG321 HGA2 9 0.000000 0.661072 3
+ FGA3 CG302 CG331 HGA3 9 0.000000 0.661072 3
+ CG2O1 CG311 CG311 CG321 9 0.000000 0.836800 3
+ CG2O1 CG311 CG311 CG331 9 0.000000 0.836800 3
+ CG2O1 CG311 CG311 OG311 9 0.000000 0.836800 3
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+ CG2O3 CG311 CG311 OG311 9 0.000000 0.836800 3
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+ CG301 CG311 CG311 CG311 9 0.000000 0.836800 3
+ CG301 CG311 CG311 CG321 9 0.000000 0.836800 3
+ CG301 CG311 CG311 CG3RC1 9 0.000000 0.836800 3
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+ CG311 CG311 CG311 CG321 9 180.000000 2.092000 4
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+ CG311 CG311 CG311 HGA1 9 0.000000 0.815880 3
+ CG321 CG311 CG311 CG321 9 180.000000 2.092000 4
+ CG321 CG311 CG311 CG3RC1 9 0.000000 0.627600 3
+ CG321 CG311 CG311 NG2S1 9 0.000000 0.836800 3
+ CG321 CG311 CG311 HGA1 9 0.000000 0.815880 3
+ CG331 CG311 CG311 NG2S1 9 0.000000 0.836800 3
+ CG331 CG311 CG311 HGA1 9 0.000000 0.815880 3
+ CG3RC1 CG311 CG311 OG311 9 0.000000 2.510400 1
+ CG3RC1 CG311 CG311 OG311 9 0.000000 2.928800 3
+ CG3RC1 CG311 CG311 HGA1 9 0.000000 0.627600 3
+ NG2S1 CG311 CG311 OG311 9 0.000000 0.836800 3
+ NG2S1 CG311 CG311 HGA1 9 0.000000 0.836800 3
+ OG311 CG311 CG311 HGA1 9 0.000000 0.815880 3
+ HGA1 CG311 CG311 HGA1 9 0.000000 0.815880 3
+ CG321 CG311 CG314 CG2O1 9 0.000000 0.836800 3
+ CG321 CG311 CG314 CG2O3 9 0.000000 0.836800 3
+ CG321 CG311 CG314 NG3P3 9 0.000000 0.836800 3
+ CG321 CG311 CG314 HGA1 9 0.000000 0.815880 3
+ CG331 CG311 CG314 CG2O1 9 0.000000 0.836800 3
+ CG331 CG311 CG314 CG2O3 9 0.000000 0.836800 3
+ CG331 CG311 CG314 NG3P3 9 0.000000 0.836800 3
+ CG331 CG311 CG314 HGA1 9 0.000000 0.815880 3
+ HGA1 CG311 CG314 CG2O1 9 0.000000 0.836800 3
+ HGA1 CG311 CG314 CG2O3 9 0.000000 0.836800 3
+ HGA1 CG311 CG314 NG3P3 9 0.000000 0.836800 3
+ HGA1 CG311 CG314 HGA1 9 0.000000 0.815880 3
+ CG2O1 CG311 CG321 CG2O1 9 0.000000 0.836800 3
+ CG2O1 CG311 CG321 CG2O3 9 0.000000 0.836800 3
+ CG2O1 CG311 CG321 CG2R51 9 0.000000 0.836800 3
+ CG2O1 CG311 CG321 CG2R61 9 0.000000 0.167360 3
+ CG2O1 CG311 CG321 CG311 9 0.000000 0.836800 3
+ CG2O1 CG311 CG321 CG321 9 0.000000 0.836800 3
+ CG2O1 CG311 CG321 OG311 9 0.000000 0.836800 3
+ CG2O1 CG311 CG321 SG301 9 0.000000 0.836800 3
+ CG2O1 CG311 CG321 SG311 9 0.000000 0.836800 3
+ CG2O1 CG311 CG321 HGA2 9 0.000000 0.836800 3
+ CG2O2 CG311 CG321 CG2O2 9 0.000000 0.836800 3
+ CG2O2 CG311 CG321 CG321 9 0.000000 0.836800 3
+ CG2O2 CG311 CG321 HGA2 9 0.000000 0.836800 3
+ CG2O3 CG311 CG321 CG2O1 9 0.000000 0.836800 3
+ CG2O3 CG311 CG321 CG2O3 9 0.000000 0.836800 3
+ CG2O3 CG311 CG321 CG2R51 9 0.000000 0.836800 3
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+ CG2O3 CG311 CG321 CG311 9 0.000000 0.836800 3
+ CG2O3 CG311 CG321 CG321 9 0.000000 0.836800 3
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+ CG2O3 CG311 CG321 SG311 9 0.000000 0.836800 3
+ CG2O3 CG311 CG321 HGA2 9 0.000000 0.836800 3
+ CG2R61 CG311 CG321 CG2O3 9 0.000000 0.167360 3
+ CG2R61 CG311 CG321 HGA2 9 0.000000 0.000000 3
+ CG301 CG311 CG321 CG311 9 0.000000 0.836800 3
+ CG301 CG311 CG321 CG321 9 0.000000 0.836800 3
+ CG301 CG311 CG321 HGA2 9 0.000000 0.815880 3
+ CG311 CG311 CG321 CG2D1 9 0.000000 0.836800 3
+ CG311 CG311 CG321 CG311 9 0.000000 0.836800 3
+ CG311 CG311 CG321 CG321 9 0.000000 0.836800 3
+ CG311 CG311 CG321 CG331 9 0.000000 0.836800 3
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+ CG314 CG311 CG321 CG331 9 0.000000 0.836800 3
+ CG314 CG311 CG321 HGA2 9 0.000000 0.815880 3
+ CG321 CG311 CG321 CG2D1 9 0.000000 0.836800 3
+ CG321 CG311 CG321 CG311 9 0.000000 0.836800 3
+ CG321 CG311 CG321 CG321 9 0.000000 0.836800 3
+ CG321 CG311 CG321 CG324 9 0.000000 0.836800 3
+ CG321 CG311 CG321 NG2S1 9 0.000000 0.836800 3
+ CG321 CG311 CG321 OG302 9 180.000000 0.836800 3
+ CG321 CG311 CG321 OG303 9 180.000000 0.836800 3
+ CG321 CG311 CG321 OG311 9 180.000000 0.836800 3
+ CG321 CG311 CG321 HGA2 9 0.000000 0.815880 1
+ CG324 CG311 CG321 CG321 9 0.000000 0.815880 3
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+ CG324 CG311 CG321 HGA2 9 0.000000 0.815880 3
+ CG331 CG311 CG321 CG2O3 9 0.000000 0.836800 3
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+ CG331 CG311 CG321 CG311 9 0.000000 0.836800 3
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+ CG3C51 CG311 CG321 CG321 9 0.000000 0.836800 3
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+ CG3RC1 CG311 CG321 CG311 9 0.000000 0.627600 3
+ CG3RC1 CG311 CG321 CG321 9 0.000000 0.627600 3
+ CG3RC1 CG311 CG321 HGA2 9 0.000000 0.627600 3
+ NG2R53 CG311 CG321 CG2O2 9 0.000000 0.836800 3
+ NG2R53 CG311 CG321 CG2O3 9 0.000000 0.836800 3
+ NG2R53 CG311 CG321 HGA2 9 0.000000 0.836800 3
+ NG2S1 CG311 CG321 CG2O1 9 0.000000 0.836800 3
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+ OG302 CG311 CG321 OG302 9 0.000000 0.836800 3
+ OG302 CG311 CG321 OG303 9 0.000000 0.836800 3
+ OG302 CG311 CG321 HGA2 9 0.000000 0.815880 3
+ OG311 CG311 CG321 CG2D1 9 0.000000 0.836800 3
+ OG311 CG311 CG321 CG311 9 180.000000 8.368000 3
+ OG311 CG311 CG321 CG311 9 0.000000 1.673600 5
+ OG311 CG311 CG321 CG311 9 0.000000 3.347200 6
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+ OG311 CG311 CG321 CG321 9 0.000000 2.928800 2
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+ HGA1 CG311 CG321 CG2O1 9 0.000000 0.836800 3
+ HGA1 CG311 CG321 CG2O2 9 0.000000 0.836800 3
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+ HGA1 CG311 CG321 CG311 9 0.000000 0.815880 3
+ HGA1 CG311 CG321 CG314 9 0.000000 0.815880 3
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+ HGA1 CG311 CG321 OG303 9 0.000000 0.815880 3
+ HGA1 CG311 CG321 OG311 9 0.000000 0.815880 3
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+ CG321 CG311 CG324 NG3P1 9 0.000000 0.815880 3
+ CG321 CG311 CG324 NG3P2 9 0.000000 0.815880 3
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+ NG2S1 CG311 CG324 NG3P2 9 0.000000 0.815880 3
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+ OG311 CG311 CG324 NG3P1 9 0.000000 0.815880 3
+ OG311 CG311 CG324 HGA2 9 0.000000 0.815880 3
+ HGA1 CG311 CG324 NG3P1 9 0.000000 0.815880 3
+ HGA1 CG311 CG324 NG3P2 9 0.000000 0.815880 3
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+ OG301 CG311 CG331 HGA3 9 0.000000 0.669440 3
+ OG302 CG311 CG331 HGA3 9 0.000000 0.836800 3
+ OG303 CG311 CG331 HGA3 9 0.000000 0.815880 3
+ OG311 CG311 CG331 HGA3 9 0.000000 0.836800 3
+ CLGA1 CG311 CG331 HGA3 9 0.000000 1.046000 3
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+ CG321 CG311 CG3C51 CG3C52 9 180.000000 2.092000 4
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+ CG331 CG311 CG3C51 CG3C52 9 0.000000 1.046000 1
+ CG331 CG311 CG3C51 CG3C52 9 0.000000 1.046000 2
+ CG331 CG311 CG3C51 CG3C52 9 0.000000 1.882800 3
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+ CG311 CG311 CG3RC1 CG3C52 9 0.000000 0.627600 3
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+ HGA1 CG311 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG2O2 CG311 NG2R53 CG2R53 9 180.000000 0.000000 1
+ CG2O3 CG311 NG2R53 CG2R53 9 180.000000 0.000000 1
+ CG321 CG311 NG2R53 CG2R53 9 0.000000 0.000000 1
+ HGA1 CG311 NG2R53 CG2R53 9 0.000000 0.000000 1
+ CG2O1 CG311 NG2S1 CG2O1 9 180.000000 0.836800 1
+ CG2O1 CG311 NG2S1 HGP1 9 0.000000 0.000000 1
+ CG2O2 CG311 NG2S1 CG2O1 9 180.000000 0.836800 1
+ CG2O2 CG311 NG2S1 HGP1 9 0.000000 0.000000 1
+ CG2O3 CG311 NG2S1 CG2O1 9 180.000000 0.836800 1
+ CG2O3 CG311 NG2S1 HGP1 9 0.000000 0.000000 1
+ CG311 CG311 NG2S1 CG2O1 9 0.000000 7.531200 1
+ CG311 CG311 NG2S1 HGP1 9 0.000000 0.000000 1
+ CG321 CG311 NG2S1 CG2O1 9 0.000000 7.531200 1
+ CG321 CG311 NG2S1 HGP1 9 0.000000 0.000000 1
+ CG324 CG311 NG2S1 CG2O1 9 0.000000 7.531200 1
+ CG324 CG311 NG2S1 HGP1 9 0.000000 0.000000 1
+ CG331 CG311 NG2S1 CG2O1 9 0.000000 7.531200 1
+ CG331 CG311 NG2S1 HGP1 9 0.000000 0.000000 1
+ HGA1 CG311 NG2S1 CG2O1 9 0.000000 0.000000 1
+ HGA1 CG311 NG2S1 HGP1 9 0.000000 0.000000 1
+ CG2O3 CG311 OG301 CG331 9 0.000000 0.836800 3
+ CG331 CG311 OG301 CG331 9 0.000000 1.673600 1
+ CG331 CG311 OG301 CG331 9 0.000000 2.050160 3
+ HGA1 CG311 OG301 CG331 9 0.000000 1.188256 3
+ CG321 CG311 OG302 CG2O2 9 180.000000 2.928800 1
+ CG331 CG311 OG302 CG2O2 9 0.000000 0.000000 3
+ HGA1 CG311 OG302 CG2O2 9 0.000000 0.000000 3
+ CG331 CG311 OG303 PG2 9 180.000000 1.673600 1
+ CG331 CG311 OG303 PG2 9 0.000000 1.255200 2
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+ HGA1 CG311 OG303 PG2 9 0.000000 0.000000 3
+ CG2O5 CG311 OG311 HGP1 9 0.000000 1.464400 1
+ CG2O5 CG311 OG311 HGP1 9 0.000000 1.548080 2
+ CG2O5 CG311 OG311 HGP1 9 180.000000 0.041840 3
+ CG311 CG311 OG311 HGP1 9 0.000000 5.564720 1
+ CG311 CG311 OG311 HGP1 9 0.000000 0.753120 2
+ CG311 CG311 OG311 HGP1 9 0.000000 1.924640 3
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+ CG321 CG311 OG311 HGP1 9 0.000000 1.255200 3
+ CG324 CG311 OG311 HGP1 9 0.000000 2.092000 1
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+ CG331 CG311 OG311 HGP1 9 0.000000 5.564720 1
+ CG331 CG311 OG311 HGP1 9 0.000000 0.753120 2
+ CG331 CG311 OG311 HGP1 9 0.000000 1.924640 3
+ CG3RC1 CG311 OG311 HGP1 9 0.000000 6.276000 1
+ CG3RC1 CG311 OG311 HGP1 9 180.000000 1.255200 2
+ CG3RC1 CG311 OG311 HGP1 9 0.000000 2.092000 3
+ OG312 CG311 OG311 HGP1 9 0.000000 1.171520 3
+ HGA1 CG311 OG311 HGP1 9 0.000000 0.000000 3
+ FGA2 CG312 CG331 HGA3 9 0.000000 0.744752 3
+ HGA7 CG312 CG331 HGA3 9 0.000000 0.744752 3
+ CG2R61 CG312 PG1 OG2P1 9 0.000000 0.000000 3
+ CG2R61 CG312 PG1 OG311 9 0.000000 0.418400 2
+ CG2R61 CG312 PG1 OG311 9 0.000000 1.673600 3
+ FGA2 CG312 PG1 OG2P1 9 0.000000 0.000000 3
+ FGA2 CG312 PG1 OG311 9 0.000000 0.418400 3
+ CG2R61 CG312 PG2 OG2P1 9 0.000000 0.000000 3
+ FGA2 CG312 PG2 OG2P1 9 0.000000 0.000000 3
+ CG2O1 CG314 CG321 CG2O1 9 0.000000 0.836800 3
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+ CG2O3 CG314 CG321 CG2O1 9 0.000000 0.836800 3
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+ NG3P2 CG314 CG321 CG321 9 0.000000 0.815880 3
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+ NG3P3 CG314 CG321 CG2O1 9 0.000000 0.836800 3
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+ HGA1 CG314 CG321 SG311 9 0.000000 0.815880 3
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+ CG2O1 CG314 CG331 HGA3 9 0.000000 0.836800 3
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+ NG3P3 CG314 CG331 HGA3 9 0.000000 0.836800 3
+ HGA1 CG314 CG331 HGA3 9 0.000000 0.815880 3
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+ CG324 CG321 OG303 PG1 9 0.000000 0.209200 3
+ CG331 CG321 OG303 PG2 9 180.000000 2.510400 1
+ CG331 CG321 OG303 PG2 9 0.000000 2.719600 2
+ CG331 CG321 OG303 PG2 9 0.000000 0.209200 3
+ CG3C51 CG321 OG303 PG1 9 180.000000 2.510400 1
+ CG3C51 CG321 OG303 PG1 9 0.000000 2.719600 2
+ CG3C51 CG321 OG303 PG1 9 0.000000 0.209200 3
+ CG3C51 CG321 OG303 PG2 9 180.000000 2.510400 1
+ CG3C51 CG321 OG303 PG2 9 0.000000 2.719600 2
+ CG3C51 CG321 OG303 PG2 9 0.000000 0.209200 3
+ CG3RC1 CG321 OG303 PG1 9 180.000000 2.510400 1
+ CG3RC1 CG321 OG303 PG1 9 0.000000 2.719600 2
+ CG3RC1 CG321 OG303 PG1 9 0.000000 0.209200 3
+ HGA2 CG321 OG303 PG1 9 0.000000 0.000000 3
+ HGA2 CG321 OG303 PG2 9 0.000000 0.000000 3
+ HGA2 CG321 OG303 SG3O1 9 0.000000 0.000000 3
+ CG2D1 CG321 OG311 HGP1 9 0.000000 5.439200 1
+ CG2D1 CG321 OG311 HGP1 9 0.000000 2.928800 2
+ CG2D1 CG321 OG311 HGP1 9 0.000000 0.585760 3
+ CG2DC1 CG321 OG311 HGP1 9 0.000000 5.439200 1
+ CG2DC1 CG321 OG311 HGP1 9 0.000000 2.928800 2
+ CG2DC1 CG321 OG311 HGP1 9 0.000000 0.585760 3
+ CG2DC2 CG321 OG311 HGP1 9 0.000000 5.439200 1
+ CG2DC2 CG321 OG311 HGP1 9 0.000000 2.928800 2
+ CG2DC2 CG321 OG311 HGP1 9 0.000000 0.585760 3
+ CG2R61 CG321 OG311 HGP1 9 0.000000 8.786400 1
+ CG2R61 CG321 OG311 HGP1 9 0.000000 5.857600 2
+ CG2R61 CG321 OG311 HGP1 9 0.000000 3.096160 3
+ CG302 CG321 OG311 HGP1 9 0.000000 1.673600 1
+ CG302 CG321 OG311 HGP1 9 0.000000 3.765600 2
+ CG302 CG321 OG311 HGP1 9 0.000000 1.422560 3
+ CG302 CG321 OG311 HGP1 9 0.000000 0.502080 4
+ CG311 CG321 OG311 HGP1 9 0.000000 4.727920 1
+ CG311 CG321 OG311 HGP1 9 0.000000 0.585760 2
+ CG311 CG321 OG311 HGP1 9 0.000000 1.004160 3
+ CG314 CG321 OG311 HGP1 9 0.000000 4.727920 1
+ CG314 CG321 OG311 HGP1 9 0.000000 0.585760 2
+ CG314 CG321 OG311 HGP1 9 0.000000 1.004160 3
+ CG321 CG321 OG311 HGP1 9 0.000000 4.727920 1
+ CG321 CG321 OG311 HGP1 9 0.000000 0.585760 2
+ CG321 CG321 OG311 HGP1 9 0.000000 1.004160 3
+ CG324 CG321 OG311 HGP1 9 0.000000 4.727920 1
+ CG324 CG321 OG311 HGP1 9 0.000000 0.585760 2
+ CG324 CG321 OG311 HGP1 9 0.000000 1.004160 3
+ CG331 CG321 OG311 HGP1 9 0.000000 4.727920 1
+ CG331 CG321 OG311 HGP1 9 0.000000 0.585760 2
+ CG331 CG321 OG311 HGP1 9 0.000000 1.004160 3
+ CG3C51 CG321 OG311 HGP1 9 0.000000 4.727920 1
+ CG3C51 CG321 OG311 HGP1 9 0.000000 0.585760 2
+ CG3C51 CG321 OG311 HGP1 9 0.000000 1.004160 3
+ HGA2 CG321 OG311 HGP1 9 0.000000 0.753120 3
+ CG321 CG321 OG3C61 CG321 9 180.000000 2.217520 1
+ CG321 CG321 OG3C61 CG321 9 0.000000 2.845120 2
+ CG321 CG321 OG3C61 CG321 9 180.000000 0.878640 3
+ CG321 CG321 OG3C61 CG321 9 0.000000 0.627600 4
+ CG324 CG321 OG3C61 CG321 9 0.000000 2.092000 3
+ OG3C61 CG321 OG3C61 CG321 9 0.000000 4.184000 3
+ HGA2 CG321 OG3C61 CG321 9 0.000000 0.815880 3
+ CG2DC1 CG321 OG3R60 CG2D2O 9 0.000000 2.928800 3
+ CG2DC2 CG321 OG3R60 CG2D1O 9 0.000000 2.928800 3
+ HGA2 CG321 OG3R60 CG2D1O 9 0.000000 3.765600 3
+ HGA2 CG321 OG3R60 CG2D2O 9 0.000000 3.765600 3
+ CG2R61 CG321 PG1 OG2P1 9 0.000000 0.209200 3
+ CG2R61 CG321 PG1 OG311 9 180.000000 6.903600 1
+ CG2R61 CG321 PG1 OG311 9 0.000000 2.092000 2
+ HGA2 CG321 PG1 OG2P1 9 0.000000 0.418400 3
+ HGA2 CG321 PG1 OG311 9 0.000000 0.418400 3
+ CG2R61 CG321 PG2 OG2P1 9 0.000000 0.209200 3
+ HGA2 CG321 PG2 OG2P1 9 0.000000 0.418400 3
+ CG331 CG321 SG301 SG301 9 0.000000 1.297040 3
+ HGA2 CG321 SG301 SG301 9 0.000000 0.661072 3
+ CG311 CG321 SG311 HGP3 9 0.000000 1.004160 1
+ CG311 CG321 SG311 HGP3 9 0.000000 0.627600 2
+ CG311 CG321 SG311 HGP3 9 0.000000 1.129680 3
+ CG314 CG321 SG311 HGP3 9 0.000000 1.004160 1
+ CG314 CG321 SG311 HGP3 9 0.000000 0.627600 2
+ CG314 CG321 SG311 HGP3 9 0.000000 1.129680 3
+ CG321 CG321 SG311 CG321 9 180.000000 1.004160 1
+ CG321 CG321 SG311 CG321 9 0.000000 1.548080 3
+ CG321 CG321 SG311 CG331 9 180.000000 1.004160 1
+ CG321 CG321 SG311 CG331 9 0.000000 1.548080 3
+ CG321 CG321 SG311 HGP3 9 0.000000 1.004160 1
+ CG321 CG321 SG311 HGP3 9 0.000000 0.627600 2
+ CG321 CG321 SG311 HGP3 9 0.000000 1.129680 3
+ CG324 CG321 SG311 CG321 9 0.000000 0.815880 3
+ CG331 CG321 SG311 CG331 9 180.000000 1.004160 1
+ CG331 CG321 SG311 CG331 9 0.000000 1.548080 3
+ CG331 CG321 SG311 HGP3 9 0.000000 1.004160 1
+ CG331 CG321 SG311 HGP3 9 0.000000 0.627600 2
+ CG331 CG321 SG311 HGP3 9 0.000000 1.129680 3
+ CG3C51 CG321 SG311 CG321 9 180.000000 1.004160 1
+ CG3C51 CG321 SG311 CG321 9 0.000000 1.548080 3
+ SG311 CG321 SG311 CG321 9 0.000000 5.439200 3
+ HGA2 CG321 SG311 CG321 9 0.000000 1.171520 3
+ HGA2 CG321 SG311 CG331 9 0.000000 1.171520 3
+ HGA2 CG321 SG311 HGP3 9 0.000000 0.836800 3
+ CG321 CG321 SG3O1 OG2P1 9 0.000000 0.962320 3
+ CG331 CG321 SG3O1 OG2P1 9 0.000000 1.087840 3
+ HGA2 CG321 SG3O1 OG2P1 9 0.000000 0.794960 3
+ CG331 CG321 SG3O2 CG331 9 0.000000 3.765600 1
+ CG331 CG321 SG3O2 CG331 9 0.000000 1.464400 2
+ CG331 CG321 SG3O2 CG331 9 0.000000 0.523000 3
+ CG331 CG321 SG3O2 NG311 9 0.000000 0.418400 1
+ CG331 CG321 SG3O2 NG311 9 0.000000 1.673600 2
+ CG331 CG321 SG3O2 NG311 9 0.000000 1.506240 3
+ CG331 CG321 SG3O2 OG2P1 9 0.000000 0.753120 3
+ HGA2 CG321 SG3O2 CG331 9 0.000000 0.523000 3
+ HGA2 CG321 SG3O2 NG311 9 0.000000 0.669440 3
+ HGA2 CG321 SG3O2 OG2P1 9 0.000000 0.669440 3
+ CG331 CG321 SG3O3 CG331 9 180.000000 0.753120 1
+ CG331 CG321 SG3O3 CG331 9 0.000000 2.384880 3
+ CG331 CG321 SG3O3 OG2P1 9 180.000000 6.694400 1
+ CG331 CG321 SG3O3 OG2P1 9 180.000000 1.004160 2
+ CG331 CG321 SG3O3 OG2P1 9 180.000000 0.125520 3
+ HGA2 CG321 SG3O3 CG331 9 0.000000 0.836800 3
+ HGA2 CG321 SG3O3 OG2P1 9 0.000000 0.836800 3
+ FGA1 CG322 CG331 HGA3 9 0.000000 0.774040 3
+ HGA6 CG322 CG331 HGA3 9 0.000000 0.774040 3
+ SG302 CG323 CG331 HGA3 9 0.000000 0.627600 3
+ HGA2 CG323 CG331 HGA3 9 0.000000 0.669440 3
+ NG3P0 CG324 CG331 HGA3 9 0.000000 0.669440 3
+ NG3P3 CG324 CG331 HGA3 9 0.000000 0.836800 3
+ HGA2 CG324 CG331 HGA3 9 0.000000 0.669440 3
+ HGP5 CG324 CG331 HGA3 9 0.000000 0.669440 3
+ NG3P3 CG324 CG3C31 CG3C31 9 0.000000 0.815880 3
+ NG3P3 CG324 CG3C31 HGA1 9 0.000000 0.836800 3
+ HGA2 CG324 CG3C31 CG3C31 9 0.000000 0.815880 3
+ HGA2 CG324 CG3C31 HGA1 9 0.000000 0.815880 3
+ CG321 CG324 NG2O1 OG2N1 9 180.000000 0.351456 2
+ CG321 CG324 NG2O1 OG2N1 9 0.000000 0.138072 4
+ CG321 CG324 NG2O1 OG2N1 9 0.000000 0.101253 6
+ HGA2 CG324 NG2O1 OG2N1 9 180.000000 0.062760 6
+ CG321 CG324 NG2P1 CG2N1 9 180.000000 0.000000 6
+ CG321 CG324 NG2P1 HGP2 9 180.000000 0.000000 6
+ HGA2 CG324 NG2P1 CG2N1 9 180.000000 0.000000 6
+ HGA2 CG324 NG2P1 HGP2 9 180.000000 0.000000 6
+ CG321 CG324 NG3P0 CG334 9 0.000000 1.087840 3
+ CG331 CG324 NG3P0 CG324 9 0.000000 1.087840 3
+ CG331 CG324 NG3P0 CG334 9 0.000000 1.087840 3
+ HGP5 CG324 NG3P0 CG324 9 0.000000 1.087840 3
+ HGP5 CG324 NG3P0 CG334 9 0.000000 1.087840 3
+ CG2R61 CG324 NG3P1 CG324 9 180.000000 7.112800 1
+ CG2R61 CG324 NG3P1 CG324 9 180.000000 3.347200 2
+ CG2R61 CG324 NG3P1 CG324 9 0.000000 2.426720 3
+ CG2R61 CG324 NG3P1 HGP2 9 0.000000 0.167360 3
+ CG311 CG324 NG3P1 CG324 9 0.000000 0.418400 3
+ CG311 CG324 NG3P1 CG334 9 0.000000 0.418400 3
+ CG311 CG324 NG3P1 HGP2 9 0.000000 0.418400 3
+ CG321 CG324 NG3P1 CG324 9 0.000000 0.418400 3
+ CG321 CG324 NG3P1 CG334 9 0.000000 0.418400 3
+ CG321 CG324 NG3P1 HGP2 9 0.000000 0.418400 3
+ HGA2 CG324 NG3P1 CG324 9 0.000000 0.418400 3
+ HGA2 CG324 NG3P1 CG334 9 0.000000 0.418400 3
+ HGA2 CG324 NG3P1 HGP2 9 0.000000 0.418400 3
+ CG311 CG324 NG3P2 CG324 9 0.000000 1.673600 1
+ CG311 CG324 NG3P2 CG324 9 0.000000 1.046000 2
+ CG311 CG324 NG3P2 CG324 9 0.000000 2.510400 3
+ CG311 CG324 NG3P2 HGP2 9 0.000000 0.418400 3
+ CG321 CG324 NG3P2 CG314 9 0.000000 1.673600 1
+ CG321 CG324 NG3P2 CG314 9 0.000000 1.046000 2
+ CG321 CG324 NG3P2 CG314 9 0.000000 2.510400 3
+ CG321 CG324 NG3P2 CG324 9 0.000000 1.673600 1
+ CG321 CG324 NG3P2 CG324 9 0.000000 1.046000 2
+ CG321 CG324 NG3P2 CG324 9 0.000000 2.510400 3
+ CG321 CG324 NG3P2 HGP2 9 0.000000 0.418400 3
+ HGA2 CG324 NG3P2 CG314 9 0.000000 0.418400 3
+ HGA2 CG324 NG3P2 CG324 9 0.000000 0.418400 3
+ HGA2 CG324 NG3P2 HGP2 9 0.000000 0.418400 3
+ CG2O1 CG324 NG3P3 HGP2 9 0.000000 0.418400 3
+ CG2O3 CG324 NG3P3 HGP2 9 0.000000 0.418400 3
+ CG321 CG324 NG3P3 HGP2 9 0.000000 0.418400 3
+ CG331 CG324 NG3P3 HGP2 9 0.000000 0.418400 3
+ CG3C31 CG324 NG3P3 HGP2 9 0.000000 0.418400 3
+ HGA2 CG324 NG3P3 HGP2 9 0.000000 0.418400 3
+ HGA3 CG331 CG331 HGA3 9 0.000000 0.648520 3
+ HGA3 CG331 CG3C51 CG3C51 9 0.000000 0.669440 3
+ HGA3 CG331 CG3C51 CG3C52 9 0.000000 0.669440 3
+ HGA3 CG331 CG3C51 CG3RC1 9 0.000000 0.669440 3
+ HGA3 CG331 CG3C51 OG3C51 9 0.000000 0.669440 3
+ HGA3 CG331 CG3C51 HGA1 9 0.000000 0.669440 3
+ HGA3 CG331 CG3RC1 CG311 9 180.000000 0.627600 3
+ HGA3 CG331 CG3RC1 CG321 9 0.000000 0.669440 3
+ HGA3 CG331 CG3RC1 CG3C51 9 180.000000 0.627600 3
+ HGA3 CG331 CG3RC1 CG3RC1 9 180.000000 0.627600 3
+ HGA3 CG331 NG2D1 CG2D1 9 0.000000 0.418400 3
+ HGA3 CG331 NG2D1 CG2N1 9 180.000000 0.460240 3
+ HGA3 CG331 NG2D1 CG2O7 9 0.000000 0.125520 3
+ HGA3 CG331 NG2R51 CG2R53 9 0.000000 0.000000 3
+ HGA3 CG331 NG2R51 CG2RC0 9 0.000000 0.794960 3
+ HGA3 CG331 NG2R61 CG2R62 9 0.000000 0.000000 3
+ HGA3 CG331 NG2R61 CG2R63 9 0.000000 0.794960 3
+ HGA3 CG331 NG2S0 CG2O1 9 0.000000 0.000000 3
+ HGA3 CG331 NG2S0 CG331 9 0.000000 1.757280 3
+ HGA3 CG331 NG2S1 CG2O1 9 0.000000 0.000000 3
+ HGA3 CG331 NG2S1 CG2O6 9 0.000000 0.000000 3
+ HGA3 CG331 NG2S1 HGP1 9 0.000000 0.000000 3
+ HGA3 CG331 NG2S3 PG1 9 0.000000 0.627600 3
+ HGA3 CG331 NG2S3 SG3O1 9 0.000000 0.627600 3
+ HGA3 CG331 NG2S3 HGP1 9 0.000000 0.041840 3
+ HGA3 CG331 NG311 CG2N1 9 180.000000 0.000000 3
+ HGA3 CG331 NG311 SG3O2 9 0.000000 0.418400 3
+ HGA3 CG331 NG311 HGP1 9 0.000000 0.209200 3
+ HGA3 CG331 NG311 HGPAM1 9 0.000000 1.757280 3
+ HGA3 CG331 OG301 CG2D1O 9 0.000000 0.271960 3
+ HGA3 CG331 OG301 CG2D2O 9 0.000000 0.271960 3
+ HGA3 CG331 OG301 CG2R61 9 0.000000 0.355640 3
+ HGA3 CG331 OG301 CG301 9 0.000000 1.188256 3
+ HGA3 CG331 OG301 CG311 9 0.000000 1.188256 3
+ HGA3 CG331 OG301 CG321 9 0.000000 1.188256 3
+ HGA3 CG331 OG301 CG331 9 0.000000 1.188256 3
+ HGA3 CG331 OG301 CG3C51 9 180.000000 0.836800 1
+ HGA3 CG331 OG301 CG3C51 9 180.000000 5.020800 2
+ HGA3 CG331 OG302 CG2O2 9 0.000000 0.000000 3
+ HGA3 CG331 OG302 CG2O6 9 0.000000 0.000000 3
+ HGA3 CG331 OG303 PG0 9 0.000000 0.000000 3
+ HGA3 CG331 OG303 PG1 9 0.000000 0.000000 3
+ HGA3 CG331 OG303 PG2 9 0.000000 0.000000 3
+ HGA3 CG331 OG303 SG3O1 9 0.000000 0.000000 3
+ HGA3 CG331 OG303 SG3O2 9 0.000000 0.000000 3
+ HGA3 CG331 OG311 HGP1 9 0.000000 0.753120 3
+ HGA3 CG331 SG301 SG301 9 0.000000 0.661072 3
+ HGA3 CG331 SG311 CG2O6 9 0.000000 1.506240 3
+ HGA3 CG331 SG311 CG2R64 9 180.000000 0.627600 3
+ HGA3 CG331 SG311 CG321 9 0.000000 1.171520 3
+ HGA3 CG331 SG311 HGP3 9 0.000000 0.836800 3
+ HGA3 CG331 SG3O1 OG2P1 9 0.000000 0.962320 3
+ HGA3 CG331 SG3O2 CG321 9 0.000000 0.355640 3
+ HGA3 CG331 SG3O2 CG331 9 0.000000 0.481160 3
+ HGA3 CG331 SG3O2 NG311 9 0.000000 0.418400 3
+ HGA3 CG331 SG3O2 NG321 9 0.000000 0.794960 3
+ HGA3 CG331 SG3O2 OG2P1 9 0.000000 0.753120 3
+ HGA3 CG331 SG3O2 OG303 9 0.000000 0.000000 3
+ HGA3 CG331 SG3O3 CG321 9 0.000000 0.836800 3
+ HGA3 CG331 SG3O3 CG331 9 0.000000 0.836800 3
+ HGA3 CG331 SG3O3 OG2P1 9 0.000000 0.836800 3
+ HGA3 CG334 NG2O1 OG2N1 9 0.000000 0.004184 6
+ HGA3 CG334 NG2P1 CG2D1 9 180.000000 0.627600 3
+ HGA3 CG334 NG2P1 CG2DC1 9 180.000000 0.627600 3
+ HGA3 CG334 NG2P1 CG2DC2 9 180.000000 0.627600 3
+ HGA3 CG334 NG2P1 CG2N1 9 180.000000 0.000000 6
+ HGA3 CG334 NG2P1 HGP2 9 180.000000 0.000000 6
+ HGP5 CG334 NG3P0 CG324 9 0.000000 1.087840 3
+ HGP5 CG334 NG3P0 CG334 9 0.000000 1.087840 3
+ HGP5 CG334 NG3P0 OG311 9 0.000000 0.418400 3
+ HGP5 CG334 NG3P0 OG312 9 0.000000 1.464400 3
+ HGA3 CG334 NG3P1 CG324 9 0.000000 0.418400 3
+ HGA3 CG334 NG3P1 HGP2 9 0.000000 3.765600 3
+ HGA3 CG334 NG3P3 HGP2 9 0.000000 0.376560 3
+ HGAAM0 CG3AM0 NG301 CG3AM0 9 0.000000 1.317960 3
+ HGAAM1 CG3AM1 NG311 CG3AM1 9 0.000000 0.334720 3
+ HGAAM1 CG3AM1 NG311 HGPAM1 9 0.000000 1.757280 3
+ HGAAM2 CG3AM2 NG321 HGPAM2 9 0.000000 0.669440 3
+ CG321 CG3C31 CG3C31 OG3C31 9 180.000000 0.460240 6
+ CG321 CG3C31 CG3C31 HGA2 9 180.000000 0.836800 5
+ CG324 CG3C31 CG3C31 CG3C31 9 0.000000 0.418400 6
+ CG324 CG3C31 CG3C31 HGA2 9 180.000000 0.836800 5
+ CG3C31 CG3C31 CG3C31 HGA1 9 0.000000 0.418400 6
+ CG3C31 CG3C31 CG3C31 HGA2 9 0.000000 0.418400 6
+ OG3C31 CG3C31 CG3C31 HGA1 9 180.000000 0.460240 6
+ OG3C31 CG3C31 CG3C31 HGA2 9 180.000000 0.460240 6
+ HGA1 CG3C31 CG3C31 HGA2 9 180.000000 0.836800 5
+ HGA2 CG3C31 CG3C31 HGA2 9 180.000000 0.836800 5
+ CG3RC1 CG3C31 CG3RC1 CG321 9 0.000000 0.627600 3
+ CG3RC1 CG3C31 CG3RC1 CG3C51 9 0.000000 0.627600 3
+ CG3RC1 CG3C31 CG3RC1 CG3C52 9 0.000000 0.627600 3
+ CG3RC1 CG3C31 CG3RC1 NG2R51 9 0.000000 0.627600 3
+ CG3RC1 CG3C31 CG3RC1 NG2R61 9 0.000000 2.928800 3
+ CG3RC1 CG3C31 CG3RC1 HGA1 9 0.000000 0.627600 3
+ HGA2 CG3C31 CG3RC1 CG321 9 0.000000 0.815880 3
+ HGA2 CG3C31 CG3RC1 CG3C51 9 0.000000 0.815880 3
+ HGA2 CG3C31 CG3RC1 CG3C52 9 0.000000 0.815880 3
+ HGA2 CG3C31 CG3RC1 CG3RC1 9 0.000000 0.627600 3
+ HGA2 CG3C31 CG3RC1 NG2R51 9 0.000000 0.627600 3
+ HGA2 CG3C31 CG3RC1 NG2R61 9 0.000000 0.627600 3
+ HGA2 CG3C31 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG321 CG3C31 OG3C31 CG3C31 9 0.000000 2.677760 5
+ CG321 CG3C31 OG3C31 CG3C31 9 180.000000 3.389040 6
+ HGA1 CG3C31 OG3C31 CG3C31 9 0.000000 2.677760 5
+ HGA1 CG3C31 OG3C31 CG3C31 9 180.000000 3.389040 6
+ HGA2 CG3C31 OG3C31 CG3C31 9 0.000000 2.677760 5
+ HGA2 CG3C31 OG3C31 CG3C31 9 180.000000 3.389040 6
+ CG2R53 CG3C41 CG3C41 NG2R43 9 0.000000 12.552000 3
+ CG2R53 CG3C41 CG3C41 HGA2 9 0.000000 2.384880 3
+ CG3C41 CG3C41 CG3C41 CG3C41 9 0.000000 5.983120 3
+ CG3C41 CG3C41 CG3C41 HGA2 9 0.000000 2.384880 3
+ NG2R43 CG3C41 CG3C41 HGA2 9 0.000000 2.384880 3
+ HGA2 CG3C41 CG3C41 HGA2 9 0.000000 0.000000 3
+ CG3C41 CG3C41 NG2R43 CG2R53 9 0.000000 12.552000 3
+ CG3C41 CG3C41 NG2R43 HGP1 9 180.000000 0.836800 3
+ HGA2 CG3C41 NG2R43 CG2R53 9 0.000000 2.384880 3
+ HGA2 CG3C41 NG2R43 HGP1 9 0.000000 0.000000 3
+ CG321 CG3C51 CG3C51 CG3C51 9 0.000000 0.794960 3
+ CG321 CG3C51 CG3C51 CG3C52 9 0.000000 0.794960 3
+ CG321 CG3C51 CG3C51 NG2S3 9 180.000000 2.092000 2
+ CG321 CG3C51 CG3C51 NG321 9 180.000000 1.255200 3
+ CG321 CG3C51 CG3C51 OG303 9 180.000000 3.347200 3
+ CG321 CG3C51 CG3C51 OG303 9 0.000000 0.836800 4
+ CG321 CG3C51 CG3C51 OG311 9 0.000000 0.585760 3
+ CG321 CG3C51 CG3C51 HGA1 9 0.000000 0.794960 3
+ CG331 CG3C51 CG3C51 CG3C51 9 0.000000 0.794960 3
+ CG331 CG3C51 CG3C51 CG3C52 9 0.000000 0.794960 3
+ CG331 CG3C51 CG3C51 OG303 9 180.000000 3.347200 3
+ CG331 CG3C51 CG3C51 OG311 9 0.000000 0.585760 3
+ CG331 CG3C51 CG3C51 HGA1 9 0.000000 0.794960 3
+ CG3C51 CG3C51 CG3C51 CG3C51 9 180.000000 1.715440 3
+ CG3C51 CG3C51 CG3C51 CG3C52 9 180.000000 1.715440 3
+ CG3C51 CG3C51 CG3C51 CG3C53 9 0.000000 1.673600 6
+ CG3C51 CG3C51 CG3C51 NG2R51 9 0.000000 0.000000 3
+ CG3C51 CG3C51 CG3C51 NG2R61 9 0.000000 0.000000 3
+ CG3C51 CG3C51 CG3C51 NG301 9 0.000000 0.000000 3
+ CG3C51 CG3C51 CG3C51 OG303 9 180.000000 8.368000 3
+ CG3C51 CG3C51 CG3C51 OG303 9 0.000000 1.673600 5
+ CG3C51 CG3C51 CG3C51 OG303 9 0.000000 3.347200 6
+ CG3C51 CG3C51 CG3C51 OG311 9 0.000000 0.836800 3
+ CG3C51 CG3C51 CG3C51 OG3C51 9 0.000000 0.000000 3
+ CG3C51 CG3C51 CG3C51 FGA1 9 0.000000 0.836800 3
+ CG3C51 CG3C51 CG3C51 HGA1 9 0.000000 0.794960 3
+ CG3C51 CG3C51 CG3C51 HGA6 9 0.000000 0.794960 3
+ CG3C52 CG3C51 CG3C51 CG3C52 9 180.000000 1.715440 3
+ CG3C52 CG3C51 CG3C51 CG3RC1 9 0.000000 0.627600 3
+ CG3C52 CG3C51 CG3C51 NG2R51 9 0.000000 0.000000 3
+ CG3C52 CG3C51 CG3C51 OG303 9 180.000000 3.347200 3
+ CG3C52 CG3C51 CG3C51 OG303 9 0.000000 0.836800 4
+ CG3C52 CG3C51 CG3C51 OG311 9 0.000000 0.836800 3
+ CG3C52 CG3C51 CG3C51 OG3C51 9 0.000000 0.000000 3
+ CG3C52 CG3C51 CG3C51 FGA1 9 0.000000 0.836800 3
+ CG3C52 CG3C51 CG3C51 HGA1 9 0.000000 0.794960 3
+ CG3C52 CG3C51 CG3C51 HGA6 9 0.000000 0.794960 3
+ CG3C53 CG3C51 CG3C51 OG311 9 0.000000 0.585760 3
+ CG3C53 CG3C51 CG3C51 HGA1 9 0.000000 0.815880 3
+ CG3RC1 CG3C51 CG3C51 OG311 9 0.000000 2.510400 1
+ CG3RC1 CG3C51 CG3C51 OG311 9 0.000000 2.928800 3
+ CG3RC1 CG3C51 CG3C51 HGA1 9 0.000000 0.627600 3
+ NG2R51 CG3C51 CG3C51 OG303 9 0.000000 0.000000 3
+ NG2R51 CG3C51 CG3C51 OG311 9 0.000000 0.000000 3
+ NG2R51 CG3C51 CG3C51 HGA1 9 0.000000 0.000000 3
+ NG2R61 CG3C51 CG3C51 OG311 9 0.000000 0.000000 3
+ NG2R61 CG3C51 CG3C51 HGA1 9 0.000000 0.815880 3
+ NG2S3 CG3C51 CG3C51 OG3C51 9 0.000000 0.836800 3
+ NG2S3 CG3C51 CG3C51 HGA1 9 0.000000 0.815880 3
+ NG301 CG3C51 CG3C51 OG311 9 0.000000 0.000000 3
+ NG301 CG3C51 CG3C51 HGA1 9 0.000000 0.815880 3
+ NG321 CG3C51 CG3C51 OG3C51 9 0.000000 0.836800 3
+ NG321 CG3C51 CG3C51 HGA1 9 0.000000 0.815880 3
+ OG303 CG3C51 CG3C51 OG311 9 0.000000 0.000000 3
+ OG303 CG3C51 CG3C51 OG3C51 9 0.000000 0.836800 3
+ OG303 CG3C51 CG3C51 OG3C51 9 180.000000 2.510400 4
+ OG303 CG3C51 CG3C51 OG3C51 9 0.000000 1.255200 5
+ OG303 CG3C51 CG3C51 OG3C51 9 0.000000 2.092000 6
+ OG303 CG3C51 CG3C51 FGA1 9 0.000000 0.836800 3
+ OG303 CG3C51 CG3C51 HGA1 9 0.000000 0.815880 3
+ OG303 CG3C51 CG3C51 HGA6 9 0.000000 0.815880 3
+ OG311 CG3C51 CG3C51 OG311 9 0.000000 0.000000 3
+ OG311 CG3C51 CG3C51 OG3C51 9 0.000000 0.836800 3
+ OG311 CG3C51 CG3C51 OG3C51 9 180.000000 2.510400 4
+ OG311 CG3C51 CG3C51 OG3C51 9 0.000000 1.255200 5
+ OG311 CG3C51 CG3C51 OG3C51 9 0.000000 2.092000 6
+ OG311 CG3C51 CG3C51 HGA1 9 0.000000 0.815880 3
+ OG3C51 CG3C51 CG3C51 HGA1 9 0.000000 0.794960 3
+ FGA1 CG3C51 CG3C51 HGA1 9 0.000000 0.774040 3
+ HGA1 CG3C51 CG3C51 HGA1 9 0.000000 0.794960 3
+ HGA1 CG3C51 CG3C51 HGA6 9 0.000000 0.794960 3
+ CG2O1 CG3C51 CG3C52 CG3C52 9 0.000000 0.585760 3
+ CG2O1 CG3C51 CG3C52 HGA2 9 0.000000 0.585760 3
+ CG2O3 CG3C51 CG3C52 CG3C52 9 0.000000 0.585760 3
+ CG2O3 CG3C51 CG3C52 HGA2 9 0.000000 0.585760 3
+ CG311 CG3C51 CG3C52 CG3C52 9 0.000000 0.794960 3
+ CG311 CG3C51 CG3C52 HGA2 9 0.000000 0.794960 3
+ CG321 CG3C51 CG3C52 CG3C52 9 0.000000 0.794960 3
+ CG321 CG3C51 CG3C52 NG3C51 9 0.000000 0.000000 3
+ CG321 CG3C51 CG3C52 HGA2 9 0.000000 0.794960 3
+ CG331 CG3C51 CG3C52 CG3C52 9 0.000000 0.794960 3
+ CG331 CG3C51 CG3C52 HGA2 9 0.000000 0.794960 3
+ CG3C51 CG3C51 CG3C52 CG3C51 9 180.000000 1.715440 3
+ CG3C51 CG3C51 CG3C52 CG3C52 9 180.000000 1.715440 3
+ CG3C51 CG3C51 CG3C52 CG3RC1 9 0.000000 0.627600 3
+ CG3C51 CG3C51 CG3C52 OG3C51 9 0.000000 0.000000 3
+ CG3C51 CG3C51 CG3C52 HGA2 9 0.000000 0.794960 3
+ CG3C52 CG3C51 CG3C52 CG3C52 9 180.000000 1.715440 3
+ CG3C52 CG3C51 CG3C52 CG3RC1 9 0.000000 0.627600 3
+ CG3C52 CG3C51 CG3C52 NG3C51 9 0.000000 2.886960 3
+ CG3C52 CG3C51 CG3C52 OG3C51 9 0.000000 0.000000 3
+ CG3C52 CG3C51 CG3C52 HGA2 9 0.000000 0.794960 3
+ CG3RC1 CG3C51 CG3C52 CG3C52 9 0.000000 0.627600 3
+ CG3RC1 CG3C51 CG3C52 OG3C51 9 0.000000 0.000000 3
+ CG3RC1 CG3C51 CG3C52 HGA2 9 0.000000 0.627600 3
+ NG2R51 CG3C51 CG3C52 CG3C51 9 0.000000 0.000000 3
+ NG2R51 CG3C51 CG3C52 CG3C52 9 0.000000 0.000000 3
+ NG2R51 CG3C51 CG3C52 HGA2 9 0.000000 0.000000 3
+ NG2R61 CG3C51 CG3C52 CG3C51 9 0.000000 0.000000 3
+ NG2R61 CG3C51 CG3C52 CG3C52 9 0.000000 0.000000 3
+ NG2R61 CG3C51 CG3C52 HGA2 9 0.000000 0.000000 3
+ NG2S0 CG3C51 CG3C52 CG3C52 9 0.000000 0.585760 3
+ NG2S0 CG3C51 CG3C52 HGA2 9 0.000000 0.585760 3
+ NG2S3 CG3C51 CG3C52 CG3C51 9 180.000000 5.648400 1
+ NG2S3 CG3C51 CG3C52 CG3C51 9 0.000000 4.184000 2
+ NG2S3 CG3C51 CG3C52 CG3C51 9 180.000000 0.836800 3
+ NG2S3 CG3C51 CG3C52 CG3C52 9 180.000000 5.648400 1
+ NG2S3 CG3C51 CG3C52 CG3C52 9 0.000000 4.184000 2
+ NG2S3 CG3C51 CG3C52 CG3C52 9 180.000000 0.836800 3
+ NG2S3 CG3C51 CG3C52 OG3C51 9 0.000000 0.836800 3
+ NG2S3 CG3C51 CG3C52 HGA2 9 0.000000 0.815880 3
+ NG321 CG3C51 CG3C52 CG3C51 9 180.000000 1.255200 3
+ NG321 CG3C51 CG3C52 HGA2 9 180.000000 0.627600 3
+ OG301 CG3C51 CG3C52 CG3C52 9 180.000000 8.368000 3
+ OG301 CG3C51 CG3C52 CG3C52 9 0.000000 1.673600 5
+ OG301 CG3C51 CG3C52 CG3C52 9 0.000000 3.347200 6
+ OG301 CG3C51 CG3C52 OG3C51 9 0.000000 0.836800 3
+ OG301 CG3C51 CG3C52 HGA2 9 180.000000 0.815880 3
+ OG303 CG3C51 CG3C52 CG3C51 9 180.000000 8.368000 3
+ OG303 CG3C51 CG3C52 CG3C51 9 0.000000 1.673600 5
+ OG303 CG3C51 CG3C52 CG3C51 9 0.000000 3.347200 6
+ OG303 CG3C51 CG3C52 CG3C52 9 180.000000 2.092000 1
+ OG303 CG3C51 CG3C52 CG3C52 9 0.000000 2.928800 2
+ OG303 CG3C51 CG3C52 CG3C52 9 0.000000 1.673600 3
+ OG303 CG3C51 CG3C52 CG3C52 9 0.000000 1.673600 5
+ OG303 CG3C51 CG3C52 CG3RC1 9 0.000000 7.949600 2
+ OG303 CG3C51 CG3C52 OG3C51 9 0.000000 0.836800 3
+ OG303 CG3C51 CG3C52 OG3C51 9 180.000000 2.510400 4
+ OG303 CG3C51 CG3C52 OG3C51 9 0.000000 1.255200 5
+ OG303 CG3C51 CG3C52 OG3C51 9 0.000000 2.092000 6
+ OG303 CG3C51 CG3C52 HGA2 9 0.000000 0.815880 3
+ OG311 CG3C51 CG3C52 CG3C51 9 180.000000 8.368000 3
+ OG311 CG3C51 CG3C52 CG3C51 9 0.000000 1.673600 5
+ OG311 CG3C51 CG3C52 CG3C51 9 0.000000 3.347200 6
+ OG311 CG3C51 CG3C52 CG3C52 9 180.000000 2.092000 1
+ OG311 CG3C51 CG3C52 CG3C52 9 0.000000 2.928800 2
+ OG311 CG3C51 CG3C52 CG3C52 9 0.000000 1.673600 3
+ OG311 CG3C51 CG3C52 CG3C52 9 0.000000 1.673600 5
+ OG311 CG3C51 CG3C52 CG3RC1 9 0.000000 7.949600 2
+ OG311 CG3C51 CG3C52 OG3C51 9 0.000000 0.836800 3
+ OG311 CG3C51 CG3C52 OG3C51 9 180.000000 2.510400 4
+ OG311 CG3C51 CG3C52 OG3C51 9 0.000000 1.255200 5
+ OG311 CG3C51 CG3C52 OG3C51 9 0.000000 2.092000 6
+ OG311 CG3C51 CG3C52 HGA2 9 180.000000 0.815880 3
+ OG3C51 CG3C51 CG3C52 CG3C51 9 0.000000 0.000000 3
+ OG3C51 CG3C51 CG3C52 CG3C52 9 0.000000 0.000000 3
+ OG3C51 CG3C51 CG3C52 HGA2 9 0.000000 0.794960 3
+ FGA1 CG3C51 CG3C52 OG3C51 9 0.000000 0.836800 3
+ FGA1 CG3C51 CG3C52 HGA2 9 0.000000 0.774040 3
+ HGA1 CG3C51 CG3C52 CG3C51 9 0.000000 0.794960 3
+ HGA1 CG3C51 CG3C52 CG3C52 9 0.000000 0.794960 3
+ HGA1 CG3C51 CG3C52 CG3RC1 9 0.000000 0.627600 3
+ HGA1 CG3C51 CG3C52 NG3C51 9 0.000000 0.000000 3
+ HGA1 CG3C51 CG3C52 OG3C51 9 0.000000 0.794960 3
+ HGA1 CG3C51 CG3C52 HGA2 9 0.000000 0.794960 3
+ HGA6 CG3C51 CG3C52 OG3C51 9 0.000000 0.794960 3
+ HGA6 CG3C51 CG3C52 HGA2 9 0.000000 0.794960 3
+ CG3C51 CG3C51 CG3C53 NG2R61 9 0.000000 0.000000 3
+ CG3C51 CG3C51 CG3C53 OG3C51 9 0.000000 2.510400 6
+ CG3C51 CG3C51 CG3C53 HGA1 9 0.000000 0.815880 3
+ OG311 CG3C51 CG3C53 NG2R61 9 0.000000 0.000000 3
+ OG311 CG3C51 CG3C53 OG3C51 9 0.000000 0.836800 3
+ OG311 CG3C51 CG3C53 OG3C51 9 180.000000 2.510400 4
+ OG311 CG3C51 CG3C53 OG3C51 9 0.000000 1.255200 5
+ OG311 CG3C51 CG3C53 OG3C51 9 0.000000 2.092000 6
+ OG311 CG3C51 CG3C53 HGA1 9 0.000000 0.815880 3
+ HGA1 CG3C51 CG3C53 NG2R61 9 0.000000 0.815880 3
+ HGA1 CG3C51 CG3C53 OG3C51 9 0.000000 0.815880 3
+ HGA1 CG3C51 CG3C53 HGA1 9 0.000000 0.815880 3
+ CG311 CG3C51 CG3RC1 CG311 9 0.000000 0.661072 3
+ CG311 CG3C51 CG3RC1 CG321 9 0.000000 0.209200 3
+ CG311 CG3C51 CG3RC1 CG331 9 0.000000 0.661072 3
+ CG311 CG3C51 CG3RC1 CG3RC1 9 0.000000 0.661072 3
+ CG321 CG3C51 CG3RC1 CG3C31 9 180.000000 9.204800 2
+ CG321 CG3C51 CG3RC1 CG3C31 9 0.000000 16.736000 3
+ CG321 CG3C51 CG3RC1 CG3C31 9 180.000000 2.301200 6
+ CG321 CG3C51 CG3RC1 CG3RC1 9 0.000000 0.627600 3
+ CG321 CG3C51 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG331 CG3C51 CG3RC1 CG321 9 0.000000 0.836800 3
+ CG331 CG3C51 CG3RC1 CG331 9 0.000000 0.836800 3
+ CG331 CG3C51 CG3RC1 CG3RC1 9 0.000000 0.836800 3
+ CG3C51 CG3C51 CG3RC1 CG3C31 9 0.000000 0.627600 3
+ CG3C51 CG3C51 CG3RC1 CG3RC1 9 0.000000 0.627600 3
+ CG3C51 CG3C51 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG3C52 CG3C51 CG3RC1 CG311 9 0.000000 0.209200 3
+ CG3C52 CG3C51 CG3RC1 CG321 9 180.000000 9.204800 2
+ CG3C52 CG3C51 CG3RC1 CG321 9 0.000000 16.736000 3
+ CG3C52 CG3C51 CG3RC1 CG321 9 180.000000 2.301200 6
+ CG3C52 CG3C51 CG3RC1 CG331 9 0.000000 0.209200 3
+ CG3C52 CG3C51 CG3RC1 CG3C31 9 180.000000 9.204800 2
+ CG3C52 CG3C51 CG3RC1 CG3C31 9 0.000000 16.736000 3
+ CG3C52 CG3C51 CG3RC1 CG3C31 9 180.000000 2.301200 6
+ CG3C52 CG3C51 CG3RC1 CG3C52 9 0.000000 0.000000 3
+ CG3C52 CG3C51 CG3RC1 CG3RC1 9 0.000000 0.627600 3
+ CG3C52 CG3C51 CG3RC1 HGA1 9 0.000000 0.627600 3
+ NG2R51 CG3C51 CG3RC1 CG3C31 9 0.000000 0.627600 3
+ NG2R51 CG3C51 CG3RC1 CG3RC1 9 0.000000 0.627600 3
+ NG2R51 CG3C51 CG3RC1 HGA1 9 0.000000 0.627600 3
+ NG2R61 CG3C51 CG3RC1 CG3C31 9 0.000000 0.627600 3
+ NG2R61 CG3C51 CG3RC1 CG3RC1 9 0.000000 0.627600 3
+ NG2R61 CG3C51 CG3RC1 HGA1 9 0.000000 0.627600 3
+ OG303 CG3C51 CG3RC1 CG3C31 9 0.000000 1.882800 2
+ OG303 CG3C51 CG3RC1 CG3C31 9 180.000000 3.347200 3
+ OG303 CG3C51 CG3RC1 CG3C31 9 0.000000 0.836800 4
+ OG303 CG3C51 CG3RC1 CG3RC1 9 0.000000 1.882800 2
+ OG303 CG3C51 CG3RC1 CG3RC1 9 0.000000 3.765600 6
+ OG303 CG3C51 CG3RC1 HGA1 9 0.000000 0.627600 3
+ OG311 CG3C51 CG3RC1 CG321 9 0.000000 1.882800 2
+ OG311 CG3C51 CG3RC1 CG321 9 180.000000 3.347200 3
+ OG311 CG3C51 CG3RC1 CG321 9 0.000000 0.836800 4
+ OG311 CG3C51 CG3RC1 CG3C31 9 0.000000 1.882800 2
+ OG311 CG3C51 CG3RC1 CG3C31 9 180.000000 3.347200 3
+ OG311 CG3C51 CG3RC1 CG3C31 9 0.000000 0.836800 4
+ OG311 CG3C51 CG3RC1 CG3C52 9 0.000000 1.882800 2
+ OG311 CG3C51 CG3RC1 CG3RC1 9 0.000000 1.882800 2
+ OG311 CG3C51 CG3RC1 HGA1 9 0.000000 0.627600 3
+ HGA1 CG3C51 CG3RC1 CG311 9 0.000000 0.209200 3
+ HGA1 CG3C51 CG3RC1 CG321 9 0.000000 0.815880 3
+ HGA1 CG3C51 CG3RC1 CG331 9 0.000000 0.209200 3
+ HGA1 CG3C51 CG3RC1 CG3C31 9 0.000000 0.815880 3
+ HGA1 CG3C51 CG3RC1 CG3C52 9 0.000000 0.627600 3
+ HGA1 CG3C51 CG3RC1 CG3RC1 9 0.000000 0.627600 3
+ HGA1 CG3C51 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG3C51 CG3C51 NG2R51 CG2R51 9 0.000000 0.836800 4
+ CG3C51 CG3C51 NG2R51 CG2R53 9 180.000000 0.000000 3
+ CG3C51 CG3C51 NG2R51 CG2RC0 9 0.000000 0.000000 3
+ CG3C52 CG3C51 NG2R51 CG2R51 9 0.000000 0.836800 4
+ CG3C52 CG3C51 NG2R51 CG2R53 9 180.000000 0.000000 3
+ CG3C52 CG3C51 NG2R51 CG2RC0 9 0.000000 0.000000 3
+ CG3RC1 CG3C51 NG2R51 CG2R53 9 180.000000 2.092000 1
+ CG3RC1 CG3C51 NG2R51 CG2RC0 9 180.000000 4.602400 1
+ OG3C51 CG3C51 NG2R51 CG2R51 9 180.000000 2.510400 1
+ OG3C51 CG3C51 NG2R51 CG2R51 9 0.000000 0.836800 3
+ OG3C51 CG3C51 NG2R51 CG2R53 9 0.000000 4.602400 1
+ OG3C51 CG3C51 NG2R51 CG2RC0 9 180.000000 4.602400 1
+ OG3C51 CG3C51 NG2R51 CG2RC0 9 0.000000 0.836800 3
+ HGA1 CG3C51 NG2R51 CG2R51 9 180.000000 1.046000 2
+ HGA1 CG3C51 NG2R51 CG2R53 9 180.000000 1.046000 2
+ HGA1 CG3C51 NG2R51 CG2R53 9 0.000000 0.815880 3
+ HGA1 CG3C51 NG2R51 CG2RC0 9 180.000000 1.046000 2
+ CG3C51 CG3C51 NG2R61 CG2R62 9 180.000000 0.000000 3
+ CG3C51 CG3C51 NG2R61 CG2R63 9 0.000000 4.184000 3
+ CG3C52 CG3C51 NG2R61 CG2R62 9 180.000000 0.000000 3
+ CG3C52 CG3C51 NG2R61 CG2R63 9 0.000000 4.184000 3
+ CG3RC1 CG3C51 NG2R61 CG2R62 9 0.000000 1.673600 4
+ CG3RC1 CG3C51 NG2R61 CG2R63 9 0.000000 4.184000 3
+ OG3C51 CG3C51 NG2R61 CG2R62 9 0.000000 4.184000 1
+ OG3C51 CG3C51 NG2R61 CG2R63 9 0.000000 0.000000 3
+ HGA1 CG3C51 NG2R61 CG2R62 9 0.000000 0.815880 3
+ HGA1 CG3C51 NG2R61 CG2R63 9 0.000000 0.815880 3
+ CG2O1 CG3C51 NG2S0 CG2O1 9 0.000000 3.347200 3
+ CG2O1 CG3C51 NG2S0 CG3C52 9 0.000000 0.418400 3
+ CG2O3 CG3C51 NG2S0 CG2O1 9 0.000000 3.347200 3
+ CG2O3 CG3C51 NG2S0 CG3C52 9 0.000000 0.418400 3
+ CG3C52 CG3C51 NG2S0 CG2O1 9 0.000000 3.347200 3
+ CG3C52 CG3C51 NG2S0 CG3C52 9 0.000000 0.418400 3
+ HGA1 CG3C51 NG2S0 CG2O1 9 0.000000 3.347200 3
+ HGA1 CG3C51 NG2S0 CG3C52 9 0.000000 0.418400 3
+ CG3C51 CG3C51 NG2S3 PG1 9 180.000000 6.276000 1
+ CG3C51 CG3C51 NG2S3 PG1 9 180.000000 2.719600 2
+ CG3C51 CG3C51 NG2S3 PG1 9 0.000000 4.184000 3
+ CG3C51 CG3C51 NG2S3 HGP1 9 0.000000 1.255200 1
+ CG3C52 CG3C51 NG2S3 PG1 9 180.000000 6.276000 1
+ CG3C52 CG3C51 NG2S3 PG1 9 180.000000 2.719600 2
+ CG3C52 CG3C51 NG2S3 PG1 9 0.000000 4.184000 3
+ CG3C52 CG3C51 NG2S3 HGP1 9 0.000000 1.255200 1
+ HGA1 CG3C51 NG2S3 PG1 9 0.000000 0.627600 3
+ HGA1 CG3C51 NG2S3 HGP1 9 0.000000 0.041840 3
+ CG3C51 CG3C51 NG301 CG2D1O 9 0.000000 0.000000 3
+ CG3C51 CG3C51 NG301 CG2D2O 9 0.000000 0.000000 3
+ OG3C51 CG3C51 NG301 CG2D1O 9 0.000000 0.000000 3
+ OG3C51 CG3C51 NG301 CG2D2O 9 0.000000 0.000000 3
+ HGA1 CG3C51 NG301 CG2D1O 9 0.000000 0.815880 3
+ HGA1 CG3C51 NG301 CG2D2O 9 0.000000 0.815880 3
+ CG3C51 CG3C51 NG321 HGPAM2 9 180.000000 1.255200 3
+ CG3C52 CG3C51 NG321 HGPAM2 9 180.000000 1.255200 3
+ HGA1 CG3C51 NG321 HGPAM2 9 0.000000 0.041840 3
+ CG3C52 CG3C51 OG301 CG331 9 180.000000 0.418400 1
+ CG3C52 CG3C51 OG301 CG331 9 180.000000 6.903600 2
+ CG3C52 CG3C51 OG301 CG331 9 0.000000 1.882800 3
+ HGA1 CG3C51 OG301 CG331 9 0.000000 2.510400 1
+ HGA1 CG3C51 OG301 CG331 9 180.000000 7.531200 2
+ HGA1 CG3C51 OG301 CG331 9 0.000000 2.008320 3
+ CG3C51 CG3C51 OG303 PG1 9 180.000000 10.460000 1
+ CG3C51 CG3C51 OG303 PG2 9 180.000000 10.460000 1
+ CG3C52 CG3C51 OG303 PG1 9 180.000000 10.460000 1
+ CG3C52 CG3C51 OG303 PG2 9 180.000000 10.460000 1
+ CG3RC1 CG3C51 OG303 PG1 9 180.000000 10.041600 1
+ CG3RC1 CG3C51 OG303 PG1 9 180.000000 1.673600 2
+ CG3RC1 CG3C51 OG303 PG1 9 180.000000 6.276000 3
+ HGA1 CG3C51 OG303 PG1 9 0.000000 0.000000 3
+ HGA1 CG3C51 OG303 PG2 9 0.000000 0.000000 3
+ CG3C51 CG3C51 OG311 HGP1 9 0.000000 1.213360 1
+ CG3C51 CG3C51 OG311 HGP1 9 0.000000 2.594080 2
+ CG3C51 CG3C51 OG311 HGP1 9 0.000000 0.209200 3
+ CG3C52 CG3C51 OG311 HGP1 9 0.000000 1.213360 1
+ CG3C52 CG3C51 OG311 HGP1 9 0.000000 2.594080 2
+ CG3C52 CG3C51 OG311 HGP1 9 0.000000 0.209200 3
+ CG3C53 CG3C51 OG311 HGP1 9 0.000000 1.213360 1
+ CG3C53 CG3C51 OG311 HGP1 9 0.000000 2.594080 2
+ CG3C53 CG3C51 OG311 HGP1 9 0.000000 0.209200 3
+ CG3RC1 CG3C51 OG311 HGP1 9 0.000000 6.276000 1
+ CG3RC1 CG3C51 OG311 HGP1 9 180.000000 1.255200 2
+ CG3RC1 CG3C51 OG311 HGP1 9 0.000000 1.338880 3
+ HGA1 CG3C51 OG311 HGP1 9 0.000000 0.753120 3
+ CG321 CG3C51 OG3C51 CG3C51 9 0.000000 1.255200 3
+ CG321 CG3C51 OG3C51 CG3C52 9 0.000000 1.255200 3
+ CG321 CG3C51 OG3C51 CG3C53 9 0.000000 3.347200 3
+ CG331 CG3C51 OG3C51 CG3C51 9 0.000000 1.255200 3
+ CG331 CG3C51 OG3C51 CG3C52 9 0.000000 1.255200 3
+ CG3C51 CG3C51 OG3C51 CG3C51 9 0.000000 2.092000 3
+ CG3C51 CG3C51 OG3C51 CG3C52 9 0.000000 2.092000 3
+ CG3C51 CG3C51 OG3C51 CG3C53 9 0.000000 0.000000 6
+ CG3C52 CG3C51 OG3C51 CG3C51 9 0.000000 2.092000 3
+ CG3C52 CG3C51 OG3C51 CG3C52 9 0.000000 2.092000 3
+ NG2R51 CG3C51 OG3C51 CG3C51 9 0.000000 0.000000 3
+ NG2R51 CG3C51 OG3C51 CG3C52 9 0.000000 0.000000 3
+ NG2R61 CG3C51 OG3C51 CG3C51 9 0.000000 0.000000 3
+ NG2R61 CG3C51 OG3C51 CG3C52 9 0.000000 0.000000 3
+ NG301 CG3C51 OG3C51 CG3C51 9 0.000000 0.000000 3
+ HGA1 CG3C51 OG3C51 CG3C51 9 0.000000 1.255200 3
+ HGA1 CG3C51 OG3C51 CG3C52 9 0.000000 1.255200 3
+ HGA1 CG3C51 OG3C51 CG3C53 9 0.000000 0.815880 3
+ CG2R51 CG3C52 CG3C52 CG3C52 9 180.000000 15.480800 3
+ CG2R51 CG3C52 CG3C52 CG3C52 9 0.000000 9.414000 4
+ CG2R51 CG3C52 CG3C52 CG3C52 9 180.000000 0.962320 6
+ CG2R51 CG3C52 CG3C52 NG3C51 9 0.000000 7.112800 3
+ CG2R51 CG3C52 CG3C52 OG3C51 9 180.000000 1.046000 3
+ CG2R51 CG3C52 CG3C52 HGA2 9 0.000000 0.585760 3
+ CG2R52 CG3C52 CG3C52 NG3C51 9 0.000000 0.000000 3
+ CG2R52 CG3C52 CG3C52 HGA2 9 0.000000 4.184000 3
+ CG2R53 CG3C52 CG3C52 CG3C52 9 180.000000 1.422560 3
+ CG2R53 CG3C52 CG3C52 HGA2 9 0.000000 0.000000 3
+ CG2RC0 CG3C52 CG3C52 NG3C51 9 0.000000 10.376320 3
+ CG2RC0 CG3C52 CG3C52 HGA2 9 0.000000 0.000000 3
+ CG3C51 CG3C52 CG3C52 CG3C51 9 180.000000 1.715440 3
+ CG3C51 CG3C52 CG3C52 CG3C52 9 180.000000 1.715440 3
+ CG3C51 CG3C52 CG3C52 CG3RC1 9 0.000000 0.627600 3
+ CG3C51 CG3C52 CG3C52 NG3C51 9 0.000000 2.886960 3
+ CG3C51 CG3C52 CG3C52 OG3C51 9 0.000000 0.000000 3
+ CG3C51 CG3C52 CG3C52 HGA2 9 0.000000 0.794960 3
+ CG3C52 CG3C52 CG3C52 CG3C52 9 180.000000 1.715440 3
+ CG3C52 CG3C52 CG3C52 CG3RC1 9 0.000000 0.627600 3
+ CG3C52 CG3C52 CG3C52 NG2R53 9 0.000000 8.911920 3
+ CG3C52 CG3C52 CG3C52 NG2S0 9 0.000000 0.585760 3
+ CG3C52 CG3C52 CG3C52 NG3C51 9 0.000000 2.886960 3
+ CG3C52 CG3C52 CG3C52 OG3C51 9 0.000000 0.000000 3
+ CG3C52 CG3C52 CG3C52 HGA2 9 0.000000 0.794960 3
+ CG3C53 CG3C52 CG3C52 CG3C54 9 0.000000 0.669440 3
+ CG3C53 CG3C52 CG3C52 HGA2 9 0.000000 0.669440 3
+ CG3C54 CG3C52 CG3C52 CG3C54 9 180.000000 1.548080 3
+ CG3C54 CG3C52 CG3C52 CG3C54 9 180.000000 0.125520 6
+ CG3C54 CG3C52 CG3C52 NG3C51 9 0.000000 0.167360 3
+ CG3C54 CG3C52 CG3C52 HGA2 9 0.000000 0.669440 3
+ CG3RC1 CG3C52 CG3C52 CG3RC1 9 180.000000 0.878640 3
+ CG3RC1 CG3C52 CG3C52 OG3C51 9 0.000000 0.000000 3
+ CG3RC1 CG3C52 CG3C52 HGA2 9 0.000000 0.815880 3
+ NG2R50 CG3C52 CG3C52 NG3C51 9 0.000000 4.184000 3
+ NG2R50 CG3C52 CG3C52 HGA2 9 0.000000 1.255200 3
+ NG2R53 CG3C52 CG3C52 HGA2 9 180.000000 0.000000 3
+ NG2S0 CG3C52 CG3C52 HGA2 9 0.000000 0.585760 3
+ NG3C51 CG3C52 CG3C52 HGA2 9 0.000000 0.000000 3
+ OG3C51 CG3C52 CG3C52 OG3C51 9 0.000000 1.087840 3
+ OG3C51 CG3C52 CG3C52 HGA2 9 0.000000 0.794960 3
+ HGA2 CG3C52 CG3C52 HGA2 9 0.000000 0.794960 3
+ CG3C52 CG3C52 CG3C53 CG2O1 9 0.000000 0.585760 3
+ CG3C52 CG3C52 CG3C53 CG2O3 9 0.000000 0.585760 3
+ CG3C52 CG3C52 CG3C53 NG3P2 9 0.000000 0.585760 3
+ CG3C52 CG3C52 CG3C53 HGA1 9 0.000000 0.585760 3
+ HGA2 CG3C52 CG3C53 CG2O1 9 0.000000 0.585760 3
+ HGA2 CG3C52 CG3C53 CG2O3 9 0.000000 0.585760 3
+ HGA2 CG3C52 CG3C53 NG3P2 9 0.000000 0.585760 3
+ HGA2 CG3C52 CG3C53 HGA1 9 0.000000 0.585760 3
+ CG2R51 CG3C52 CG3C54 NG3P2 9 180.000000 2.510400 3
+ CG2R51 CG3C52 CG3C54 HGA2 9 0.000000 0.585760 3
+ CG3C52 CG3C52 CG3C54 NG3P2 9 0.000000 0.585760 3
+ CG3C52 CG3C52 CG3C54 HGA2 9 0.000000 0.585760 3
+ NG3C51 CG3C52 CG3C54 NG3P2 9 0.000000 2.050160 3
+ NG3C51 CG3C52 CG3C54 HGA2 9 180.000000 1.548080 3
+ HGA2 CG3C52 CG3C54 NG3P2 9 0.000000 0.585760 3
+ HGA2 CG3C52 CG3C54 HGA2 9 0.000000 0.585760 3
+ CG3C51 CG3C52 CG3RC1 CG3C31 9 0.000000 16.736000 3
+ CG3C51 CG3C52 CG3RC1 CG3RC1 9 0.000000 7.322000 3
+ CG3C51 CG3C52 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG3C52 CG3C52 CG3RC1 CG311 9 0.000000 0.418400 3
+ CG3C52 CG3C52 CG3RC1 CG311 9 0.000000 2.092000 4
+ CG3C52 CG3C52 CG3RC1 CG321 9 0.000000 0.836800 3
+ CG3C52 CG3C52 CG3RC1 CG3C31 9 180.000000 9.204800 2
+ CG3C52 CG3C52 CG3RC1 CG3C31 9 0.000000 16.736000 3
+ CG3C52 CG3C52 CG3RC1 CG3C31 9 180.000000 2.301200 6
+ CG3C52 CG3C52 CG3RC1 CG3C51 9 0.000000 0.000000 3
+ CG3C52 CG3C52 CG3RC1 CG3C52 9 0.000000 0.000000 3
+ CG3C52 CG3C52 CG3RC1 CG3RC1 9 0.000000 0.627600 3
+ CG3C52 CG3C52 CG3RC1 NG2R51 9 0.000000 0.627600 3
+ CG3C52 CG3C52 CG3RC1 NG2R61 9 0.000000 0.627600 3
+ CG3C52 CG3C52 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG3RC1 CG3C52 CG3RC1 CG3C52 9 0.000000 0.000000 3
+ CG3RC1 CG3C52 CG3RC1 HGA1 9 0.000000 0.000000 3
+ HGA2 CG3C52 CG3RC1 CG311 9 0.000000 0.815880 3
+ HGA2 CG3C52 CG3RC1 CG321 9 0.000000 0.815880 1
+ HGA2 CG3C52 CG3RC1 CG3C31 9 0.000000 0.815880 3
+ HGA2 CG3C52 CG3RC1 CG3C51 9 0.000000 0.000000 3
+ HGA2 CG3C52 CG3RC1 CG3C52 9 0.000000 0.000000 3
+ HGA2 CG3C52 CG3RC1 CG3RC1 9 0.000000 0.627600 3
+ HGA2 CG3C52 CG3RC1 NG2R51 9 0.000000 0.627600 3
+ HGA2 CG3C52 CG3RC1 NG2R61 9 0.000000 0.627600 3
+ HGA2 CG3C52 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG2R51 CG3C52 NG2R50 CG2R52 9 180.000000 8.368000 2
+ CG3C52 CG3C52 NG2R50 CG2R53 9 180.000000 7.949600 3
+ HGA2 CG3C52 NG2R50 CG2R52 9 0.000000 0.000000 3
+ HGA2 CG3C52 NG2R50 CG2R53 9 0.000000 2.510400 3
+ CG3C52 CG3C52 NG2R53 CG2R53 9 180.000000 9.665040 3
+ CG3C52 CG3C52 NG2R53 HGP1 9 0.000000 3.179840 3
+ HGA2 CG3C52 NG2R53 CG2R53 9 0.000000 0.000000 3
+ HGA2 CG3C52 NG2R53 HGP1 9 180.000000 0.000000 3
+ CG3C52 CG3C52 NG2S0 CG2O1 9 180.000000 0.000000 3
+ CG3C52 CG3C52 NG2S0 CG3C51 9 0.000000 0.418400 3
+ HGA2 CG3C52 NG2S0 CG2O1 9 180.000000 0.000000 3
+ HGA2 CG3C52 NG2S0 CG3C51 9 0.000000 0.418400 3
+ CG2R51 CG3C52 NG3C51 CG3C52 9 180.000000 8.577200 3
+ CG2R51 CG3C52 NG3C51 HGP1 9 180.000000 7.405680 1
+ CG2R51 CG3C52 NG3C51 HGP1 9 0.000000 2.928800 3
+ CG3C51 CG3C52 NG3C51 CG3C52 9 0.000000 0.753120 3
+ CG3C51 CG3C52 NG3C51 HGP1 9 0.000000 2.301200 1
+ CG3C51 CG3C52 NG3C51 HGP1 9 0.000000 3.556400 3
+ CG3C52 CG3C52 NG3C51 CG2R51 9 180.000000 0.209200 3
+ CG3C52 CG3C52 NG3C51 CG2R53 9 180.000000 7.949600 3
+ CG3C52 CG3C52 NG3C51 CG2RC0 9 180.000000 6.066800 3
+ CG3C52 CG3C52 NG3C51 CG3C52 9 0.000000 0.753120 3
+ CG3C52 CG3C52 NG3C51 NG2R50 9 180.000000 11.715200 3
+ CG3C52 CG3C52 NG3C51 NG3P2 9 0.000000 3.765600 3
+ CG3C52 CG3C52 NG3C51 HGP1 9 0.000000 2.301200 1
+ CG3C52 CG3C52 NG3C51 HGP1 9 0.000000 3.556400 3
+ CG3C54 CG3C52 NG3C51 CG3C54 9 180.000000 6.610720 3
+ CG3C54 CG3C52 NG3C51 HGP1 9 0.000000 6.903600 1
+ CG3C54 CG3C52 NG3C51 HGP1 9 0.000000 3.096160 3
+ HGA2 CG3C52 NG3C51 CG2R51 9 0.000000 0.000000 3
+ HGA2 CG3C52 NG3C51 CG2R53 9 0.000000 0.418400 3
+ HGA2 CG3C52 NG3C51 CG2RC0 9 0.000000 0.000000 3
+ HGA2 CG3C52 NG3C51 CG3C52 9 0.000000 0.000000 3
+ HGA2 CG3C52 NG3C51 CG3C54 9 0.000000 2.008320 3
+ HGA2 CG3C52 NG3C51 NG2R50 9 0.000000 1.255200 3
+ HGA2 CG3C52 NG3C51 NG3P2 9 0.000000 0.000000 3
+ HGA2 CG3C52 NG3C51 HGP1 9 0.000000 0.000000 3
+ CG2R51 CG3C52 OG3C51 CG2R53 9 180.000000 1.297040 1
+ CG2R51 CG3C52 OG3C51 CG2R53 9 0.000000 1.171520 6
+ CG3C51 CG3C52 OG3C51 CG3C51 9 0.000000 2.092000 3
+ CG3C51 CG3C52 OG3C51 CG3C52 9 0.000000 2.092000 3
+ CG3C51 CG3C52 OG3C51 CG3RC1 9 0.000000 2.092000 3
+ CG3C52 CG3C52 OG3C51 CG2R51 9 0.000000 3.054320 3
+ CG3C52 CG3C52 OG3C51 CG2R53 9 0.000000 9.288480 2
+ CG3C52 CG3C52 OG3C51 CG3C51 9 0.000000 2.092000 3
+ CG3C52 CG3C52 OG3C51 CG3C52 9 0.000000 2.092000 3
+ CG3C52 CG3C52 OG3C51 CG3RC1 9 0.000000 2.092000 3
+ OG3C51 CG3C52 OG3C51 CG2RC0 9 0.000000 2.092000 3
+ OG3C51 CG3C52 OG3C51 CG3C52 9 180.000000 6.903600 3
+ HGA2 CG3C52 OG3C51 CG2R51 9 0.000000 0.000000 3
+ HGA2 CG3C52 OG3C51 CG2R53 9 0.000000 0.000000 3
+ HGA2 CG3C52 OG3C51 CG2RC0 9 0.000000 1.255200 3
+ HGA2 CG3C52 OG3C51 CG3C51 9 0.000000 1.255200 3
+ HGA2 CG3C52 OG3C51 CG3C52 9 0.000000 1.255200 3
+ HGA2 CG3C52 OG3C51 CG3RC1 9 0.000000 1.255200 3
+ CG3C51 CG3C53 NG2R61 CG2R62 9 180.000000 0.000000 3
+ OG3C51 CG3C53 NG2R61 CG2R62 9 0.000000 4.184000 1
+ HGA1 CG3C53 NG2R61 CG2R62 9 0.000000 0.815880 3
+ CG2O1 CG3C53 NG3P2 CG3C54 9 0.000000 0.334720 3
+ CG2O1 CG3C53 NG3P2 HGP2 9 0.000000 0.334720 3
+ CG2O3 CG3C53 NG3P2 CG3C54 9 0.000000 0.334720 3
+ CG2O3 CG3C53 NG3P2 HGP2 9 0.000000 0.334720 3
+ CG3C52 CG3C53 NG3P2 CG3C54 9 0.000000 0.334720 3
+ CG3C52 CG3C53 NG3P2 HGP2 9 0.000000 0.334720 3
+ HGA1 CG3C53 NG3P2 CG3C54 9 0.000000 0.334720 3
+ HGA1 CG3C53 NG3P2 HGP2 9 0.000000 0.334720 3
+ CG3C51 CG3C53 OG3C51 CG3C51 9 0.000000 0.000000 6
+ NG2R61 CG3C53 OG3C51 CG3C51 9 0.000000 0.000000 3
+ HGA1 CG3C53 OG3C51 CG3C51 9 0.000000 0.815880 3
+ NG2R52 CG3C54 CG3C54 NG2R52 9 0.000000 0.292880 3
+ NG2R52 CG3C54 CG3C54 HGA2 9 0.000000 1.255200 3
+ HGA2 CG3C54 CG3C54 HGA2 9 0.000000 0.585760 3
+ CG2R51 CG3C54 NG2R52 CG2R52 9 180.000000 11.715200 2
+ CG2R51 CG3C54 NG2R52 HGP2 9 180.000000 11.296800 2
+ CG3C54 CG3C54 NG2R52 CG2R53 9 180.000000 1.046000 3
+ CG3C54 CG3C54 NG2R52 HGP2 9 0.000000 2.510400 3
+ HGA2 CG3C54 NG2R52 CG2R52 9 180.000000 0.000000 3
+ HGA2 CG3C54 NG2R52 CG2R53 9 180.000000 0.000000 3
+ HGA2 CG3C54 NG2R52 HGP2 9 0.000000 0.000000 3
+ NG3P2 CG3C54 NG3C51 CG3C52 9 0.000000 7.405680 3
+ NG3P2 CG3C54 NG3C51 HGP1 9 180.000000 7.698560 1
+ NG3P2 CG3C54 NG3C51 HGP1 9 180.000000 4.016640 3
+ HGA2 CG3C54 NG3C51 CG3C52 9 0.000000 2.008320 3
+ HGA2 CG3C54 NG3C51 HGP1 9 0.000000 0.000000 3
+ CG2R51 CG3C54 NG3P2 CG3C54 9 180.000000 7.865920 3
+ CG2R51 CG3C54 NG3P2 HGP2 9 0.000000 1.255200 3
+ CG3C52 CG3C54 NG3P2 CG2R51 9 180.000000 2.928800 3
+ CG3C52 CG3C54 NG3P2 CG3C53 9 0.000000 0.334720 3
+ CG3C52 CG3C54 NG3P2 CG3C54 9 0.000000 0.418400 3
+ CG3C52 CG3C54 NG3P2 NG3C51 9 0.000000 0.167360 3
+ CG3C52 CG3C54 NG3P2 HGP2 9 0.000000 0.334720 3
+ NG3C51 CG3C54 NG3P2 CG3C54 9 180.000000 11.464160 3
+ NG3C51 CG3C54 NG3P2 HGP2 9 180.000000 0.669440 3
+ HGA2 CG3C54 NG3P2 CG2R51 9 0.000000 0.836800 3
+ HGA2 CG3C54 NG3P2 CG3C53 9 0.000000 0.334720 3
+ HGA2 CG3C54 NG3P2 CG3C54 9 0.000000 0.418400 3
+ HGA2 CG3C54 NG3P2 NG3C51 9 0.000000 0.418400 3
+ HGA2 CG3C54 NG3P2 HGP2 9 0.000000 0.334720 3
+ CG311 CG3RC1 CG3RC1 CG311 9 0.000000 0.627600 3
+ CG311 CG3RC1 CG3RC1 CG321 9 0.000000 16.736000 3
+ CG311 CG3RC1 CG3RC1 CG331 9 0.000000 0.661072 3
+ CG311 CG3RC1 CG3RC1 CG3C51 9 0.000000 0.627600 3
+ CG311 CG3RC1 CG3RC1 CG3C52 9 0.000000 0.627600 3
+ CG311 CG3RC1 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG321 CG3RC1 CG3RC1 CG321 9 0.000000 0.627600 3
+ CG321 CG3RC1 CG3RC1 CG331 9 0.000000 0.209200 3
+ CG321 CG3RC1 CG3RC1 CG3C31 9 0.000000 0.627600 3
+ CG321 CG3RC1 CG3RC1 CG3C51 9 0.000000 0.209200 3
+ CG321 CG3RC1 CG3RC1 CG3C52 9 0.000000 0.627600 3
+ CG321 CG3RC1 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG331 CG3RC1 CG3RC1 CG3C52 9 0.000000 0.209200 3
+ CG331 CG3RC1 CG3RC1 HGA1 9 0.000000 0.209200 3
+ CG3C31 CG3RC1 CG3RC1 CG3C51 9 0.000000 16.736000 3
+ CG3C31 CG3RC1 CG3RC1 CG3C52 9 0.000000 0.627600 3
+ CG3C31 CG3RC1 CG3RC1 NG2R51 9 0.000000 0.627600 3
+ CG3C31 CG3RC1 CG3RC1 NG2R61 9 0.000000 0.627600 3
+ CG3C31 CG3RC1 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG3C51 CG3RC1 CG3RC1 CG3C52 9 0.000000 16.736000 3
+ CG3C51 CG3RC1 CG3RC1 OG3C51 9 0.000000 5.020800 3
+ CG3C51 CG3RC1 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG3C52 CG3RC1 CG3RC1 CG3C52 9 0.000000 0.627600 3
+ CG3C52 CG3RC1 CG3RC1 NG2R51 9 0.000000 0.627600 3
+ CG3C52 CG3RC1 CG3RC1 NG2R61 9 0.000000 0.627600 3
+ CG3C52 CG3RC1 CG3RC1 OG3C51 9 0.000000 5.020800 3
+ CG3C52 CG3RC1 CG3RC1 HGA1 9 0.000000 0.627600 3
+ NG2R51 CG3RC1 CG3RC1 HGA1 9 0.000000 0.627600 3
+ NG2R61 CG3RC1 CG3RC1 HGA1 9 0.000000 0.627600 3
+ OG3C51 CG3RC1 CG3RC1 HGA1 9 0.000000 0.627600 3
+ HGA1 CG3RC1 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CG3C31 CG3RC1 NG2R51 CG2R53 9 180.000000 4.602400 1
+ CG3C31 CG3RC1 NG2R51 CG2RC0 9 0.000000 1.255200 3
+ CG3C52 CG3RC1 NG2R51 CG2R53 9 0.000000 0.418400 3
+ CG3C52 CG3RC1 NG2R51 CG2RC0 9 0.000000 1.255200 3
+ CG3RC1 CG3RC1 NG2R51 CG2R53 9 180.000000 4.602400 1
+ CG3RC1 CG3RC1 NG2R51 CG2RC0 9 180.000000 4.602400 1
+ CG3C31 CG3RC1 NG2R61 CG2R62 9 180.000000 0.000000 3
+ CG3C31 CG3RC1 NG2R61 CG2R63 9 0.000000 1.255200 3
+ CG3C52 CG3RC1 NG2R61 CG2R62 9 180.000000 0.000000 3
+ CG3C52 CG3RC1 NG2R61 CG2R63 9 0.000000 1.255200 3
+ CG3RC1 CG3RC1 NG2R61 CG2R62 9 180.000000 0.000000 3
+ CG3RC1 CG3RC1 NG2R61 CG2R63 9 180.000000 0.836800 3
+ CG3RC1 CG3RC1 OG3C51 CG3C52 9 0.000000 0.000000 3
+ OG3C51 CG3RC1 OG3C51 CG3C52 9 0.000000 0.000000 3
+ HGA1 CG3RC1 OG3C51 CG3C52 9 0.000000 1.255200 3
+ CG2D1 NG2D1 NG2S1 CG2O1 9 180.000000 14.225600 1
+ CG2D1 NG2D1 NG2S1 CG2O1 9 180.000000 5.439200 2
+ CG2D1 NG2D1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG2DC1 NG2D1 NG2S1 CG2O1 9 180.000000 14.225600 1
+ CG2DC1 NG2D1 NG2S1 CG2O1 9 180.000000 5.439200 2
+ CG2DC1 NG2D1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG2DC2 NG2D1 NG2S1 CG2O1 9 180.000000 14.225600 1
+ CG2DC2 NG2D1 NG2S1 CG2O1 9 180.000000 5.439200 2
+ CG2DC2 NG2D1 NG2S1 HGP1 9 180.000000 10.460000 2
+ CG2R51 NG2R50 NG2R50 NG2R51 9 180.000000 58.576000 2
+ CG2R51 NG2R50 NG2R50 OG2R50 9 180.000000 58.576000 2
+ CG2R52 NG2R50 NG2R51 CG2R51 9 180.000000 50.208000 2
+ CG2R52 NG2R50 NG2R51 CG2RC0 9 180.000000 35.564000 2
+ CG2R52 NG2R50 NG2R51 NG2R50 9 180.000000 39.748000 2
+ CG2R52 NG2R50 NG2R51 HGP1 9 180.000000 5.857600 2
+ CG2R53 NG2R50 NG2R51 CG2R53 9 180.000000 41.840000 2
+ CG2R53 NG2R50 NG2R51 HGP1 9 180.000000 9.623200 2
+ NG2R50 NG2R50 NG2R51 CG2R51 9 180.000000 35.564000 2
+ NG2R50 NG2R50 NG2R51 CG321 9 180.000000 10.460000 2
+ NG2R50 NG2R50 NG2R51 HGP1 9 180.000000 10.460000 2
+ CG2R52 NG2R50 NG3C51 CG3C52 9 180.000000 2.092000 2
+ CG2R52 NG2R50 NG3C51 HGP1 9 0.000000 1.046000 3
+ CG2R52 NG2R50 OG2R50 CG2R51 9 180.000000 50.208000 2
+ CG2R53 NG2R50 OG2R50 CG2R53 9 180.000000 37.656000 2
+ NG2R50 NG2R50 OG2R50 CG2R51 9 180.000000 35.564000 2
+ CG2R52 NG2R50 SG2R50 CG2R51 9 180.000000 37.656000 2
+ CG2R51 NG2R57 NG2R57 CG2R51 9 0.000000 1.255200 2
+ CG2R61 NG2R62 NG2R62 CG2R61 9 180.000000 5.020800 2
+ CG2R61 NG2R62 NG2R62 CG2R64 9 180.000000 2.092000 2
+ CG331 NG2S3 PG1 OG2P1 9 0.000000 1.673600 3
+ CG331 NG2S3 PG1 OG2P1 9 0.000000 2.092000 4
+ CG331 NG2S3 PG1 OG303 9 0.000000 7.949600 2
+ CG3C51 NG2S3 PG1 OG2P1 9 0.000000 1.673600 3
+ CG3C51 NG2S3 PG1 OG2P1 9 0.000000 2.092000 4
+ CG3C51 NG2S3 PG1 OG303 9 0.000000 7.949600 2
+ HGP1 NG2S3 PG1 OG2P1 9 0.000000 0.209200 3
+ HGP1 NG2S3 PG1 OG303 9 0.000000 0.209200 3
+ CG321 NG2S3 SG3O1 OG2P1 9 0.000000 2.309568 3
+ CG331 NG2S3 SG3O1 OG2P1 9 0.000000 2.246808 3
+ HGP1 NG2S3 SG3O1 OG2P1 9 0.000000 0.209200 3
+ CG2R61 NG311 SG3O2 CG2R61 9 180.000000 5.020800 1
+ CG2R61 NG311 SG3O2 CG2R61 9 0.000000 5.857600 2
+ CG2R61 NG311 SG3O2 CG331 9 0.000000 9.204800 2
+ CG2R61 NG311 SG3O2 CG331 9 0.000000 0.836800 3
+ CG2R61 NG311 SG3O2 OG2P1 9 0.000000 0.836800 3
+ CG321 NG311 SG3O2 CG2R61 9 0.000000 6.276000 2
+ CG321 NG311 SG3O2 CG2R61 9 0.000000 2.092000 3
+ CG321 NG311 SG3O2 CG321 9 0.000000 8.368000 2
+ CG321 NG311 SG3O2 CG321 9 0.000000 1.255200 3
+ CG321 NG311 SG3O2 CG331 9 0.000000 8.368000 2
+ CG321 NG311 SG3O2 CG331 9 0.000000 1.255200 3
+ CG321 NG311 SG3O2 NG311 9 180.000000 3.773968 1
+ CG321 NG311 SG3O2 NG311 9 0.000000 2.656840 2
+ CG321 NG311 SG3O2 NG311 9 0.000000 6.041696 3
+ CG321 NG311 SG3O2 NG311 9 180.000000 1.389088 4
+ CG321 NG311 SG3O2 OG2P1 9 0.000000 0.836800 3
+ CG331 NG311 SG3O2 CG2R61 9 0.000000 6.276000 2
+ CG331 NG311 SG3O2 CG2R61 9 0.000000 2.092000 3
+ CG331 NG311 SG3O2 CG331 9 0.000000 8.368000 2
+ CG331 NG311 SG3O2 CG331 9 0.000000 0.836800 3
+ CG331 NG311 SG3O2 NG311 9 180.000000 5.255104 1
+ CG331 NG311 SG3O2 NG311 9 0.000000 2.610816 2
+ CG331 NG311 SG3O2 NG311 9 0.000000 7.639984 3
+ CG331 NG311 SG3O2 NG311 9 180.000000 0.895376 4
+ CG331 NG311 SG3O2 NG311 9 180.000000 1.100392 6
+ CG331 NG311 SG3O2 OG2P1 9 0.000000 0.836800 3
+ HGP1 NG311 SG3O2 CG2R61 9 180.000000 5.020800 1
+ HGP1 NG311 SG3O2 CG2R61 9 0.000000 4.602400 2
+ HGP1 NG311 SG3O2 CG2R61 9 0.000000 2.092000 3
+ HGP1 NG311 SG3O2 CG321 9 180.000000 5.439200 1
+ HGP1 NG311 SG3O2 CG321 9 0.000000 5.020800 2
+ HGP1 NG311 SG3O2 CG321 9 0.000000 0.836800 3
+ HGP1 NG311 SG3O2 CG331 9 180.000000 4.184000 1
+ HGP1 NG311 SG3O2 CG331 9 0.000000 4.602400 2
+ HGP1 NG311 SG3O2 CG331 9 0.000000 0.836800 3
+ HGP1 NG311 SG3O2 NG311 9 180.000000 2.405800 1
+ HGP1 NG311 SG3O2 NG311 9 0.000000 4.531272 2
+ HGP1 NG311 SG3O2 NG311 9 180.000000 4.012456 3
+ HGP1 NG311 SG3O2 NG311 9 180.000000 0.832616 4
+ HGP1 NG311 SG3O2 NG311 9 0.000000 0.995792 6
+ HGP1 NG311 SG3O2 OG2P1 9 0.000000 0.836800 3
+ HGP1 NG321 SG3O2 CG2R61 9 180.000000 6.276000 1
+ HGP1 NG321 SG3O2 CG2R61 9 0.000000 5.020800 2
+ HGP1 NG321 SG3O2 CG2R61 9 0.000000 0.418400 3
+ HGP1 NG321 SG3O2 CG331 9 180.000000 3.765600 1
+ HGP1 NG321 SG3O2 CG331 9 0.000000 6.694400 2
+ HGP1 NG321 SG3O2 CG331 9 0.000000 0.418400 3
+ HGP1 NG321 SG3O2 OG2P1 9 0.000000 0.836800 3
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+ CN7 CN7 ON5 HN5 9 0.000000 6.276000 1
+ CN8 CN7 ON5 HN5 9 0.000000 2.092000 3
+ CN8 CN7 ON5 HN5 9 180.000000 4.184000 2
+ CN8 CN7 ON5 HN5 9 0.000000 1.255200 1
+ CN7B CN7 ON5 HN5 9 0.000000 3.347200 3
+ CN7B CN7 ON5 HN5 9 0.000000 2.092000 1
+ HN7 CN7 ON5 HN5 9 0.000000 0.000000 3
+ HN7 CN7 CN8B HN8 9 0.000000 0.815880 3
+ HN7 CN7 CN7 CN8B 9 0.000000 0.815880 3
+ CN8 CN7B ON6 CN7 9 180.000000 2.510400 6
+ CN8 CN7 CN7 ON6 9 0.000000 4.184000 4
+ CN8 CN7 CN7 ON6 9 180.000000 1.255200 5
+ CN8 CN7 CN7 ON6 9 180.000000 1.255200 6
+ CN7B CN7B ON6B CN7 9 0.000000 0.000000 6
+ CN7B CN7 CN7 ON6B 9 0.000000 0.000000 3
+ CN7 CN8 CN7B ON6 9 0.000000 2.510400 6
+ CN7 CN7B CN7B ON6B 9 0.000000 1.673600 6
+ CN7B CN8 CN7 CN7 9 0.000000 1.673600 6
+ CN7B CN7B CN7 CN7 9 0.000000 0.000000 6
+ CN7 CN7 ON6 CN7B 9 180.000000 2.510400 6
+ CN7 CN7 ON6B CN7B 9 180.000000 0.000000 6
+ HN7 CN7 CN7 CN8 9 0.000000 0.000000 3
+ HN7 CN7 CN8 CN7B 9 0.000000 0.815880 3
+ HN7 CN7B CN8 CN7 9 0.000000 0.815880 3
+ HN7 CN7 CN7 ON6 9 180.000000 0.815880 3
+ HN8 CN8 CN7B ON6 9 0.000000 0.815880 3
+ HN7 CN7 CN7 HN7 9 0.000000 0.815880 3
+ HN7 CN7B CN8 HN8 9 0.000000 0.815880 3
+ HN7 CN7 CN8 HN8 9 0.000000 0.815880 3
+ HN8 CN8 CN7 CN7 9 0.000000 0.815880 3
+ HN7 CN7 ON6 CN7B 9 0.000000 0.815880 3
+ HN7 CN7B ON6 CN7 9 0.000000 0.000000 3
+ HN7 CN7 CN7 ON6B 9 180.000000 0.815880 3
+ HN9 CN9 CN7 ON6B 9 180.000000 0.815880 3
+ HN8 CN8 CN7B ON6B 9 0.000000 0.815880 3
+ HN7 CN7B ON6B CN7 9 0.000000 0.000000 3
+ HN7 CN7 ON6B CN7B 9 0.000000 0.815880 3
+ HN7 CN7 CN7B CN7B 9 0.000000 0.815880 3
+ HN7 CN7B CN7B CN7 9 0.000000 0.815880 3
+ HN7 CN7B CN7B ON6B 9 0.000000 0.815880 3
+ NN2 CN7B CN7B ON5 9 0.000000 0.000000 3
+ NN2B CN7B CN7B ON5 9 0.000000 0.000000 3
+ ON5 CN7B CN7B HN7 9 0.000000 0.000000 3
+ HN7 CN7B CN7B HN7 9 0.000000 0.000000 3
+ CN7 CN7 CN7B ON5 9 0.000000 0.000000 3
+ ON6B CN7B CN7B ON5 9 0.000000 0.000000 3
+ ON5 CN7B CN7 ON2 9 0.000000 0.000000 3
+ ON5 CN7 CN7B ON2 9 0.000000 0.000000 3
+ ON5 CN7B CN7 ON5 9 0.000000 0.000000 3
+ HN7 CN7B ON5 HN5 9 0.000000 0.000000 3
+ HN5 ON5 CN7B CN7B 9 180.000000 0.000000 6
+ HN5 ON5 CN7B CN7B 9 0.000000 1.673600 3
+ HN5 ON5 CN7B CN7B 9 0.000000 1.673600 2
+ HN5 ON5 CN7B CN7B 9 0.000000 3.347200 1
+ HN5 ON5 CN7B CN7 9 0.000000 0.836800 3
+ HN5 ON5 CN7B CN7 9 180.000000 0.000000 2
+ HN5 ON5 CN7B CN7 9 0.000000 8.368000 1
+ CN7B ON6 CN7 CN9 9 0.000000 0.000000 3
+ HN7 CN7 CN7B ON5 9 0.000000 0.815880 3
+ HN7 CN7B CN7 CN7 9 0.000000 0.815880 3
+ HN7 CN7 CN7 CN7B 9 0.000000 0.815880 3
+ HN7 CN7 CN7B HN7 9 0.000000 0.815880 3
+ OCL CCL CTL1 NH3L 9 180.000000 13.388800 2
+ OBL CL CTL2 HAL2 9 180.000000 0.000000 6
+ OBL CL CTL3 HAL3 9 180.000000 0.000000 6
+ OSL CL CTL2 HAL2 9 180.000000 0.000000 6
+ OSL CL CTL3 HAL3 9 180.000000 0.000000 6
+ OSLP CL CTL2 HAL2 9 180.000000 0.000000 6
+ OSLP CL CTL3 HAL3 9 180.000000 0.000000 6
+ OBL CL OSL CTL1 9 180.000000 4.037560 1
+ OBL CL OSL CTL1 9 180.000000 16.108400 2
+ OBL CL OSL CTL2 9 180.000000 4.037560 1
+ OBL CL OSL CTL2 9 180.000000 16.108400 2
+ OBL CL OSL CTL3 9 180.000000 4.037560 1
+ OBL CL OSL CTL3 9 180.000000 16.108400 2
+ HAL2 CTL2 CL OHL 9 180.000000 0.000000 6
+ HAL3 CTL3 CL OHL 9 180.000000 0.000000 6
+ PL OSLP CTL2 CTL1 9 0.000000 1.702888 2
+ PL OSLP CTL2 CTL1 9 180.000000 1.008344 1
+ PL OSLP CTL2 CTL2 9 0.000000 1.702888 2
+ PL OSLP CTL2 CTL2 9 180.000000 1.008344 1
+ OSL PL OSL CTL1 9 180.000000 5.020800 1
+ OSL PL OSL CTL1 9 180.000000 0.418400 2
+ OSL PL OSL CTL1 9 180.000000 0.418400 3
+ OSLP PL OSLP CTL1 9 180.000000 5.020800 1
+ OSLP PL OSLP CTL1 9 180.000000 0.418400 2
+ OSLP PL OSLP CTL1 9 180.000000 0.418400 3
+ OSLP PL OSLP CTL2 9 180.000000 5.020800 1
+ OSLP PL OSLP CTL2 9 180.000000 0.418400 2
+ OSLP PL OSLP CTL2 9 180.000000 0.418400 3
+ O2L PL OSLP CTL2 9 0.000000 0.418400 3
+ O2L PL OSL CTL2 9 0.000000 0.418400 3
+ OSLP PL OSLP CTL3 9 180.000000 5.020800 1
+ OSLP PL OSLP CTL3 9 180.000000 0.418400 2
+ OSLP PL OSLP CTL3 9 180.000000 0.418400 3
+ O2L PL OSLP CTL1 9 0.000000 0.418400 3
+ O2L PL OSL CTL1 9 0.000000 0.418400 3
+ O2L PL OSLP CTL3 9 0.000000 0.418400 3
+ O2L PL OSL CTL3 9 0.000000 0.418400 3
+ OHL PL OSL CTL1 9 0.000000 3.974800 2
+ OHL PL OSL CTL1 9 0.000000 2.092000 3
+ OHL PL OSL CTL2 9 0.000000 3.974800 2
+ OHL PL OSL CTL2 9 0.000000 2.092000 3
+ OHL PL OSL CTL3 9 0.000000 3.974800 2
+ OHL PL OSL CTL3 9 0.000000 2.092000 3
+ OHL PL OSLP CTL2 9 0.000000 3.974800 2
+ OHL PL OSLP CTL2 9 0.000000 2.092000 3
+ OHL PL OSLP CTL3 9 0.000000 3.974800 2
+ OHL PL OSLP CTL3 9 0.000000 2.092000 3
+ CTL1 CTL2 CL OSL 9 180.000000 -0.627600 1
+ CTL1 CTL2 CL OSL 9 180.000000 2.217520 2
+ CTL2 CTL2 CL OSL 9 0.000000 0.000000 6
+ CTL2 CTL2 CL OSL 9 180.000000 0.125520 3
+ CTL2 CTL2 CL OSL 9 180.000000 1.807488 2
+ CTL2 CTL2 CL OSL 9 0.000000 1.389088 1
+ CTL3 CTL2 CL OSL 9 0.000000 0.000000 6
+ CTL3 CTL2 CL OSL 9 180.000000 0.125520 3
+ CTL3 CTL2 CL OSL 9 180.000000 1.807488 2
+ CTL3 CTL2 CL OSL 9 0.000000 1.389088 1
+ CTL3 CTL2 CTL2 CL 9 180.000000 0.000000 5
+ CTL3 CTL2 CTL2 CL 9 180.000000 1.326328 3
+ CTL3 CTL2 CTL2 CL 9 0.000000 2.330488 2
+ CTL3 CTL2 CTL2 CL 9 0.000000 3.150552 1
+ CTL2 CTL2 CTL2 CL 9 180.000000 0.000000 5
+ CTL2 CTL2 CTL2 CL 9 180.000000 1.326328 3
+ CTL2 CTL2 CTL2 CL 9 0.000000 2.330488 2
+ CTL2 CTL2 CTL2 CL 9 0.000000 3.150552 1
+ OSL CTL2 CTL1 OSL 9 60.000000 -1.794936 4
+ OSL CTL2 CTL1 OSL 9 0.000000 2.568976 3
+ OSL CTL2 CTL1 OSL 9 60.000000 -0.481160 2
+ OSL CTL2 CTL1 OSL 9 180.000000 2.941352 1
+ OSLP CTL2 CTL1 OSL 9 0.000000 0.000000 4
+ OSLP CTL2 CTL1 OSL 9 180.000000 2.539688 3
+ OSLP CTL2 CTL1 OSL 9 60.000000 1.062736 2
+ OSLP CTL2 CTL1 OSL 9 180.000000 8.434944 1
+ OSLP CTL2 CTL2 OSL 9 0.000000 0.000000 4
+ OSLP CTL2 CTL2 OSL 9 180.000000 2.539688 3
+ OSLP CTL2 CTL2 OSL 9 60.000000 1.062736 2
+ OSLP CTL2 CTL2 OSL 9 180.000000 8.434944 1
+ CTL3 CTL1 CTL2 OSL 9 0.000000 0.000000 3
+ CTL2 CTL1 CTL2 OSL 9 0.000000 0.000000 3
+ CTL3 CTL2 CTL2 OSL 9 0.000000 0.000000 3
+ CTL2 CTL2 CTL2 OSL 9 0.000000 0.000000 3
+ CL OSL CTL1 CTL2 9 0.000000 0.000000 4
+ CL OSL CTL1 CTL2 9 180.000000 0.627600 3
+ CL OSL CTL1 CTL2 9 180.000000 6.079352 2
+ CL OSL CTL1 CTL2 9 180.000000 3.502008 1
+ CL OSL CTL1 CTL3 9 0.000000 0.000000 4
+ CL OSL CTL1 CTL3 9 180.000000 0.627600 3
+ CL OSL CTL1 CTL3 9 180.000000 6.079352 2
+ CL OSL CTL1 CTL3 9 180.000000 3.502008 1
+ CL OSL CTL2 CTL1 9 180.000000 1.117128 3
+ CL OSL CTL2 CTL1 9 0.000000 0.723832 2
+ CL OSL CTL2 CTL1 9 180.000000 3.267704 1
+ NH3L CTL2 CTL2 OHL 9 180.000000 2.928800 1
+ NH3L CTL2 CTL2 OSLP 9 180.000000 2.928800 1
+ NTL CTL2 CTL2 OHL 9 180.000000 17.991200 1
+ NTL CTL2 CTL2 OHL 9 180.000000 -1.673600 3
+ NTL CTL2 CTL2 OSLP 9 180.000000 13.807200 1
+ NTL CTL2 CTL2 OSLP 9 180.000000 -1.673600 3
+ CTL3 CTL2 CTL2 CTL3 9 0.000000 0.251040 2
+ CTL3 CTL2 CTL2 CTL3 9 0.000000 0.146440 5
+ CTL2 CTL2 CTL2 CTL3 9 0.000000 0.677808 2
+ CTL2 CTL2 CTL2 CTL3 9 180.000000 0.196648 3
+ CTL2 CTL2 CTL2 CTL3 9 0.000000 0.439320 4
+ CTL2 CTL2 CTL2 CTL3 9 0.000000 0.740568 5
+ CTL2 CTL2 CTL2 CTL2 9 0.000000 0.422584 2
+ CTL2 CTL2 CTL2 CTL2 9 180.000000 0.594128 3
+ CTL2 CTL2 CTL2 CTL2 9 0.000000 0.309616 4
+ CTL2 CTL2 CTL2 CTL2 9 0.000000 0.405848 5
+ HAL3 CTL3 OSL SL 9 0.000000 0.000000 3
+ CTL2 OSL SL O2L 9 0.000000 0.000000 3
+ CTL3 OSL SL O2L 9 0.000000 0.000000 3
+ HEL1 CEL1 CEL1 HEL1 9 180.000000 4.184000 2
+ CTL3 CEL1 CEL1 HEL1 9 180.000000 4.184000 2
+ CTL2 CEL1 CEL2 HEL2 9 180.000000 21.756800 2
+ CTL3 CEL1 CEL2 HEL2 9 180.000000 21.756800 2
+ HEL1 CEL1 CEL2 HEL2 9 180.000000 21.756800 2
+ CEL1 CEL1 CTL2 HAL2 9 180.000000 1.255200 3
+ CEL1 CEL1 CTL3 HAL3 9 180.000000 1.255200 3
+ CEL1 CEL1 CTL2 CTL3 9 180.000000 3.807440 1
+ CEL1 CEL1 CTL2 CTL3 9 180.000000 0.753120 2
+ CEL1 CEL1 CTL2 CTL3 9 180.000000 0.711280 3
+ CEL1 CEL1 CTL2 CTL2 9 180.000000 3.807440 1
+ CEL1 CEL1 CTL2 CTL2 9 180.000000 0.753120 2
+ CEL1 CEL1 CTL2 CTL2 9 180.000000 0.711280 3
+ CEL1 CTL2 CTL2 CL 9 180.000000 0.585760 1
+ CEL1 CTL2 CTL2 CL 9 0.000000 0.711280 2
+ CEL1 CTL2 CTL2 CL 9 180.000000 0.209200 3
+ CEL1 CTL2 CTL2 CTL2 9 180.000000 0.585760 1
+ CEL1 CTL2 CTL2 CTL2 9 0.000000 0.711280 2
+ CEL1 CTL2 CTL2 CTL2 9 180.000000 0.209200 3
+ CEL1 CTL2 CTL2 CTL3 9 180.000000 0.585760 1
+ CEL1 CTL2 CTL2 CTL3 9 0.000000 0.711280 2
+ CEL1 CTL2 CTL2 CTL3 9 180.000000 0.209200 3
+ CEL2 CEL1 CTL2 CTL2 9 180.000000 2.092000 1
+ CEL2 CEL1 CTL2 CTL2 9 180.000000 5.439200 3
+ CEL2 CEL1 CTL2 CTL3 9 180.000000 2.092000 1
+ CEL2 CEL1 CTL2 CTL3 9 180.000000 5.439200 3
+ CEL2 CEL1 CTL2 HAL2 9 0.000000 0.502080 3
+ CEL2 CEL1 CTL3 HAL3 9 180.000000 0.209200 3
+ HEL1 CEL1 CTL2 CTL2 9 0.000000 0.502080 3
+ HEL1 CEL1 CTL2 CTL3 9 0.000000 0.502080 3
+ HEL1 CEL1 CTL2 HAL2 9 0.000000 0.000000 3
+ HEL1 CEL1 CTL3 HAL3 9 0.000000 0.000000 3
+ CEL2 CEL1 CTL2 CEL1 9 180.000000 5.020800 1
+ CEL2 CEL1 CTL2 CEL1 9 180.000000 1.673600 2
+ CEL2 CEL1 CTL2 CEL1 9 180.000000 5.439200 3
+ CEL1 CTL2 CEL1 HEL1 9 0.000000 0.000000 2
+ CEL1 CTL2 CEL1 HEL1 9 0.000000 0.000000 3
+ CEL1 CEL1 CTL2 CEL1 9 180.000000 3.556400 1
+ CEL1 CEL1 CTL2 CEL1 9 180.000000 1.255200 2
+ CEL1 CEL1 CTL2 CEL1 9 0.000000 1.087840 3
+ CEL1 CEL1 CTL2 CEL1 9 0.000000 0.401664 4
+ CC31A CC30A CC32A HCA2A 9 0.000000 0.836800 3
+ CC32A CC30A CC32A HCA2A 9 0.000000 0.836800 3
+ CC33A CC30A CC32A HCA2A 9 0.000000 0.836800 3
+ CC31A CC30A CC33A HCA3A 9 0.000000 0.836800 3
+ CC32A CC30A CC32A HCA3A 9 0.000000 0.836800 3
+ CC33A CC30A CC32A HCA3A 9 0.000000 0.836800 3
+ HCA1A CC31A CC31A HCA1A 9 0.000000 0.836800 3
+ CC31A CC31A CC31A HCA1A 9 0.000000 0.836800 3
+ CC32A CC31A CC31A HCA1A 9 0.000000 0.836800 3
+ CC33A CC31A CC31A HCA1A 9 0.000000 0.836800 3
+ HCA1A CC31A CC32A HCA2A 9 0.000000 0.836800 3
+ HCA1A CC31A CC32A CC31A 9 0.000000 0.836800 3
+ HCA1A CC31A CC32A CC32A 9 0.000000 0.836800 3
+ HCA1A CC31A CC32A CC33A 9 0.000000 0.836800 3
+ CC31A CC31A CC32A HCA2A 9 0.000000 0.836800 3
+ CC32A CC31A CC32A HCA2A 9 0.000000 0.836800 3
+ CC33A CC31A CC32A HCA2A 9 0.000000 0.836800 3
+ HCA1A CC31A CC33A HCA3A 9 0.000000 0.836800 3
+ CC31A CC31A CC33A HCA3A 9 0.000000 0.836800 3
+ CC32A CC31A CC33A HCA3A 9 0.000000 0.836800 3
+ CC33A CC31A CC33A HCA3A 9 0.000000 0.836800 3
+ HCA2A CC32A CC32A HCA2A 9 0.000000 0.794960 3
+ CC30A CC32A CC32A HCA2A 9 0.000000 0.794960 3
+ CC31A CC32A CC32A HCA2A 9 0.000000 0.794960 3
+ CC32A CC32A CC32A HCA2A 9 0.000000 0.794960 3
+ CC33A CC32A CC32A HCA2A 9 0.000000 0.794960 3
+ HCA2A CC32A CC33A HCA3A 9 0.000000 0.669440 3
+ CC30A CC32A CC33A HCA3A 9 0.000000 0.669440 3
+ CC31A CC32A CC33A HCA3A 9 0.000000 0.669440 3
+ CC32A CC32A CC33A HCA3A 9 0.000000 0.669440 3
+ CC33A CC32A CC33A HCA3A 9 0.000000 0.669440 3
+ CC33A CC32A CC32A CC33A 9 180.000000 0.133009 6
+ CC33A CC32A CC32A CC33A 9 0.000000 0.159787 2
+ CC33A CC32A CC32A CC32A 9 0.000000 0.853159 5
+ CC33A CC32A CC32A CC32A 9 0.000000 0.452876 4
+ CC33A CC32A CC32A CC32A 9 180.000000 0.340285 3
+ CC33A CC32A CC32A CC32A 9 0.000000 0.629734 2
+ CC32A CC32A CC32A CC32A 9 0.000000 0.470742 5
+ CC32A CC32A CC32A CC32A 9 0.000000 0.395723 4
+ CC32A CC32A CC32A CC32A 9 180.000000 0.626554 3
+ CC32A CC32A CC32A CC32A 9 0.000000 0.269868 2
+ CC33A CC325A CC325A CC33A 9 0.000000 0.669440 3
+ CC33A CC325A CC325A CC325A 9 0.000000 0.669440 3
+ CC33A CC325A CC325A HCA25A 9 0.000000 0.669440 3
+ HCA25A CC325A CC325A HCA25A 9 0.000000 0.669440 3
+ CC325A CC325A CC325A HCA25A 9 0.000000 0.669440 3
+ CC325A CC325A CC325A CC325A 9 180.000000 1.715440 3
+ CC33A CC325B CC325B CC33A 9 0.000000 0.794960 3
+ CC33A CC325B CC325B CC325B 9 0.000000 0.794960 3
+ CC33A CC325B CC325B HCA25A 9 0.000000 0.794960 3
+ HCA25A CC325B CC325B HCA25A 9 0.000000 0.794960 3
+ CC325B CC325B CC325B HCA25A 9 0.000000 0.794960 3
+ OC305A CC325B CC325B HCA25A 9 0.000000 0.794960 3
+ HCA25A CC325B CC33A HCA3A 9 0.000000 0.669440 3
+ CC325B CC325B CC33A HCA3A 9 0.000000 0.669440 3
+ OC305A CC325B CC33A HCA3A 9 0.000000 0.669440 3
+ CC325B CC325B CC325B CC325B 9 180.000000 1.715440 3
+ HCA25A CC325B OC305A CC325B 9 0.000000 1.255200 3
+ OC305A CC325B CC325B CC325B 9 0.000000 0.000000 3
+ CC325B CC325B OC305A CC325B 9 0.000000 2.092000 3
+ CC33A CC325B OC305A CC325B 9 0.000000 1.255200 3
+ CC33A CC326A CC326A CC33A 9 0.000000 0.794960 3
+ CC33A CC326A CC326A CC326A 9 0.000000 0.794960 3
+ CC33A CC326A CC326A HCA2A 9 0.000000 0.794960 3
+ HCA2A CC326A CC326A HCA2A 9 0.000000 0.794960 3
+ HCA2A CC326A CC326A CC326A 9 0.000000 0.794960 3
+ OC30A CC326A CC326A HCA2A 9 0.000000 0.794960 3
+ HCA2A CC326A CC33A HCA3A 9 0.000000 0.669440 3
+ CC326A CC326A CC33A HCA3A 9 0.000000 0.669440 3
+ OC30A CC326A CC33A HCA3A 9 0.000000 0.669440 3
+ CC326A CC326A CC326A CC326A 9 0.000000 2.084845 2
+ CC326A CC326A CC326A CC326A 9 0.000000 -2.503873 3
+ CC326A CC326A CC326A CC326A 9 0.000000 1.746653 4
+ CC326A CC326A CC326A CC326A 9 0.000000 -1.038845 5
+ OC30A CC326A CC326A CC326A 9 0.000000 -0.804374 1
+ OC30A CC326A CC326A CC326A 9 0.000000 -4.184000 2
+ OC30A CC326A CC326A CC326A 9 0.000000 2.487681 3
+ OC30A CC326A CC326A CC326A 9 0.000000 -0.328946 4
+ HCA3A CC33A CC33A HCA3A 9 0.000000 0.638060 3
+ CC326A OC30A CC326A CC326A 9 0.000000 -2.205052 1
+ CC326A OC30A CC326A CC326A 9 0.000000 2.857546 2
+ CC326A OC30A CC326A CC326A 9 0.000000 -0.877678 3
+ CC326A OC30A CC326A CC326A 9 0.000000 0.629148 4
+ CC326A OC30A CC326A HCA2A 9 0.000000 1.188256 3
+ HCA2A CC32A CC32A OC30A 9 0.000000 0.794960 3
+ OC30A CC32A CC33A HCA3A 9 0.000000 0.669440 3
+ HCA2A CC32A OC30A CC32A 9 0.000000 1.188256 3
+ HCA3A CC33A OC30A CC32A 9 0.000000 1.188256 3
+ HCA2A CC32A OC30A CC33A 9 0.000000 1.188256 3
+ HCA3A CC33A OC30A CC33A 9 0.000000 1.188256 3
+ CC33A CC32A OC30A CC32A 9 0.000000 1.673600 1
+ CC33A CC32A OC30A CC32A 9 0.000000 2.050160 3
+ CC33A CC32A OC30A CC33A 9 0.000000 1.673600 1
+ CC33A CC32A OC30A CC33A 9 0.000000 2.050160 3
+ CC32A CC32A OC30A CC33A 9 0.000000 2.384880 1
+ CC32A CC32A OC30A CC33A 9 0.000000 1.213360 2
+ CC32A CC32A OC30A CC33A 9 0.000000 1.799120 3
+ CC32A CC32A OC30A CC32A 9 0.000000 2.384880 1
+ CC32A CC32A OC30A CC32A 9 0.000000 1.213360 2
+ CC32A CC32A OC30A CC32A 9 0.000000 1.799120 3
+ OC30A CC32A CC32A OC30A 9 180.000000 2.468560 1
+ OC30A CC32A CC32A OC30A 9 0.000000 4.853440 2
+ OC30A CC32A CC32A CC33A 9 180.000000 0.669440 1
+ OC30A CC32A CC32A CC33A 9 0.000000 1.631760 2
+ OC30A CC32A CC32A CC32A 9 180.000000 0.669440 1
+ OC30A CC32A CC32A CC32A 9 0.000000 1.631760 2
+ HE2 CE2 CE1 CPB 9 180.000000 21.756800 2
+ CRL1 CRL1 CTL1 CTL2 9 0.000000 0.000000 3
+ CRL1 CTL1 CTL2 CTL3 9 180.000000 0.509611 3
+ CRL1 CTL1 CTL2 CTL3 9 180.000000 0.910020 2
+ CRL1 CTL1 CTL2 CTL3 9 180.000000 1.003323 1
+ CRL1 CTL1 CTL2 CTL2 9 180.000000 0.509611 3
+ CRL1 CTL1 CTL2 CTL2 9 180.000000 0.910020 2
+ CRL1 CTL1 CTL2 CTL2 9 180.000000 1.003323 1
+ CRL1 CRL2 CEL1 CRL1 9 180.000000 1.255200 3
+ CTL1 CRL2 CEL1 CRL1 9 180.000000 1.255200 3
+ CRL1 CTL2 CEL1 CRL1 9 180.000000 1.255200 3
+ CRL1 CRL2 CEL1 CTL1 9 180.000000 1.255200 3
+ CTL1 CTL2 CEL1 CRL1 9 180.000000 1.255200 3
+ CTL1 CRL2 CEL1 CTL1 9 180.000000 1.255200 3
+ CRL1 CTL2 CEL1 CTL1 9 180.000000 1.255200 3
+ CRL2 CEL1 CRL1 CRL1 9 180.000000 0.000000 3
+ CTL2 CEL1 CRL1 CRL1 9 180.000000 0.000000 3
+ CRL2 CEL1 CTL1 CRL1 9 180.000000 0.000000 3
+ CRL2 CEL1 CRL1 CTL1 9 180.000000 0.000000 3
+ CTL2 CEL1 CTL1 CRL1 9 180.000000 0.000000 3
+ CTL2 CEL1 CRL1 CTL1 9 180.000000 0.000000 3
+ CRL2 CEL1 CTL1 CTL1 9 180.000000 0.000000 3
+ CTL2 CEL1 CRL1 CTL3 9 180.000000 0.000000 3
+ CRL2 CEL1 CTL1 CTL3 9 180.000000 0.000000 3
+ CRL2 CEL1 CRL1 CRL2 9 180.000000 1.255200 3
+ CRL2 CEL1 CRL1 CTL2 9 180.000000 1.255200 3
+ CRL2 CEL1 CTL1 CRL2 9 180.000000 1.255200 3
+ CTL2 CEL1 CRL1 CRL2 9 180.000000 1.255200 3
+ CRL2 CEL1 CTL1 CTL2 9 180.000000 1.255200 3
+ CTL2 CEL1 CRL1 CTL2 9 180.000000 1.255200 3
+ CTL2 CEL1 CTL1 CRL2 9 180.000000 1.255200 3
+ CEL1 CEL1 CRL2 HGA2 9 180.000000 1.255200 3
+ CEL1 CEL1 CRL2 HAL2 9 180.000000 1.255200 3
+ CEL1 CEL1 CTL2 HGA2 9 180.000000 1.255200 3
+ CEL1 CEL1 CRL2 CRL1 9 180.000000 2.092000 1
+ CEL1 CEL1 CRL2 CRL1 9 180.000000 5.439200 3
+ CEL1 CEL1 CTL2 CRL1 9 180.000000 2.092000 1
+ CEL1 CEL1 CTL2 CRL1 9 180.000000 5.439200 3
+ CEL1 CEL1 CRL2 CTL1 9 180.000000 2.092000 1
+ CEL1 CEL1 CRL2 CTL1 9 180.000000 5.439200 3
+ CEL1 CEL1 CRL1 CRL2 9 180.000000 2.092000 1
+ CEL1 CEL1 CRL1 CRL2 9 180.000000 5.439200 3
+ CEL1 CEL1 CTL1 CRL2 9 180.000000 2.092000 1
+ CEL1 CEL1 CTL1 CRL2 9 180.000000 5.439200 3
+ CEL1 CEL1 CRL1 CTL2 9 180.000000 2.092000 1
+ CEL1 CEL1 CRL1 CTL2 9 180.000000 5.439200 3
+ CEL1 CEL1 CRL1 CTL3 9 180.000000 2.092000 1
+ CEL1 CEL1 CRL1 CTL3 9 180.000000 5.439200 3
+ CEL1 CEL1 CRL2 CTL3 9 180.000000 3.765600 1
+ CEL1 CEL1 CRL2 CTL3 9 180.000000 0.836800 2
+ CEL1 CRL2 CRL2 CTL3 9 180.000000 0.585760 1
+ CEL1 CRL2 CRL2 CTL3 9 0.000000 0.711280 2
+ CEL1 CRL2 CRL2 CTL3 9 180.000000 0.209200 3
+ CEL1 CRL2 CTL2 CTL3 9 180.000000 0.585760 1
+ CEL1 CRL2 CTL2 CTL3 9 0.000000 0.711280 2
+ CEL1 CRL2 CTL2 CTL3 9 180.000000 0.209200 3
+ CEL1 CTL2 CRL2 CTL3 9 180.000000 0.585760 1
+ CEL1 CTL2 CRL2 CTL3 9 0.000000 0.711280 2
+ CEL1 CTL2 CRL2 CTL3 9 180.000000 0.209200 3
+ CEL1 CEL1 CRL2 CEL1 9 180.000000 4.184000 1
+ CEL1 CEL1 CRL2 CEL1 9 0.000000 0.418400 2
+ CEL1 CEL1 CRL2 CEL1 9 180.000000 1.255200 3
+ CEL1 CEL1 CRL2 CEL1 9 0.000000 0.836800 4
+ CEL1 CEL1 CRL1 CRL1 9 180.000000 2.092000 1
+ CEL1 CEL1 CRL1 CRL1 9 180.000000 5.439200 3
+ CEL1 CEL1 CTL1 CRL1 9 180.000000 2.092000 1
+ CEL1 CEL1 CTL1 CRL1 9 180.000000 5.439200 3
+ CEL1 CEL1 CRL1 CTL1 9 180.000000 2.092000 1
+ CEL1 CEL1 CRL1 CTL1 9 180.000000 5.439200 3
+ CEL1 CEL1 CRL2 CRL2 9 180.000000 3.807440 1
+ CEL1 CEL1 CRL2 CRL2 9 180.000000 0.753120 2
+ CEL1 CEL1 CRL2 CRL2 9 180.000000 0.711280 3
+ CEL1 CEL1 CRL2 CTL2 9 180.000000 3.807440 1
+ CEL1 CEL1 CRL2 CTL2 9 180.000000 0.753120 2
+ CEL1 CEL1 CRL2 CTL2 9 180.000000 0.711280 3
+ CEL1 CEL1 CTL2 CRL2 9 180.000000 3.807440 1
+ CEL1 CEL1 CTL2 CRL2 9 180.000000 0.753120 2
+ CEL1 CEL1 CTL2 CRL2 9 180.000000 0.711280 3
+ CEL1 CRL2 CRL2 CRL2 9 180.000000 0.585760 1
+ CEL1 CRL2 CRL2 CRL2 9 0.000000 0.711280 2
+ CEL1 CRL2 CRL2 CRL2 9 180.000000 0.209200 3
+ CEL1 CRL2 CTL2 CTL2 9 180.000000 0.585760 1
+ CEL1 CRL2 CTL2 CTL2 9 0.000000 0.711280 2
+ CEL1 CRL2 CTL2 CTL2 9 180.000000 0.209200 3
+ CEL1 CTL2 CRL2 CTL2 9 180.000000 0.585760 1
+ CEL1 CTL2 CRL2 CTL2 9 0.000000 0.711280 2
+ CEL1 CTL2 CRL2 CTL2 9 180.000000 0.209200 3
+ CEL1 CTL2 CTL2 CRL2 9 180.000000 0.585760 1
+ CEL1 CTL2 CTL2 CRL2 9 0.000000 0.711280 2
+ CEL1 CTL2 CTL2 CRL2 9 180.000000 0.209200 3
+ CEL1 CRL2 CRL2 CTL2 9 180.000000 0.585760 1
+ CEL1 CRL2 CRL2 CTL2 9 0.000000 0.711280 2
+ CEL1 CRL2 CRL2 CTL2 9 180.000000 0.209200 3
+ CEL1 CRL2 CTL2 CRL2 9 180.000000 0.585760 1
+ CEL1 CRL2 CTL2 CRL2 9 0.000000 0.711280 2
+ CEL1 CRL2 CTL2 CRL2 9 180.000000 0.209200 3
+ CEL1 CTL2 CRL2 CRL2 9 180.000000 0.585760 1
+ CEL1 CTL2 CRL2 CRL2 9 0.000000 0.711280 2
+ CEL1 CTL2 CRL2 CRL2 9 180.000000 0.209200 3
+ CRL2 CEL1 CRL1 CTL3 9 180.000000 0.000000 3
+ HEL1 CEL1 CRL2 CRL1 9 0.000000 0.000000 3
+ HEL1 CEL1 CTL2 CRL1 9 0.000000 0.000000 3
+ HEL1 CEL1 CRL2 CTL1 9 0.000000 0.000000 3
+ HEL1 CEL1 CRL2 CTL2 9 0.000000 0.502080 3
+ HEL1 CEL1 CTL2 CRL2 9 0.000000 0.502080 3
+ HEL1 CEL1 CRL2 CTL3 9 0.000000 0.502080 3
+ HEL1 CEL1 CRL2 HGA2 9 0.000000 0.000000 3
+ HEL1 CEL1 CTL2 HGA2 9 0.000000 0.000000 3
+ HEL1 CEL1 CRL2 HAL2 9 0.000000 0.000000 3
+ CEL1 CRL2 CEL1 HEL1 9 0.000000 0.000000 2
+ CEL1 CRL2 CEL1 HEL1 9 0.000000 0.000000 3
+ CRL2 CEL1 CEL2 HEL2 9 180.000000 21.756800 2
+ CEL2 CEL1 CRL2 CRL2 9 180.000000 2.092000 1
+ CEL2 CEL1 CRL2 CRL2 9 180.000000 5.439200 3
+ CEL2 CEL1 CTL2 CRL2 9 180.000000 2.092000 1
+ CEL2 CEL1 CTL2 CRL2 9 180.000000 5.439200 3
+ CEL2 CEL1 CRL2 CTL2 9 180.000000 2.092000 1
+ CEL2 CEL1 CRL2 CTL2 9 180.000000 5.439200 3
+ CEL2 CEL1 CRL2 CTL3 9 180.000000 2.092000 1
+ CEL2 CEL1 CRL2 CTL3 9 180.000000 5.439200 3
+ CEL2 CEL1 CRL2 HGA2 9 0.000000 0.502080 3
+ CEL2 CEL1 CTL2 HGA2 9 0.000000 0.502080 3
+ CEL2 CEL1 CRL2 HAL2 9 0.000000 0.502080 3
+ CEL2 CEL1 CRL2 CEL1 9 180.000000 5.020800 1
+ CEL2 CEL1 CRL2 CEL1 9 180.000000 1.673600 2
+ CEL2 CEL1 CRL2 CEL1 9 180.000000 5.439200 3
+ HGA2 CRL2 CEL1 CRL1 9 0.000000 0.125520 3
+ HAL2 CRL2 CEL1 CRL1 9 0.000000 0.125520 3
+ HGA2 CTL2 CEL1 CRL1 9 0.000000 0.125520 3
+ HGA2 CRL2 CEL1 CTL1 9 0.000000 0.125520 3
+ HGA2 CTL2 CEL1 CTL1 9 0.000000 0.125520 3
+ HAL2 CRL2 CEL1 CTL1 9 0.000000 0.125520 3
+ HAL2 CTL2 CEL1 CRL1 9 0.000000 0.125520 3
+ HEL1 CEL1 CRL2 CRL2 9 0.000000 0.502080 3
+ CTL2 CTL2 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CTL2 CTL2 CG3RC1 CG3C31 9 180.000000 0.000000 2
+ HGA2 CG3C31 CG3RC1 CTL2 9 0.000000 0.815880 3
+ CG3RC1 CG3C31 CG3RC1 CTL2 9 0.000000 0.627600 3
+ CTL2 CG3RC1 CG3RC1 CG3C31 9 0.000000 0.627600 3
+ CTL2 CG3RC1 CG3RC1 HGA1 9 0.000000 0.627600 3
+ CTL2 CG3RC1 CG3RC1 CTL2 9 0.000000 0.627600 3
+ HAL2 CTL2 CG3RC1 CG3C31 9 0.000000 0.815880 3
+ HAL2 CTL2 CG3RC1 CG3RC1 9 0.000000 0.627600 3
+ CG3RC1 CG3C31 CG3RC1 CTL3 9 0.000000 0.627600 3
+ HGA2 CG3C31 CG3RC1 CTL3 9 0.000000 0.815880 3
+ HAL3 CTL3 CG3RC1 CG3RC1 9 180.000000 0.627600 3
+ HAL3 CTL3 CG3RC1 HGA1 9 0.000000 0.669440 3
+ HAL2 CTL2 CG3RC1 HGA1 9 0.000000 0.627600 3
+ HAL3 CTL3 CG3RC1 CG3C31 9 180.000000 0.627600 3
+ CG3RC1 CG3RC1 CTL2 CTL2 9 159.600000 7.154640 1
+ CG3RC1 CG3RC1 CTL2 CTL2 9 165.100000 1.548080 2
+ CG3RC1 CG3RC1 CTL2 CTL2 9 47.600000 2.426720 3
+ CG3RC1 CTL2 CTL2 CTL2 9 180.000000 0.669440 1
+ CG3RC1 CTL2 CTL2 CTL2 9 180.000000 0.041840 2
+ CG3RC1 CTL2 CTL2 CTL2 9 180.000000 0.711280 3
+ CA CA CA ON2B 9 180.000000 12.970400 2
+ HP CA CA ON2B 9 180.000000 17.572800 2
+ CA CA ON2B P 9 180.000000 5.857600 2
+ CA CA ON2B P 9 180.000000 0.836800 3
+ CA ON2B P ON4 9 0.000000 3.974800 2
+ CA ON2B P ON4 9 0.000000 2.092000 3
+ CA ON2B P ON3 9 0.000000 0.418400 3
+ ON2B P ON4 HN4 9 180.000000 6.694400 1
+ ON2B P ON4 HN4 9 0.000000 3.765600 2
+ CA CA CT2 P 9 180.000000 0.836800 2
+ CA CT2 P ON4 9 0.000000 2.092000 2
+ CA CT2 P ON4 9 180.000000 6.903600 1
+ HA2 CT2 P ON4 9 0.000000 0.418400 3
+ CA CT2 P ON3 9 0.000000 0.209200 3
+ HA2 CT2 P ON3 9 0.000000 0.418400 3
+ CT2 P ON4 HN4 9 180.000000 2.510400 1
+ CT2 P ON4 HN4 9 0.000000 4.602400 2
+ CT1 CT1 ON2 P 9 180.000000 1.673600 1
+ CT1 CT1 ON2 P 9 0.000000 1.255200 2
+ CT1 CT1 ON2 P 9 0.000000 0.418400 3
+ CT3 CT1 ON2 P 9 180.000000 1.673600 1
+ CT3 CT1 ON2 P 9 0.000000 1.255200 2
+ CT3 CT1 ON2 P 9 0.000000 0.418400 3
+ CN9 CN7 ON2 P 9 180.000000 1.673600 1
+ CN9 CN7 ON2 P 9 0.000000 1.255200 2
+ CN9 CN7 ON2 P 9 0.000000 0.418400 3
+ CT1 CT2 ON2 P 9 180.000000 2.510400 1
+ CT1 CT2 ON2 P 9 0.000000 2.719600 2
+ CT1 CT2 ON2 P 9 0.000000 0.209200 3
+ CN9 CN8 ON2 P 9 180.000000 2.510400 1
+ CN9 CN8 ON2 P 9 0.000000 2.719600 2
+ CN9 CN8 ON2 P 9 0.000000 0.209200 3
+ CT1 ON2 P ON3 9 0.000000 0.418400 3
+ CT2 ON2 P ON3 9 0.000000 0.418400 3
+ CT1 ON2 P ON4 9 0.000000 3.974800 2
+ CT1 ON2 P ON4 9 0.000000 2.092000 3
+ CT2 ON2 P ON4 9 0.000000 3.974800 2
+ CT2 ON2 P ON4 9 0.000000 2.092000 3
+ HA1 CT1 ON2 P 9 0.000000 0.000000 3
+ HA2 CT2 ON2 P 9 0.000000 0.000000 3
+ CN9 CN7 CN9 HN9 9 0.000000 0.815880 3
+ ON2 CN7 CN9 HN9 9 0.000000 0.815880 3
+ CN8B S CT2 CT2 9 180.000000 1.004160 1
+ CN7 CN8B S CT2 9 120.000000 0.836800 1
+ ON6B CN7 CN8B S 9 180.000000 14.225600 1
+ CN7 CN7 CN8B S 9 180.000000 0.836800 4
+ CN7 CN7 CN8B S 9 180.000000 3.347200 3
+ CN7 CN7 CN8B S 9 0.000000 1.673600 2
+ CN7 CN7 CN8B S 9 180.000000 10.460000 1
+ HN7 CN7 CN8B S 9 0.000000 0.815880 3
+ CT2 S CN8B HN8 9 0.000000 1.171520 3
+ HA2 CT2 S CN8B 9 0.000000 1.171520 3
+ CT3 SP CN8B CN7 9 180.000000 1.635944 1
+ CT3 SP CN8B CN7 9 0.000000 1.560632 3
+ CT3 SP CT2 CT2 9 180.000000 1.635944 1
+ CT3 SP CT2 CT2 9 0.000000 1.560632 3
+ CN8B SP CT2 CT2 9 180.000000 1.635944 1
+ CN8B SP CT2 CT2 9 0.000000 1.560632 3
+ CN7 CN8B SP CT2 9 180.000000 1.635944 1
+ CN7 CN8B SP CT2 9 0.000000 1.560632 3
+ CT2 SP CT3 HA3 9 0.000000 1.171520 3
+ HA2 CT2 SP CT3 9 0.000000 1.171520 3
+ CN8B SP CT3 HA3 9 0.000000 1.171520 3
+ HN8 CN8B SP CT3 9 0.000000 1.171520 3
+ ON6B CN7 CN8B SP 9 180.000000 14.225600 1
+ CN7 CN7 CN8B SP 9 180.000000 0.836800 4
+ CN7 CN7 CN8B SP 9 180.000000 3.347200 3
+ CN7 CN7 CN8B SP 9 0.000000 1.673600 2
+ CN7 CN7 CN8B SP 9 180.000000 10.460000 1
+ HN7 CN7 CN8B SP 9 0.000000 0.815880 3
+ CT2 SP CN8B HN8 9 0.000000 1.171520 3
+ HA2 CT2 SP CN8B 9 0.000000 1.171520 3
+ CN7B NR1 CPH1 HR3 9 180.000000 0.000000 2
+ CN7B NR1 CPH1 CPH1 9 0.000000 0.000000 1
+ CN7B NR1 CPH2 HR1 9 180.000000 0.000000 2
+ CN7B NR1 CPH2 NR2 9 180.000000 0.000000 2
+ ON6 CN7B NR1 CPH1 9 0.000000 0.836800 3
+ ON6 CN7B NR1 CPH1 9 -70.000000 2.092000 2
+ ON6 CN7B NR1 CPH1 9 180.000000 2.510400 1
+ ON6 CN7B NR1 CPH2 9 0.000000 1.255200 1
+ ON6B CN7B NR1 CPH1 9 0.000000 0.836800 3
+ ON6B CN7B NR1 CPH1 9 -70.000000 2.092000 2
+ ON6B CN7B NR1 CPH1 9 180.000000 2.510400 1
+ ON6B CN7B NR1 CPH2 9 0.000000 1.255200 1
+ CN8 CN7B NR1 CPH1 9 0.000000 0.836800 4
+ CN8 CN7B NR1 CPH2 9 180.000000 0.418400 3
+ CN8 CN7B NR1 CPH2 9 0.000000 1.255200 2
+ CN8 CN7B NR1 CPH2 9 180.000000 0.000000 1
+ CN7B CN7B NR1 CPH1 9 0.000000 0.836800 4
+ CN7B CN7B NR1 CPH2 9 180.000000 0.418400 3
+ CN7B CN7B NR1 CPH2 9 0.000000 1.255200 2
+ CN7B CN7B NR1 CPH2 9 180.000000 0.000000 1
+ HN7 CN7B NR1 CPH1 9 0.000000 0.000000 3
+ HN7 CN7B NR1 CPH2 9 0.000000 0.815880 3
+ CN8 CN8 CN7B NR1 9 0.000000 0.000000 3
+ CN7 CN7B CN7B NR1 9 0.000000 0.000000 3
+ CN8 ON6 CN7B NR1 9 0.000000 0.000000 3
+ HN8 CN8 CN7B NR1 9 0.000000 0.000000 3
+ HN7 CN7B CN7B NR1 9 0.000000 0.000000 3
+ NR1 CN7B CN7B ON5 9 0.000000 0.000000 3
+ CN7B ON6 CN7 CN8 9 0.000000 0.000000 3
+ CN7 ON6 CN7B NR1 9 0.000000 0.000000 3
+ CN7 ON6B CN7B NR1 9 0.000000 0.000000 3
+ NR1 CN7B CN8 CN7 9 0.000000 0.000000 3
+ CC321C OC3C61 CC311D NC2D1 9 0.000000 2.594080 1
+ CC321C OC3C61 CC311D NC2D1 9 0.000000 6.443360 2
+ CC321C OC3C61 CC311D NC2D1 9 0.000000 2.008320 3
+ HCP1 NC2D1 CC311D OC3C61 9 0.000000 0.000000 1
+ NC2D1 CC311D CC311D NC2D1 9 180.000000 2.468560 1
+ NC2D1 CC311D CC311D NC2D1 9 0.000000 4.853440 2
+ CC311D NC2D1 CC2O1 OC2D1 9 180.000000 10.460000 2
+ CC311D NC2D1 CC2O1 CC331 9 0.000000 6.694400 1
+ CC311D NC2D1 CC2O1 CC331 9 180.000000 10.460000 2
+ HCP1 NC2D1 CC311D HCA1 9 0.000000 0.000000 1
+ CC2O1 NC2D1 CC311D HCA1 9 0.000000 0.000000 1
+ HCP1 NC2D1 CC311D CC321C 9 0.000000 0.000000 1
+ HCA2 CC321C CC311D NC2D1 9 0.000000 0.836800 3
+ CC321C CC321C CC311D NC2D1 9 0.000000 0.836800 3
+ CC311D CC311D NC2D1 HCP1 9 0.000000 0.000000 1
+ HCA1 CC311D CC311D NC2D1 9 0.000000 0.836800 3
+ NC2D1 CC311D CC311D CC321C 9 0.000000 0.836800 3
+ OC3C61 CC311D CC311D NC2D1 9 0.000000 0.836800 3
+ NC2D1 CC3162 OC3C61 CC3163 9 0.000000 2.594080 1
+ NC2D1 CC3162 OC3C61 CC3163 9 0.000000 6.443360 2
+ NC2D1 CC3162 OC3C61 CC3163 9 0.000000 2.008320 3
+ NC2D1 CC3162 OC3C61 CC3263 9 0.000000 2.594080 1
+ NC2D1 CC3162 OC3C61 CC3263 9 0.000000 6.443360 2
+ NC2D1 CC3162 OC3C61 CC3263 9 0.000000 2.008320 3
+ HCP1 NC2D1 CC3162 OC3C61 9 0.000000 0.000000 1
+ NC2D1 CC3162 CC3161 NC2D1 9 180.000000 2.468560 1
+ NC2D1 CC3162 CC3161 NC2D1 9 0.000000 4.853440 2
+ CC3162 NC2D1 CC2O1 OC2D1 9 180.000000 10.460000 2
+ CC3162 NC2D1 CC2O1 CC331 9 0.000000 6.694400 1
+ CC3162 NC2D1 CC2O1 CC331 9 180.000000 10.460000 2
+ HCA1 CC3162 NC2D1 HCP1 9 0.000000 0.000000 1
+ HCA1 CC3162 NC2D1 CC2O1 9 0.000000 0.000000 1
+ NC2D1 CC3162 CC3161 HCA1 9 0.000000 0.836800 3
+ NC2D1 CC3162 CC3161 CC3161 9 0.000000 0.836800 3
+ HCP1 NC2D1 CC3162 CC3161 9 0.000000 0.000000 1
+ NC2D1 CC3162 CC3161 OC311 9 0.000000 0.836800 3
+ CC311D CC311D NC2D1 CC2O1 9 180.000000 2.092000 1
+ CC2O1 NC2D1 CC311D CC321C 9 180.000000 2.092000 1
+ CC2O1 NC2D1 CC311D OC3C61 9 180.000000 11.296800 1
+ CC2O1 NC2D1 CC311D OC3C61 9 0.000000 5.355520 2
+ CC2O1 NC2D1 CC3162 CC3161 9 180.000000 2.092000 1
+ CC2O1 NC2D1 CC3162 OC3C61 9 180.000000 11.296800 1
+ CC2O1 NC2D1 CC3162 OC3C61 9 0.000000 5.355520 2
+ NH3 CT1 CC321 HCA2 9 0.000000 0.836800 3
+ NH1 CT1 CC321 HCA2 9 0.000000 0.836800 3
+ NH3 CT1 CC321 CC2O1 9 0.000000 0.836800 3
+ NH1 CT1 CC321 CC2O1 9 0.000000 0.836800 3
+ CT1 CC321 CC2O1 OC2D1 9 180.000000 0.209200 6
+ CT1 CC321 CC2O1 NC2D1 9 180.000000 0.209200 6
+ HB1 CT1 CC321 HCA2 9 0.000000 0.836800 3
+ HB2 CT1 CC321 HCA2 9 0.000000 0.836800 3
+ HB1 CT1 CC321 CC2O1 9 0.000000 0.836800 3
+ HB2 CT1 CC321 CC2O1 9 0.000000 0.836800 3
+ CC321 CC2O1 NC2D1 HCP1 9 180.000000 10.460000 2
+ CC321 CC2O1 NC2D1 CC3162 9 0.000000 6.694400 1
+ CC321 CC2O1 NC2D1 CC3162 9 180.000000 10.460000 2
+ HCA2 CC321 CT1 CC 9 0.000000 0.836800 3
+ HCA2 CC321 CT1 C 9 0.000000 0.836800 3
+ HCA2 CC321 CC2O1 OC2D1 9 180.000000 0.000000 3
+ HCA2 CC321 CC2O1 NC2D1 9 0.000000 0.000000 3
+ CC2O1 CC321 CT1 CC 9 0.000000 0.836800 3
+ CC2O1 CC321 CT1 C 9 0.000000 0.836800 3
+ CC321 CT1 C O 9 0.000000 5.857600 1
+ H NH1 CT1 CC321 9 0.000000 0.000000 1
+ C NH1 CT1 CC321 9 0.000000 7.531200 1
+ CC321 CT1 C NH1 9 0.000000 0.000000 1
+ CC311D OC301 CT2 HA 9 0.000000 1.188256 3
+ CC311D OC301 CT2 HA2 9 0.000000 1.188256 3
+ HA CT2 OC301 CC3162 9 0.000000 1.188256 3
+ HA2 CT2 OC301 CC3162 9 0.000000 1.188256 3
+ CC311D OC301 CT1 HA 9 0.000000 1.188256 3
+ CC311D OC301 CT1 HA1 9 0.000000 1.188256 3
+ HA CT1 OC301 CC3162 9 0.000000 1.188256 3
+ HA1 CT1 OC301 CC3162 9 0.000000 1.188256 3
+ CT2 OC301 CC311D HCA1 9 0.000000 1.188256 3
+ CT2 OC301 CC3162 HCA1 9 0.000000 1.188256 3
+ CT1 OC301 CC311D HCA1 9 0.000000 1.188256 3
+ CT1 OC301 CC3162 HCA1 9 0.000000 1.188256 3
+ CC321C CC311D OC301 CT2 9 180.000000 5.773920 1
+ CC321C CC311D OC301 CT2 9 180.000000 5.146320 2
+ CC321C CC311D OC301 CT2 9 0.000000 1.046000 3
+ CC321C CC311D OC301 CT1 9 180.000000 4.811600 1
+ CC321C CC311D OC301 CT1 9 180.000000 6.443360 2
+ CC321C CC311D OC301 CT1 9 0.000000 1.631760 3
+ CT2 OC301 CC311D OC3C61 9 0.000000 1.129680 1
+ CT2 OC301 CC311D OC3C61 9 0.000000 0.920480 2
+ CT2 OC301 CC311D OC3C61 9 0.000000 0.292880 3
+ CT1 OC301 CC311D OC3C61 9 180.000000 1.799120 1
+ CT1 OC301 CC311D OC3C61 9 0.000000 0.209200 2
+ CT1 OC301 CC311D OC3C61 9 180.000000 2.343040 3
+ CC311D OC301 CT1 CT3 9 180.000000 6.359680 1
+ CC311D OC301 CT1 CT3 9 180.000000 0.167360 2
+ CC311D OC301 CT1 CT3 9 180.000000 1.882800 3
+ CC311D OC301 CT2 CT1 9 180.000000 8.451680 1
+ CC311D OC301 CT2 CT1 9 0.000000 0.167360 2
+ CC311D OC301 CT2 CT1 9 180.000000 4.058480 3
+ CC311D OC301 CT1 CT1 9 180.000000 9.246640 1
+ CC311D OC301 CT1 CT1 9 180.000000 0.041840 2
+ CC311D OC301 CT1 CT1 9 0.000000 0.125520 3
+ NH1 CT1 CT2 OC301 9 180.000000 1.757280 1
+ NH1 CT1 CT2 OC301 9 180.000000 2.845120 2
+ NH1 CT1 CT2 OC301 9 0.000000 4.435040 3
+ NH1 CT1 CT1 OC301 9 0.000000 1.966480 1
+ NH1 CT1 CT1 OC301 9 0.000000 6.694400 2
+ NH1 CT1 CT1 OC301 9 180.000000 1.631760 3
+ NH3 CT1 CT2 OC301 9 180.000000 1.757280 1
+ NH3 CT1 CT2 OC301 9 180.000000 2.845120 2
+ NH3 CT1 CT2 OC301 9 0.000000 4.435040 3
+ NH3 CT1 CT1 OC301 9 0.000000 1.966480 1
+ NH3 CT1 CT1 OC301 9 0.000000 6.694400 2
+ NH3 CT1 CT1 OC301 9 180.000000 1.631760 3
+ C CT1 CT2 OC301 9 180.000000 1.715440 1
+ C CT1 CT2 OC301 9 180.000000 1.338880 2
+ C CT1 CT2 OC301 9 180.000000 4.978960 3
+ C CT1 CT1 OC301 9 0.000000 4.309520 1
+ C CT1 CT1 OC301 9 0.000000 5.899440 2
+ C CT1 CT1 OC301 9 0.000000 2.761440 3
+ CC3161 CC3162 OC301 CT2 9 180.000000 5.773920 1
+ CC3161 CC3162 OC301 CT2 9 180.000000 5.146320 2
+ CC3161 CC3162 OC301 CT2 9 0.000000 1.046000 3
+ CC3161 CC3162 OC301 CT1 9 180.000000 4.811600 1
+ CC3161 CC3162 OC301 CT1 9 180.000000 6.443360 2
+ CC3161 CC3162 OC301 CT1 9 0.000000 1.631760 3
+ CT2 OC301 CC3162 OC3C61 9 0.000000 1.129680 1
+ CT2 OC301 CC3162 OC3C61 9 0.000000 0.920480 2
+ CT2 OC301 CC3162 OC3C61 9 0.000000 0.292880 3
+ CT1 OC301 CC3162 OC3C61 9 180.000000 1.799120 1
+ CT1 OC301 CC3162 OC3C61 9 0.000000 0.209200 2
+ CT1 OC301 CC3162 OC3C61 9 180.000000 2.343040 3
+ CC3162 OC301 CT1 CT3 9 180.000000 6.359680 1
+ CC3162 OC301 CT1 CT3 9 180.000000 0.167360 2
+ CC3162 OC301 CT1 CT3 9 180.000000 1.882800 3
+ CC3162 OC301 CT2 CT1 9 180.000000 8.451680 1
+ CC3162 OC301 CT2 CT1 9 0.000000 0.167360 2
+ CC3162 OC301 CT2 CT1 9 180.000000 4.058480 3
+ CC3162 OC301 CT1 CT1 9 180.000000 9.246640 1
+ CC3162 OC301 CT1 CT1 9 180.000000 0.041840 2
+ CC3162 OC301 CT1 CT1 9 0.000000 0.125520 3
+ CC3161 CC3161 OC30P PL 9 180.000000 0.083680 3
+ CC3161 OC30P PL OC2DP 9 0.000000 1.380720 3
+ HCA1 CC3161 OC30P PL 9 0.000000 1.188256 3
+ CC3161 OC30P PL OSLP 9 0.000000 6.066800 2
+ CC3161 OC30P PL O2L 9 0.000000 1.380720 3
+ CTL2 CTL2 CTL2 OC301 9 0.000000 0.794960 3
+ CC3162 OC301 CTL2 CTL2 9 0.000000 1.673600 1
+ CC3162 OC301 CTL2 CTL2 9 0.000000 2.050160 3
+ CC3161 CC3162 OC301 CTL2 9 0.000000 0.920480 1
+ CC3161 CC3162 OC301 CTL2 9 180.000000 1.171520 2
+ CC3161 CC3162 OC301 CTL2 9 0.000000 3.723760 3
+ HAL2 CTL2 CTL2 OC301 9 0.000000 0.794960 3
+ CC3162 OC301 CTL2 HAL2 9 0.000000 1.188256 3
+ CTL2 OC301 CC3162 OC3C61 9 0.000000 0.585760 1
+ CTL2 OC301 CC3162 OC3C61 9 0.000000 4.058480 2
+ CTL2 OC301 CC3162 OC3C61 9 180.000000 0.460240 3
+ CTL2 OC301 CTL1 HAL1 9 0.000000 1.188256 3
+ OC301 CTL2 CTL3 HAL3 9 0.000000 0.836800 3
+ CTL2 OC301 CC311D OC3C61 9 180.000000 1.506240 1
+ CTL2 OC301 CC311D OC3C61 9 0.000000 2.175680 2
+ CTL2 OC301 CC311D OC3C61 9 180.000000 3.472720 3
+ CTL2 OC301 CC311D CC321C 9 180.000000 2.426720 1
+ CTL2 OC301 CC311D CC321C 9 180.000000 2.886960 2
+ CTL2 OC301 CC311D CC321C 9 0.000000 4.853440 3
+ HAL2 CTL2 OC301 CC3051 9 0.000000 1.188256 3
+ HAL2 CTL2 OC301 CC3152 9 0.000000 1.188256 3
+ HAL1 CC3152 OC301 CTL2 9 0.000000 1.188256 3
+ CTL2 OC301 CC3162 HCA1 9 0.000000 1.188256 3
+ OC30P PL OSLP CTL2 9 180.000000 5.020800 1
+ OC30P PL OSLP CTL2 9 180.000000 0.418400 2
+ OC30P PL OSLP CTL2 9 180.000000 0.418400 3
+ X CS SS X 9 0.200000 0.000000 3
+ X C NC2 X 9 180.000000 9.414000 2
+ X CD OH1 X 9 180.000000 8.577200 2
+ X CD OS X 9 180.000000 8.577200 2
+ X CE1 CE1 X 9 0.000000 0.627600 1
+ X CE1 CE1 X 9 180.000000 35.564000 2
+ X CE2 CE2 X 9 180.000000 20.501600 2
+ X CP1 C X 9 180.000000 0.000000 6
+ X CP1 CC X 9 180.000000 0.000000 6
+ X CP1 CD X 9 180.000000 0.000000 6
+ X CP1 CP2 X 9 0.000000 0.585760 3
+ X CP2 CP2 X 9 0.000000 0.669440 3
+ X CP3 CP2 X 9 0.000000 0.585760 3
+ X CT1 CC X 9 180.000000 0.209200 6
+ X CT1 CD X 9 180.000000 0.000000 6
+ X CT1 CT1 X 9 0.000000 0.836800 3
+ X CT1 CT2 X 9 0.000000 0.836800 3
+ X CT1 CT3 X 9 0.000000 0.836800 3
+ X CT1 NH3 X 9 0.000000 0.418400 3
+ X CT1 OH1 X 9 0.000000 0.585760 3
+ X CT1 OS X 9 0.000000 -0.418400 3
+ X CT2 CA X 9 0.000000 0.000000 6
+ X CT2 CC X 9 180.000000 0.209200 6
+ X CT2 CD X 9 180.000000 0.000000 6
+ X CT2 CT2 X 9 0.000000 0.794960 3
+ X CT2 CT3 X 9 0.000000 0.669440 3
+ X CT2 NC2 X 9 180.000000 0.000000 6
+ X CT2 NH3 X 9 0.000000 0.418400 3
+ X CT2 OH1 X 9 0.000000 0.585760 3
+ X CT2 OS X 9 0.000000 -0.418400 3
+ X CT3 CA X 9 0.000000 0.000000 6
+ X CT3 CC X 9 180.000000 0.209200 6
+ X CT3 CD X 9 180.000000 0.000000 6
+ X CT3 CT3 X 9 0.000000 0.638060 3
+ X CT3 NC2 X 9 180.000000 0.000000 6
+ X CT3 NH2 X 9 0.000000 0.460240 3
+ X CT3 NH3 X 9 0.000000 0.376560 3
+ X CT3 OH1 X 9 0.000000 0.585760 3
+ X CT3 OS X 9 0.000000 -0.418400 3
+ X CT2A CC X 9 180.000000 0.209200 6
+ X CN8 ON2 X 9 0.000000 -0.418400 3
+ X CN7 CN8 X 9 0.000000 0.836800 3
+ X CN8 NN6 X 9 0.000000 0.418400 3
+ X ON4 P X 9 0.000000 1.255200 3
+ X ON4 P2 X 9 0.000000 1.255200 3
+ X CN2 NN3 X 9 180.000000 8.368000 2
+ X CN1 NN3 X 9 180.000000 4.184000 2
+ X CN1 NN2 X 9 180.000000 3.765600 2
+ X CN1T NN2B X 9 180.000000 3.765600 2
+ X CN1 NN2G X 9 180.000000 3.765600 2
+ X CN1 NN2U X 9 180.000000 3.765600 2
+ X CN1T NN2U X 9 180.000000 3.765600 2
+ X CN3 NN2 X 9 180.000000 4.184000 2
+ X CN3 NN2B X 9 180.000000 4.184000 2
+ X CN3 CN3 X 9 180.000000 4.184000 2
+ X CN3 CN3T X 9 180.000000 4.184000 2
+ X CN1 CN3 X 9 180.000000 4.184000 2
+ X CN1 CN3T X 9 180.000000 4.184000 2
+ X CN2 CN3 X 9 180.000000 3.347200 2
+ X CN1 CN5G X 9 180.000000 4.184000 2
+ X CN2 NN2G X 9 180.000000 4.184000 2
+ X CN2 CN5 X 9 180.000000 4.184000 2
+ X CN4 NN2 X 9 180.000000 6.276000 2
+ X CN4 NN2B X 9 180.000000 6.276000 2
+ X CN4 NN3A X 9 180.000000 14.644000 2
+ X CN4 NN4 X 9 180.000000 8.368000 2
+ X CN5 CN5 X 9 180.000000 0.000000 2
+ X CN5G CN5 X 9 180.000000 0.000000 2
+ X CN5 NN2 X 9 180.000000 6.276000 2
+ X CN5 NN2B X 9 180.000000 6.276000 2
+ X CN5 NN3A X 9 180.000000 4.184000 2
+ X CN5 NN3G X 9 180.000000 4.184000 2
+ X CN5 NN4 X 9 180.000000 4.184000 2
+ X CN5G NN4 X 9 180.000000 4.184000 2
+ X CN2 NN3A X 9 180.000000 4.184000 2
+ X CN2 NN3G X 9 180.000000 4.184000 2
+ X CN8 CN8 X 9 0.000000 0.627600 3
+ X CN8 CN9 X 9 0.000000 0.627600 3
+ X CTL1 OHL X 9 0.000000 0.585760 3
+ X CTL2 OHL X 9 0.000000 0.585760 3
+ X CTL3 OHL X 9 0.000000 0.585760 3
+ X CL OSL X 9 180.000000 8.577200 2
+ X CTL2 CL X 9 180.000000 0.209200 6
+ X CTL3 CL X 9 180.000000 0.209200 6
+ X CL OHL X 9 180.000000 8.577200 2
+ X CTL1 CCL X 9 180.000000 0.209200 6
+ X OHL PL X 9 0.000000 1.255200 3
+ X CTL1 OSL X 9 0.000000 0.000000 3
+ X CTL2 OSL X 9 0.000000 0.000000 3
+ X CTL3 OSL X 9 0.000000 0.000000 3
+ X CTL1 OSLP X 9 0.000000 0.000000 3
+ X CTL2 OSLP X 9 0.000000 0.000000 3
+ X CTL3 OSLP X 9 0.000000 0.000000 3
+ X CTL2 NTL X 9 0.000000 1.087840 3
+ X CTL5 NTL X 9 0.000000 0.962320 3
+ X CTL1 NH3L X 9 0.000000 0.418400 3
+ X CTL2 NH3L X 9 0.000000 0.418400 3
+ X CTL1 CTL1 X 9 0.000000 0.836800 3
+ X CTL1 CTL2 X 9 0.000000 0.836800 3
+ X CTL1 CTL3 X 9 0.000000 0.836800 3
+ X CTL2 CTL2 X 9 0.000000 0.794960 3
+ X CTL2 CTL3 X 9 0.000000 0.669440 3
+ X CTL3 CTL3 X 9 0.000000 0.638060 3
+ X CEL1 CEL1 X 9 180.000000 1.882800 1
+ X CEL1 CEL1 X 9 180.000000 35.564000 2
+ X CEL2 CEL2 X 9 180.000000 20.501600 2
+ X FE SS X 9 0.000000 0.000000 4
+ X CPA CPB X 9 0.000000 0.000000 2
+ X CPA CPM X 9 0.000000 0.000000 2
+ X CPB CE1 X 9 180.000000 12.552000 2
+ X CPB CPB X 9 0.000000 0.000000 2
+ X CPB CT2 X 9 0.000000 0.000000 6
+ X CPB CT3 X 9 0.000000 0.000000 6
+ X FE CM X 9 0.000000 0.209200 4
+ X FE NPH X 9 0.000000 0.000000 2
+ X FE NR2 X 9 0.000000 0.209200 4
+ X FE OM X 9 0.000000 0.000000 4
+ X NPH CPA X 9 0.000000 0.000000 2
+ X CRL1 OHL X 9 0.000000 0.585760 3
+ X CRL2 OHL X 9 0.000000 0.585760 3
+ X CRL1 CTL1 X 9 0.000000 0.836800 3
+ X CRL1 CRL1 X 9 0.000000 0.836800 3
+ X CRL1 CTL2 X 9 0.000000 0.836800 3
+ X CRL1 CRL2 X 9 0.000000 0.836800 3
+ X CTL1 CRL2 X 9 0.000000 0.836800 3
+ X CRL1 CTL3 X 9 0.000000 0.836800 3
+ X CTL2 CRL2 X 9 0.000000 0.794960 3
+ X CRL2 CRL2 X 9 0.000000 0.794960 3
+ X CRL2 CTL3 X 9 0.000000 0.669440 3
+ X CRL1 NH3L X 9 0.000000 0.418400 3
+ X CG3RC1 CG3RC1 X 9 180.000000 1.882800 1
+ X CG3RC1 CG3RC1 X 9 180.000000 35.564000 2
+
+
+[ dihedraltypes ]
+; 'improper' dihedrals
+; i j k l func phi0 kphi
+ HE2 HE2 CE2 CE2 2 0.000000 25.104000
+ HR1 NR1 NR2 CPH2 2 0.000000 4.184000
+ HR1 NR2 NR1 CPH2 2 0.000000 4.184000
+ HR3 CPH1 NR1 CPH1 2 0.000000 4.184000
+ HR3 CPH1 NR2 CPH1 2 0.000000 4.184000
+ HR3 CPH1 NR3 CPH1 2 0.000000 8.368000
+ HR3 NR1 CPH1 CPH1 2 0.000000 4.184000
+ HR3 NR2 CPH1 CPH1 2 0.000000 4.184000
+ N C CP1 CP3 2 0.000000 0.000000
+ C HC HC NC2 2 0.000000 0.000000
+ NR1 CPH1 CPH2 H 2 0.000000 3.765600
+ NR1 CPH2 CPH1 H 2 0.000000 3.765600
+ NR3 CPH1 CPH2 H 2 0.000000 10.041600
+ NR3 CPH2 CPH1 H 2 0.000000 10.041600
+ O CP1 NH2 CC 2 0.000000 376.560000
+ O CT1 NH2 CC 2 0.000000 376.560000
+ O CT2 NH2 CC 2 0.000000 376.560000
+ O CT3 NH2 CC 2 0.000000 376.560000
+ O HA1 NH2 CC 2 0.000000 376.560000
+ O N CT2 CC 2 0.000000 1004.160000
+ O NH2 CP1 CC 2 0.000000 376.560000
+ O NH2 CT1 CC 2 0.000000 376.560000
+ O NH2 CT2 CC 2 0.000000 376.560000
+ O NH2 CT3 CC 2 0.000000 376.560000
+ O NH2 HA1 CC 2 0.000000 376.560000
+ CG2D1 CG331 NG2D1 HGA4 2 0.000000 209.200000
+ CG2D1 CG331 NG2P1 HGR52 2 0.000000 150.624000
+ CG2D1O CG2D1 NG301 HGA4 2 0.000000 443.504000
+ CG2D1O CG2D1 NG311 HGA4 2 0.000000 443.504000
+ CG2D1O CG2D2 NG321 HGA4 2 0.000000 443.504000
+ CG2D1O CG2D2 OG301 HGA4 2 0.000000 192.464000
+ CG2D1O CG2DC1 NG301 HGA4 2 0.000000 443.504000
+ CG2D1O CG2DC1 NG311 HGA4 2 0.000000 443.504000
+ CG2D1O CG2DC1 OG301 HGA4 2 0.000000 83.680000
+ CG2D2O CG2D1 NG301 HGA4 2 0.000000 443.504000
+ CG2D2O CG2D1 NG311 HGA4 2 0.000000 443.504000
+ CG2D2O CG2D2 NG321 HGA4 2 0.000000 443.504000
+ CG2D2O CG2D2 OG301 HGA4 2 0.000000 192.464000
+ CG2D2O CG2DC2 NG301 HGA4 2 0.000000 443.504000
+ CG2D2O CG2DC2 NG311 HGA4 2 0.000000 443.504000
+ CG2D2O CG2DC2 OG301 HGA4 2 0.000000 83.680000
+ CG2DC1 CG2R61 NG2D1 HGA4 2 0.000000 251.040000
+ CG2DC1 CG2DC2 NG2P1 HGR52 2 0.000000 108.784000
+ CG2DC2 CG2R61 NG2D1 HGA4 2 0.000000 251.040000
+ CG2DC2 CG2DC1 NG2P1 HGR52 2 0.000000 108.784000
+ CG2N1 NG321 NG321 NG2D1 2 0.000000 711.280000
+ CG2N1 NG2P1 NG2P1 NG2P1 2 0.000000 334.720000
+ CG2N1 NG2D1 NG311 NG321 2 0.000000 711.280000
+ CG2N2 NG2P1 NG2P1 CG2R61 2 0.000000 251.040000
+ CG2N2 NG2P1 NG2P1 CG331 2 0.000000 251.040000
+ CG2O1 CG2DC1 NG2S1 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG2DC1 NG2S2 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG2DC2 NG2S1 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG2DC2 NG2S2 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG2R61 NG2S1 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG2R61 NG2S2 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG2R62 NG2S2 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG311 NG2S0 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG311 NG2S1 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG311 NG2S2 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG311 NG311 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG321 NG2S0 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG321 NG2S1 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG321 NG2S2 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG331 NG2S0 OG2D1 2 0.000000 594.128000
+ CG2O1 CG331 NG2S1 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG331 NG2S2 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG3C51 NG2S0 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG3C51 NG2S1 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG3C51 NG2S2 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG3C53 NG2S0 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG3C53 NG2S1 OG2D1 2 0.000000 1004.160000
+ CG2O1 CG3C53 NG2S2 OG2D1 2 0.000000 1004.160000
+ CG2O1 NG2S0 OG2D1 HGR52 2 0.000000 418.400000
+ CG2O1 NG2S2 OG2D1 HGR52 2 0.000000 552.288000
+ CG2O2 CG2R61 OG2D1 OG302 2 0.000000 602.496000
+ CG2O2 CG311 OG2D1 OG302 2 0.000000 518.816000
+ CG2O2 CG321 OG2D1 OG302 2 0.000000 518.816000
+ CG2O2 CG331 OG2D1 OG302 2 0.000000 518.816000
+ CG2O2 CG2R61 OG2D1 OG311 2 0.000000 443.504000
+ CG2O2 CG311 OG2D1 OG311 2 0.000000 543.920000
+ CG2O2 CG321 OG2D1 OG311 2 0.000000 543.920000
+ CG2O2 CG331 OG2D1 OG311 2 0.000000 543.920000
+ CG2O2 OG2D1 OG311 HGR52 2 0.000000 627.600000
+ CG2O3 OG2D2 OG2D2 CG2DC1 2 0.000000 803.328000
+ CG2O3 OG2D2 OG2D2 CG2DC2 2 0.000000 803.328000
+ CG2O3 OG2D2 OG2D2 CG2O5 2 0.000000 803.328000
+ CG2O3 OG2D2 OG2D2 CG2R61 2 0.000000 803.328000
+ CG2O3 OG2D2 OG2D2 CG301 2 0.000000 803.328000
+ CG2O3 OG2D2 OG2D2 CG311 2 0.000000 803.328000
+ CG2O3 OG2D2 OG2D2 CG314 2 0.000000 803.328000
+ CG2O3 OG2D2 OG2D2 CG321 2 0.000000 803.328000
+ CG2O3 OG2D2 OG2D2 CG331 2 0.000000 803.328000
+ CG2O3 OG2D2 OG2D2 HGR52 2 0.000000 560.656000
+ CG2O4 CG2DC1 OG2D1 HGR52 2 0.000000 117.152000
+ CG2O4 CG2DC2 OG2D1 HGR52 2 0.000000 117.152000
+ CG2O4 CG2R61 OG2D1 HGR52 2 0.000000 443.504000
+ CG2O4 CG321 OG2D1 HGR52 2 0.000000 418.400000
+ CG2O4 CG331 OG2D1 HGR52 2 0.000000 418.400000
+ CG2O5 CG2DC1 CG331 OG2D3 2 0.000000 736.384000
+ CG2O5 CG2DC2 CG331 OG2D3 2 0.000000 736.384000
+ CG2O5 CG2O3 CG2R61 OG2D3 2 0.000000 602.496000
+ CG2O5 CG2R61 CG311 OG2D3 2 0.000000 602.496000
+ CG2O5 CG2R61 CG321 OG2D3 2 0.000000 602.496000
+ CG2O5 CG2R61 CG331 OG2D3 2 0.000000 502.080000
+ CG2O5 CG321 CG321 OG2D3 2 0.000000 585.760000
+ CG2O5 CG321 CG331 OG2D3 2 0.000000 585.760000
+ CG2O5 CG331 CG331 OG2D3 2 0.000000 585.760000
+ CG2O6 NG2S2 NG2S2 OG2D1 2 0.000000 669.440000
+ CG2O6 OG302 OG302 OG2D1 2 0.000000 1213.360000
+ CG2O6 OG2D2 OG2D2 OG2D2 2 0.000000 895.376000
+ CG2O6 NG2S1 OG2D1 OG302 2 0.000000 518.816000
+ CG2O6 OG2D2 OG2D2 OG311 2 0.000000 711.280000
+ CG2O6 SG311 SG311 SG2D1 2 0.000000 669.440000
+ CG2R53 CG251O NG2R53 OG2D1 2 0.000000 753.120000
+ CG2R53 CG252O NG2R53 OG2D1 2 0.000000 753.120000
+ CG2R53 CG25C1 NG2R51 OG2D1 2 0.000000 753.120000
+ CG2R53 CG25C2 NG2R51 OG2D1 2 0.000000 753.120000
+ CG2R53 CG3C41 NG2R43 OG2D1 2 0.000000 1004.160000
+ CG2R53 CG3C52 NG2R53 OG2D1 2 0.000000 753.120000
+ CG2R53 NG2R53 NG2R53 OG2D1 2 0.000000 753.120000
+ CG2R53 CG2R51 OG2D1 OG3C51 2 0.000000 239.324800
+ CG2R53 CG3C52 OG2D1 OG3C51 2 0.000000 376.560000
+ CG2R53 NG2R53 OG2D1 SG311 2 0.000000 359.824000
+ CG2R53 NG2R53 SG2D1 SG311 2 0.000000 359.824000
+ CG2R63 CG2R62 CG2R62 OG2D4 2 0.000000 125.520000
+ CG2R63 CG2R62 NG2R61 OG2D4 2 0.000000 753.120000
+ CG2R63 CG2R62 NG2R67 OG2D4 2 0.000000 753.120000
+ CG2R63 CG2RC0 NG2R61 OG2D4 2 0.000000 753.120000
+ CG2R63 NG2R61 NG2R61 OG2D4 2 0.000000 753.120000
+ CG2R63 NG2R61 NG2R62 OG2D4 2 0.000000 753.120000
+ CG2R63 NG2R61 NG2R67 OG2D4 2 0.000000 753.120000
+ CG2R63 CG2R62 OG2D4 OG3R60 2 0.000000 426.768000
+ CG2R63 CG2R61 NG2R61 SG2D1 2 0.000000 259.408000
+ CG2R63 CG2R61 NG2R67 SG2D1 2 0.000000 326.352000
+ CG2R63 CG2R62 NG2R61 SG2D1 2 0.000000 326.352000
+ CG2R63 CG2R62 NG2R67 SG2D1 2 0.000000 326.352000
+ CG2R63 NG2R61 NG2R61 SG2D1 2 0.000000 702.912000
+ CG2R63 NG2R61 NG2R67 SG2D1 2 0.000000 702.912000
+ CG2R64 CG2R61 NG2R60 NG2S1 2 0.000000 158.992000
+ CG2R64 CG2R62 NG2R62 NG2S3 2 0.000000 502.080000
+ CG2R64 CG2RC0 NG2R62 NG2S3 2 0.000000 334.720000
+ CG2R64 NG2R61 NG2R62 NG2S3 2 0.000000 334.720000
+ NG2O1 OG2N1 OG2N1 CG324 2 0.000000 448.524800
+ NG2O1 OG2N1 OG2N1 CG334 2 0.000000 425.094400
+ NG2S3 HGP4 HGP4 CG2R61 2 0.000000 -20.920000
+ NG2S3 HGP4 HGP4 CG2R64 2 0.000000 75.312000
+ CC2O1 CC331 NC2D1 OC2D1 2 0.000000 1004.160000
+ NC2D1 CC2O1 CC3161 HCP1 2 0.000000 167.360000
+ NC2D1 CC2O1 CC3062 HCP1 2 0.000000 167.360000
+ CC2O2 CC311 OC2D2 OC2D2 2 0.000000 803.328000
+ CC2O2 CC301 OC2D2 OC2D2 2 0.000000 803.328000
+ CC2O2 CC3163 OC2D2 OC2D2 2 0.000000 803.328000
+ NC2D1 CC2O1 CC331 HCP1 2 0.000000 167.360000
+ NC2D1 CC2O1 CC311 HCP1 2 0.000000 167.360000
+ CC2O2 CC321 OC2D2 OC2D2 2 0.000000 803.328000
+ CC2O4 CC331 OC2D4 HCR1 2 0.000000 418.400000
+ CC2O4 CC312 OC2D4 HCR1 2 0.000000 418.400000
+ OC2D3 CC331 CC331 CC2O3 2 0.000000 585.760000
+ OC2D3 CC312 CC322 CC2O3 2 0.000000 585.760000
+ NN2B CN4 CN5 HN2 2 0.000000 58.576000
+ NN1 CN2 HN1 HN1 2 0.000000 50.208000
+ CN1 NN2G CN5G ON1 2 0.000000 753.120000
+ CN1T NN2B NN2U ON1 2 0.000000 920.480000
+ CN1 NN2U CN3T ON1 2 0.000000 753.120000
+ CN2 NN3G NN2G NN1 2 0.000000 334.720000
+ CN2 NN3A CN5 NN1 2 0.000000 334.720000
+ CN2 NN3 CN3 NN1 2 0.000000 502.080000
+ HEL2 HEL2 CEL2 CEL2 2 0.000000 25.104000
+ CPB CPA NPH CPA 2 0.000000 174.054400
+ HA CPA CPA CPM 2 0.000000 246.019200
+ NPH CPA CPA FE 2 0.000000 1149.763200
+ NPH CPA CPB CPB 2 0.000000 339.740800
+ NPH CPA CPM CPA 2 0.000000 153.134400
+ NPH CPM CPB CPA 2 0.000000 273.633600
+ NR1 CPH1 CPH2 CN7B 2 0.000000 5.020800
+ NR1 CPH2 CPH1 CN7B 2 0.000000 5.020800
+ NC2D1 CC2O1 CC311D HCP1 2 0.000000 167.360000
+ NC2D1 CC2O1 CC3162 HCP1 2 0.000000 167.360000
+ CC2O1 NC2D1 CC321 OC2D1 2 0.000000 376.560000
+ CC2O1 CC321 NC2D1 OC2D1 2 0.000000 376.560000
+ NC2 X X C 2 0.000000 376.560000
+ NC2 X X HC 2 0.000000 -16.736000
+ NH1 X X H 2 0.000000 167.360000
+ NH2 X X H 2 0.000000 33.472000
+ O X X C 2 0.000000 1004.160000
+ OB X X CD 2 0.000000 836.800000
+ OC X X CC 2 0.000000 803.328000
+ CC X X CT1 2 0.000000 803.328000
+ CC X X CT2 2 0.000000 803.328000
+ CC X X CT3 2 0.000000 803.328000
+ HN2 X X NN2 2 0.000000 8.368000
+ HN1 X X NN1 2 0.000000 33.472000
+ CN1 X X ON1 2 0.000000 753.120000
+ CN1T X X ON1 2 0.000000 753.120000
+ CN1 X X ON1C 2 0.000000 669.440000
+ CN2 X X NN1 2 0.000000 753.120000
+ CN9 X X CN3T 2 0.000000 117.152000
+ OBL X X CL 2 0.000000 836.800000
+ OCL X X CL 2 0.000000 803.328000
+ OCL X X CCL 2 0.000000 803.328000
+ CPB X X CE1 2 0.000000 753.120000
+ CT2 X X CPB 2 0.000000 753.120000
+ CT3 X X CPB 2 0.000000 753.120000
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/ffnonbonded.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/ffnonbonded.itp
new file mode 100644
index 0000000000000000000000000000000000000000..172891aa660ae4702c56c2996dcd57c9cd7b0040
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/ffnonbonded.itp
@@ -0,0 +1,29889 @@
+; This force field generated by charmm2gmx.py from
+; multiple charmm parameter files
+; and multiple charmm topology files
+
+[ atomtypes ]
+;type atnum mass charge ptype sigma epsilon
+ ALG1 13 26.981540 0.000 A 0.356359487256 2.71960
+ BAR 56 137.327000 0.000 A 0.336759715457 0.62760
+BRGA1 35 79.904000 0.000 A 0.351014094947 2.00832
+BRGA2 35 79.904000 0.000 A 0.365268474438 2.21752
+BRGA3 35 79.904000 0.000 A 0.356359487256 2.25936
+BRGR1 35 79.904000 0.000 A 0.368832069310 1.75728
+ C 6 12.011000 0.000 A 0.356359487256 0.46024
+ CA 6 12.011000 0.000 A 0.355005321205 0.29288
+ CAD 48 112.411000 0.000 A 0.241789912103 0.50208
+ CAI 6 12.011000 0.000 A 0.354577689820 0.30543
+ CAL 20 40.080000 0.000 A 0.243571709540 0.50208
+ CC 6 12.011000 0.000 A 0.356359487256 0.29288
+CC2O1 6 12.011000 0.000 A 0.356359487256 0.46024
+CC2O2 6 12.011000 0.000 A 0.356359487256 0.29288
+CC2O3 6 12.011000 0.000 A 0.356359487256 0.37656
+CC2O4 6 12.011000 0.000 A 0.320723538531 0.25104
+CC301 6 12.011000 0.000 A 0.356359487256 0.13389
+CC3051 6 12.011000 0.000 A 0.356359487256 0.13389
+CC3062 6 12.011000 0.000 A 0.356359487256 0.13389
+CC30A 6 12.011000 0.000 A 0.356359487256 0.13389
+CC311 6 12.011000 0.000 A 0.356359487256 0.13389
+CC311C 6 12.011000 0.000 A 0.356359487256 0.13389
+CC311D 6 12.011000 0.000 A 0.356359487256 0.13389
+CC312 6 12.011000 0.000 A 0.356359487256 0.13389
+CC312C 6 12.011000 0.000 A 0.356359487256 0.13389
+CC312D 6 12.011000 0.000 A 0.356359487256 0.13389
+CC3151 6 12.011000 0.000 A 0.356359487256 0.13389
+CC3152 6 12.011000 0.000 A 0.356359487256 0.13389
+CC3153 6 12.011000 0.000 A 0.356359487256 0.13389
+CC3161 6 12.011000 0.000 A 0.356359487256 0.13389
+CC3162 6 12.011000 0.000 A 0.356359487256 0.13389
+CC3163 6 12.011000 0.000 A 0.356359487256 0.13389
+CC31A 6 12.011000 0.000 A 0.356359487256 0.13389
+CC321 6 12.011000 0.000 A 0.358141284692 0.23430
+CC321C 6 12.011000 0.000 A 0.358141284692 0.23430
+CC321D 6 12.011000 0.000 A 0.358141284692 0.23430
+CC322 6 12.011000 0.000 A 0.358141284692 0.23430
+CC322C 6 12.011000 0.000 A 0.359923082129 0.25104
+CC3251 6 12.011000 0.000 A 0.359923082129 0.25104
+CC325A 6 12.011000 0.000 A 0.359923082129 0.25104
+CC325B 6 12.011000 0.000 A 0.359923082129 0.25104
+CC3261 6 12.011000 0.000 A 0.358141284692 0.23430
+CC3263 6 12.011000 0.000 A 0.358141284692 0.23430
+CC326A 6 12.011000 0.000 A 0.358141284692 0.23430
+CC32A 6 12.011000 0.000 A 0.358141284692 0.23430
+CC331 6 12.011000 0.000 A 0.363486677001 0.32635
+CC33A 6 12.011000 0.000 A 0.363486677001 0.32635
+ CCL 6 12.011000 0.000 A 0.356359487256 0.29288
+ CD 6 12.011000 0.000 A 0.356359487256 0.29288
+ CE1 6 12.011000 0.000 A 0.372395664183 0.28451
+ CE2 6 12.011000 0.000 A 0.370613866746 0.26778
+ CEL1 6 12.011000 0.000 A 0.372395664183 0.28451
+ CEL2 6 12.011000 0.000 A 0.370613866746 0.26778
+ CES 55 132.905450 0.000 A 0.374177461619 0.79496
+CG1N1 6 12.011000 0.000 A 0.333196120584 0.75312
+CG1T1 6 12.011000 0.000 A 0.327850728276 0.69873
+CG1T2 6 12.011000 0.000 A 0.355023139179 0.43179
+CG251O 6 12.011000 0.000 A 0.372395664183 0.28451
+CG252O 6 12.011000 0.000 A 0.372395664183 0.28451
+CG25C1 6 12.011000 0.000 A 0.372395664183 0.28451
+CG25C2 6 12.011000 0.000 A 0.372395664183 0.28451
+CG2D1 6 12.011000 0.000 A 0.372395664183 0.28451
+CG2D1O 6 12.011000 0.000 A 0.372395664183 0.28451
+CG2D2 6 12.011000 0.000 A 0.370613866746 0.26778
+CG2D2O 6 12.011000 0.000 A 0.372395664183 0.28451
+CG2DC1 6 12.011000 0.000 A 0.372395664183 0.28451
+CG2DC2 6 12.011000 0.000 A 0.372395664183 0.28451
+CG2DC3 6 12.011000 0.000 A 0.370613866746 0.26778
+CG2N1 6 12.011000 0.000 A 0.356359487256 0.46024
+CG2N2 6 12.011000 0.000 A 0.356359487256 0.46024
+CG2O1 6 12.011000 0.000 A 0.356359487256 0.46024
+CG2O2 6 12.011000 0.000 A 0.302905564168 0.41003
+CG2O3 6 12.011000 0.000 A 0.356359487256 0.29288
+CG2O4 6 12.011000 0.000 A 0.320723538531 0.25104
+CG2O5 6 12.011000 0.000 A 0.356359487256 0.37656
+CG2O6 6 12.011000 0.000 A 0.356359487256 0.29288
+CG2O7 6 12.011000 0.000 A 0.278494939291 0.24267
+CG2R51 6 12.011000 0.000 A 0.374177461619 0.20920
+CG2R52 6 12.011000 0.000 A 0.391995435982 0.08368
+CG2R53 6 12.011000 0.000 A 0.391995435982 0.08368
+CG2R57 6 12.011000 0.000 A 0.374177461619 0.20920
+CG2R61 6 12.011000 0.000 A 0.355005321205 0.29288
+CG2R62 6 12.011000 0.000 A 0.338541512893 0.37656
+CG2R63 6 12.011000 0.000 A 0.338541512893 0.41840
+CG2R64 6 12.011000 0.000 A 0.374177461619 0.16736
+CG2R66 6 12.011000 0.000 A 0.338541512893 0.29288
+CG2R67 6 12.011000 0.000 A 0.355005321205 0.29288
+CG2R71 6 12.011000 0.000 A 0.355432952589 0.28033
+CG2RC0 6 12.011000 0.000 A 0.331414323148 0.41422
+CG2RC7 6 12.011000 0.000 A 0.331414323148 0.41422
+CG301 6 12.011000 0.000 A 0.356359487256 0.13389
+CG302 6 12.011000 0.000 A 0.409813410345 0.08368
+CG311 6 12.011000 0.000 A 0.356359487256 0.13389
+CG312 6 12.011000 0.000 A 0.365268474438 0.17573
+CG314 6 12.011000 0.000 A 0.385759144955 0.12970
+CG321 6 12.011000 0.000 A 0.358141284692 0.23430
+CG322 6 12.011000 0.000 A 0.338541512893 0.25104
+CG323 6 12.011000 0.000 A 0.391995435982 0.46024
+CG324 6 12.011000 0.000 A 0.387540942391 0.23012
+CG331 6 12.011000 0.000 A 0.365268474438 0.32635
+CG334 6 12.011000 0.000 A 0.394668132136 0.32217
+CG3AM0 6 12.011000 0.000 A 0.351014094947 0.29288
+CG3AM1 6 12.011000 0.000 A 0.352795892384 0.32635
+CG3AM2 6 12.011000 0.000 A 0.354577689820 0.33472
+CG3C31 6 12.011000 0.000 A 0.358141284692 0.23430
+CG3C41 6 12.011000 0.000 A 0.359923082129 0.27196
+CG3C50 6 12.011000 0.000 A 0.358141284692 0.15062
+CG3C51 6 12.011000 0.000 A 0.358141284692 0.15062
+CG3C52 6 12.011000 0.000 A 0.359923082129 0.25104
+CG3C53 6 12.011000 0.000 A 0.387540942391 0.14644
+CG3C54 6 12.011000 0.000 A 0.389322739827 0.24686
+CG3RC1 6 12.011000 0.000 A 0.356359487256 0.13389
+ CL 6 12.011000 0.000 A 0.356359487256 0.29288
+ CLA 17 35.450000 0.000 A 0.404468018036 0.62760
+CLGA1 17 35.453000 0.000 A 0.340323310330 1.43511
+CLGA3 17 35.453000 0.000 A 0.340323310330 1.29704
+CLGR1 17 35.453000 0.000 A 0.343886905202 1.33888
+ CM 6 12.011000 0.000 A 0.374177461619 0.46024
+ CN1 6 12.011000 0.000 A 0.338541512893 0.41840
+ CN1T 6 12.011000 0.000 A 0.338541512893 0.41840
+ CN2 6 12.011000 0.000 A 0.338541512893 0.41840
+ CN3 6 12.011000 0.000 A 0.338541512893 0.37656
+ CN3T 6 12.011000 0.000 A 0.338541512893 0.37656
+ CN4 6 12.011000 0.000 A 0.338541512893 0.31380
+ CN5 6 12.011000 0.000 A 0.338541512893 0.31380
+ CN5G 6 12.011000 0.000 A 0.338541512893 0.31380
+ CN7 6 12.011000 0.000 A 0.405358916754 0.08368
+ CN7B 6 12.011000 0.000 A 0.405358916754 0.08368
+ CN8 6 12.011000 0.000 A 0.358141284692 0.23430
+ CN8B 6 12.011000 0.000 A 0.358141284692 0.23430
+ CN9 6 12.011000 0.000 A 0.363486677001 0.32635
+ CP1 6 12.011000 0.000 A 0.405358916754 0.08368
+ CP2 6 12.011000 0.000 A 0.387540942391 0.23012
+ CP3 6 12.011000 0.000 A 0.387540942391 0.23012
+ CPA 6 12.011000 0.000 A 0.320723538531 0.37656
+ CPB 6 12.011000 0.000 A 0.320723538531 0.37656
+ CPH1 6 12.011000 0.000 A 0.320723538531 0.20920
+ CPH2 6 12.011000 0.000 A 0.320723538531 0.20920
+ CPM 6 12.011000 0.000 A 0.320723538531 0.37656
+ CPT 6 12.011000 0.000 A 0.331414323148 0.41422
+ CRL1 6 12.011000 0.000 A 0.358141284692 0.15062
+ CRL2 6 12.011000 0.000 A 0.359923082129 0.25104
+ CS 6 12.011000 0.000 A 0.391995435982 0.46024
+ CST 6 12.011000 0.000 A 0.278494939291 0.24267
+ CT 6 12.011000 0.000 A 0.405358916754 0.08368
+ CT1 6 12.011000 0.000 A 0.356359487256 0.13389
+ CT2 6 12.011000 0.000 A 0.358141284692 0.23430
+ CT2A 6 12.011000 0.000 A 0.358141284692 0.23430
+ CT3 6 12.011000 0.000 A 0.363486677001 0.32635
+ CTL1 6 12.011000 0.000 A 0.405358916754 0.08368
+ CTL2 6 12.011000 0.000 A 0.358141284692 0.23430
+ CTL3 6 12.011000 0.000 A 0.363486677001 0.32635
+ CTL5 6 12.011000 0.000 A 0.367050271874 0.33472
+ CY 6 12.011000 0.000 A 0.354577689820 0.30543
+ FE 26 55.847000 0.000 A 0.115816833358 -0.00000
+ FGA1 9 18.998000 0.000 A 0.290432982114 0.56484
+ FGA2 9 18.998000 0.000 A 0.290432982114 0.43932
+ FGA3 9 18.998000 0.000 A 0.285087589805 0.40585
+ FGP1 9 18.998000 0.000 A 0.285087589805 0.40585
+ FGR1 9 18.998000 0.000 A 0.302905564168 0.50208
+ H 1 1.008000 0.000 A 0.040001352445 0.19246
+ HA 1 1.008000 0.000 A 0.235197261589 0.09205
+ HA1 1 1.008000 0.000 A 0.238760856462 0.18828
+ HA2 1 1.008000 0.000 A 0.238760856462 0.14226
+ HA3 1 1.008000 0.000 A 0.238760856462 0.10042
+ HAL1 1 1.008000 0.000 A 0.235197261589 0.09205
+ HAL2 1 1.008000 0.000 A 0.238760856462 0.11715
+ HAL3 1 1.008000 0.000 A 0.238760856462 0.10042
+ HB1 1 1.008000 0.000 A 0.235197261589 0.09205
+ HB2 1 1.008000 0.000 A 0.238760856462 0.11715
+ HBL 1 1.008000 0.000 A 0.235197261589 0.09205
+ HC 1 1.008000 0.000 A 0.040001352445 0.19246
+ HCA1 1 1.008000 0.000 A 0.238760856462 0.18828
+HCA1A 1 1.008000 0.000 A 0.238760856462 0.18828
+HCA1C2 1 1.008000 0.000 A 0.238760856462 0.18828
+ HCA2 1 1.008000 0.000 A 0.238760856462 0.14644
+HCA25A 1 1.008000 0.000 A 0.231633666716 0.14644
+HCA2A 1 1.008000 0.000 A 0.238760856462 0.14644
+HCA2C2 1 1.008000 0.000 A 0.231633666716 0.14644
+ HCA3 1 1.008000 0.000 A 0.238760856462 0.10042
+HCA3A 1 1.008000 0.000 A 0.238760856462 0.10042
+HCA3M 1 1.008000 0.000 A 0.238760856462 0.10042
+ HCL 1 1.008000 0.000 A 0.040001352445 0.19246
+ HCP1 1 1.008000 0.000 A 0.040001352445 0.19246
+HCP1M 1 1.008000 0.000 A 0.040001352445 0.19246
+ HCR1 1 1.008000 0.000 A 0.142543794902 0.19246
+ HE1 1 1.008000 0.000 A 0.222724679535 0.12970
+ HE2 1 1.008000 0.000 A 0.224506476971 0.10878
+ HEL1 1 1.008000 0.000 A 0.222724679535 0.12970
+ HEL2 1 1.008000 0.000 A 0.224506476971 0.10878
+ HGA1 1 1.008000 0.000 A 0.238760856462 0.18828
+ HGA2 1 1.008000 0.000 A 0.238760856462 0.14644
+ HGA3 1 1.008000 0.000 A 0.238760856462 0.10042
+ HGA4 1 1.008000 0.000 A 0.222724679535 0.12970
+ HGA5 1 1.008000 0.000 A 0.224506476971 0.10878
+ HGA6 1 1.008000 0.000 A 0.235197261589 0.11715
+ HGA7 1 1.008000 0.000 A 0.231633666716 0.12552
+HGAAM0 1 1.008000 0.000 A 0.228070071844 0.11715
+HGAAM1 1 1.008000 0.000 A 0.228070071844 0.11715
+HGAAM2 1 1.008000 0.000 A 0.224506476971 0.16736
+ HGP1 1 1.008000 0.000 A 0.040001352445 0.19246
+ HGP2 1 1.008000 0.000 A 0.040001352445 0.19246
+ HGP3 1 1.008000 0.000 A 0.080180884633 0.41840
+ HGP4 1 1.008000 0.000 A 0.040001352445 0.19246
+ HGP5 1 1.008000 0.000 A 0.124725820540 0.19246
+HGPAM1 1 1.008000 0.000 A 0.155907275675 0.03766
+HGPAM2 1 1.008000 0.000 A 0.155907275675 0.04184
+HGPAM3 1 1.008000 0.000 A 0.155016376956 0.05021
+HGR51 1 1.008000 0.000 A 0.242003727796 0.12552
+HGR52 1 1.008000 0.000 A 0.160361769265 0.19246
+HGR53 1 1.008000 0.000 A 0.124725820540 0.19246
+HGR61 1 1.008000 0.000 A 0.242003727796 0.12552
+HGR62 1 1.008000 0.000 A 0.195997717991 0.19246
+HGR63 1 1.008000 0.000 A 0.160361769265 0.19246
+HGR71 1 1.008000 0.000 A 0.242003727796 0.12552
+ HL 1 1.008000 0.000 A 0.124725820540 0.19246
+ HN1 1 1.008000 0.000 A 0.040001352445 0.19246
+ HN2 1 1.008000 0.000 A 0.040001352445 0.19246
+ HN3 1 1.008000 0.000 A 0.195997717991 0.19246
+ HN4 1 1.008000 0.000 A 0.040001352445 0.19246
+ HN5 1 1.008000 0.000 A 0.040001352445 0.19246
+ HN6 1 1.008000 0.000 A 0.235197261589 0.09205
+ HN7 1 1.008000 0.000 A 0.235197261589 0.09205
+ HN8 1 1.008000 0.000 A 0.238760856462 0.11715
+ HN9 1 1.008000 0.000 A 0.238760856462 0.10042
+ HOL 1 1.008000 0.000 A 0.040001352445 0.19246
+ HP 1 1.008000 0.000 A 0.242003727796 0.12552
+ HR1 1 1.008000 0.000 A 0.160361769265 0.19246
+ HR2 1 1.008000 0.000 A 0.124725820540 0.19246
+ HR3 1 1.008000 0.000 A 0.261567863646 0.03264
+ HS 1 1.008000 0.000 A 0.080180884633 0.41840
+#ifdef ORIGINAL_TIP3P
+; normal TIP3p : no LJ on H
+#ifdef HEAVY_H
+HT 1 4.032 0.000 A 0.0 0.0
+#else
+; normal TIP3P, but not HEAVY_H
+HT 1 1.008000 0.000 A 0.0 0.0
+#endif
+#else
+#ifdef HEAVY_H
+HT 1 4.032 0.000 A 0.0400013524445 0.192464
+#else
+; CHARMM_TIP3P, but not HEAVY_H
+HT 1 1.008000 0.417 A 0.0400013524445 0.192464
+#endif
+#endif
+ HX 1 1.008000 0.000 A 0.040001352445 0.19246
+ IGR1 53 126.904470 0.000 A 0.390213638545 2.30120
+ LIT 3 6.941000 0.000 A 0.231188217357 0.00975
+ MG 12 24.305000 0.000 A 0.211142996199 0.06276
+ N 7 14.007000 0.000 A 0.329632525712 0.83680
+ NC2 7 14.007000 0.000 A 0.329632525712 0.83680
+NC2D1 7 14.007000 0.000 A 0.329632525712 0.83680
+NG1T1 7 14.007000 0.000 A 0.318941741094 0.75312
+NG2D1 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2O1 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2P1 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2R43 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2R50 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2R51 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2R52 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2R53 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2R57 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2R60 7 14.007000 0.000 A 0.336759715457 0.25104
+NG2R61 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2R62 7 14.007000 0.000 A 0.367050271874 0.20920
+NG2R67 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2RC0 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2S0 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2S1 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2S2 7 14.007000 0.000 A 0.329632525712 0.83680
+NG2S3 7 14.007000 0.000 A 0.329632525712 0.83680
+NG301 7 14.007000 0.000 A 0.356359487256 0.14644
+NG311 7 14.007000 0.000 A 0.356359487256 0.18828
+NG321 7 14.007000 0.000 A 0.354577689820 0.25104
+NG331 7 14.007000 0.000 A 0.352795892384 0.29288
+NG3C51 7 14.007000 0.000 A 0.329632525712 0.83680
+NG3N1 7 14.007000 0.000 A 0.365268474438 0.25104
+NG3P0 7 14.007000 0.000 A 0.329632525712 0.83680
+NG3P1 7 14.007000 0.000 A 0.329632525712 0.83680
+NG3P2 7 14.007000 0.000 A 0.329632525712 0.83680
+NG3P3 7 14.007000 0.000 A 0.329632525712 0.83680
+ NH1 7 14.007000 0.000 A 0.329632525712 0.83680
+ NH2 7 14.007000 0.000 A 0.329632525712 0.83680
+ NH3 7 14.007000 0.000 A 0.329632525712 0.83680
+ NH3L 7 14.007000 0.000 A 0.329632525712 0.83680
+ NN1 7 14.007000 0.000 A 0.329632525712 0.83680
+ NN2 7 14.007000 0.000 A 0.329632525712 0.83680
+ NN2B 7 14.007000 0.000 A 0.329632525712 0.83680
+ NN2G 7 14.007000 0.000 A 0.329632525712 0.83680
+ NN2U 7 14.007000 0.000 A 0.329632525712 0.83680
+ NN3 7 14.007000 0.000 A 0.329632525712 0.83680
+ NN3A 7 14.007000 0.000 A 0.329632525712 0.83680
+ NN3G 7 14.007000 0.000 A 0.329632525712 0.83680
+ NN4 7 14.007000 0.000 A 0.329632525712 0.83680
+ NN6 7 14.007000 0.000 A 0.329632525712 0.83680
+ NP 7 14.007000 0.000 A 0.329632525712 0.83680
+ NPH 7 14.007000 0.000 A 0.329632525712 0.83680
+ NR1 7 14.007000 0.000 A 0.329632525712 0.83680
+ NR2 7 14.007000 0.000 A 0.329632525712 0.83680
+ NR3 7 14.007000 0.000 A 0.329632525712 0.83680
+ NTL 7 14.007000 0.000 A 0.329632525712 0.83680
+ NY 7 14.007000 0.000 A 0.329632525712 0.83680
+ O 8 15.999000 0.000 A 0.302905564168 0.50208
+ O2L 8 15.999400 0.000 A 0.302905564168 0.50208
+ OB 8 15.999000 0.000 A 0.302905564168 0.50208
+ OBL 8 15.999400 0.000 A 0.302905564168 0.50208
+ OC 8 15.999000 0.000 A 0.302905564168 0.50208
+OC2D1 8 15.999400 0.000 A 0.302905564168 0.50208
+OC2D2 8 15.999400 0.000 A 0.302905564168 0.50208
+OC2D3 8 15.999400 0.000 A 0.302905564168 0.20920
+OC2D4 8 15.999400 0.000 A 0.302905564168 0.50208
+OC2DP 8 15.999400 0.000 A 0.302905564168 0.50208
+OC301 8 15.999400 0.000 A 0.293996576986 0.41840
+OC302 8 15.999400 0.000 A 0.293996576986 0.41840
+OC303 8 15.999400 0.000 A 0.293996576986 0.41840
+OC305A 8 15.999400 0.000 A 0.293996576986 0.41840
+OC30A 8 15.999400 0.000 A 0.293996576986 0.41840
+OC30P 8 15.999400 0.000 A 0.315378146222 0.63639
+OC311 8 15.999400 0.000 A 0.314487247504 0.80375
+OC311M 8 15.999400 0.000 A 0.314487247504 0.80375
+OC312 8 15.999400 0.000 A 0.315378146222 0.63639
+OC3C51 8 15.999400 0.000 A 0.293996576986 0.41840
+OC3C5M 8 15.999400 0.000 A 0.293996576986 0.41840
+OC3C61 8 15.999400 0.000 A 0.293996576986 0.41840
+ OCL 8 15.999400 0.000 A 0.302905564168 0.50208
+OG2D1 8 15.999400 0.000 A 0.302905564168 0.50208
+OG2D2 8 15.999400 0.000 A 0.302905564168 0.50208
+OG2D3 8 15.999400 0.000 A 0.302905564168 0.20920
+OG2D4 8 15.999400 0.000 A 0.302905564168 0.50208
+OG2D5 8 15.999400 0.000 A 0.301480126219 0.69036
+OG2N1 8 15.999400 0.000 A 0.302905564168 0.50208
+OG2P1 8 15.999400 0.000 A 0.302905564168 0.50208
+OG2R50 8 15.999400 0.000 A 0.302905564168 0.50208
+OG301 8 15.999400 0.000 A 0.293996576986 0.41840
+OG302 8 15.999400 0.000 A 0.293996576986 0.41840
+OG303 8 15.999400 0.000 A 0.293996576986 0.41840
+OG304 8 15.999400 0.000 A 0.293996576986 0.41840
+OG311 8 15.999400 0.000 A 0.314487247504 0.80375
+OG312 8 15.999400 0.000 A 0.311814551349 0.50208
+OG3C31 8 15.999400 0.000 A 0.293996576986 0.41840
+OG3C51 8 15.999400 0.000 A 0.293996576986 0.41840
+OG3C61 8 15.999400 0.000 A 0.293996576986 0.41840
+OG3R60 8 15.999400 0.000 A 0.293996576986 0.41840
+ OH1 8 15.999000 0.000 A 0.315378146222 0.63639
+ OHL 8 15.999400 0.000 A 0.315378146222 0.63639
+ OM 8 15.999000 0.000 A 0.302905564168 0.50208
+ ON1 8 15.999400 0.000 A 0.302905564168 0.50208
+ ON1C 8 15.999400 0.000 A 0.302905564168 0.50208
+ ON2 8 15.999400 0.000 A 0.315378146222 0.63639
+ ON3 8 15.999400 0.000 A 0.302905564168 0.50208
+ ON4 8 15.999400 0.000 A 0.315378146222 0.63639
+ ON5 8 15.999400 0.000 A 0.315378146222 0.63639
+ ON6 8 15.999400 0.000 A 0.315378146222 0.63639
+ ON6B 8 15.999400 0.000 A 0.315378146222 0.63639
+ OS 8 15.999400 0.000 A 0.315378146222 0.63639
+ OSL 8 15.999400 0.000 A 0.293996576986 0.41840
+ OSLP 8 15.999400 0.000 A 0.293996576986 0.41840
+ OST 8 15.999000 0.000 A 0.301480126219 0.69036
+ OT 8 15.999400 0.000 A 0.315057422683 0.63639
+#ifdef HEAVY_H
+OT 8 9.951400 -0.834 A 0.315057422683 0.6363864
+#endif
+ OX 8 15.999400 0.000 A 0.302905564168 0.50208
+ P 15 30.974000 0.000 A 0.383086448800 2.44764
+ P2 15 30.974000 0.000 A 0.383086448800 2.44764
+ PC 15 30.974000 0.000 A 0.383086448800 2.44764
+ PG0 15 30.973800 0.000 A 0.383086448800 2.44764
+ PG1 15 30.973800 0.000 A 0.383086448800 2.44764
+ PG2 15 30.973800 0.000 A 0.383086448800 2.44764
+ PL 15 30.974000 0.000 A 0.383086448800 2.44764
+ POT 19 39.098300 0.000 A 0.314264522824 0.36401
+ RUB 37 85.467800 0.000 A 0.338541512893 0.62760
+ S 16 32.060000 0.000 A 0.356359487256 1.88280
+ SC 16 32.060000 0.000 A 0.374177461619 1.96648
+SG2D1 16 32.060000 0.000 A 0.365268474438 2.36396
+SG2R50 16 32.060000 0.000 A 0.356359487256 1.88280
+SG301 16 32.060000 0.000 A 0.351904993665 1.58992
+SG302 16 32.060000 0.000 A 0.391995435982 1.96648
+SG311 16 32.060000 0.000 A 0.356359487256 1.88280
+SG3O1 16 32.060000 0.000 A 0.374177461619 1.96648
+SG3O2 16 32.060000 0.000 A 0.356359487256 1.46440
+SG3O3 16 32.060000 0.000 A 0.356359487256 1.46440
+ SL 16 32.060000 0.000 A 0.374177461619 1.96648
+ SM 16 32.060000 0.000 A 0.351904993665 1.58992
+ SOD 11 22.989770 0.000 A 0.251367073323 0.19623
+ SS 16 32.060000 0.000 A 0.391995435982 1.96648
+ ZN 30 65.370000 0.000 A 0.194215920555 1.04600
+ ON2B 8 15.999400 0.000 A 0.315378146200 0.6363864 ; phospho residues
+ SP 16 32.060000 0.000 A 0.391995436000 1.88280 ; S-adenosyl methionine
+; The following atom types are NOT part of the CHARMM distribution
+; atomtypes for additional water models
+#ifdef HEAVY_H
+OWT4 8 9.951400 0.0 A 3.15365e-01 6.48520e-01 ; TIP4p O
+HWT4 1 4.032000 0.52 A 0.0 0.0 ; TIP4p H
+MWT4 0 0.000000 -1.04 A 0.0 0.0 ; TIP 4p vsite
+OW 8 9.951400 -0.82 A 3.16557e-01 6.50194e-01 ; SPC 0
+HW 1 4.032000 0.41 A 0.0 0.0; SPC H
+#else
+OWT4 8 15.999400 0.0 A 3.15365e-01 6.48520e-01 ; TIP4p O
+HWT4 1 1.008000 0.52 A 0.0 0.0 ; TIP4p H
+MWT4 0 0.000000 -1.04 A 0.0 0.0 ; TIP4p vsite
+OW 8 15.999400 -0.82 A 3.16557e-01 6.50194e-01 ; SPC O
+HW 1 1.008000 0.41 A 0.0 0.0 ; SPC H
+#endif
+; special dummy-type particles
+MNH3 0 0.000000 0.00 A 0.0 0.0
+MNH2 0 0.000000 0.00 A 0.0 0.0
+MCH3 0 0.000000 0.00 A 0.0 0.0
+MCH3S 0 0.000000 0.00 A 0.0 0.0
+MW 0 0.000000 0.00 A 0.0 0.0
+; Updated Mg2+ parameters by Allner et al. (DOI: 10.1021/ct3000734)
+MGA 12 24.305000 0.000 A 0.277000 0.01234280
+
+[ pairtypes ]
+ CP1 C 1 0.347450500075 0.138767581228
+ CP1 CA 1 0.346773417049 0.110698234855
+ CP1 CC 1 0.347450500075 0.110698234855
+ CP1 CD 1 0.347450500075 0.110698234855
+ CP1 CE1 1 0.355468588538 0.109105371453
+ CP1 CE2 1 0.354577689820 0.105847757841
+ CP1 CP1 1 0.338541512893 0.041840000000
+ CP1 CP2 1 0.338541512893 0.041840000000
+ CP1 CP3 1 0.338541512893 0.041840000000
+ CP1 CPH1 1 0.329632525712 0.093557084179
+ CP1 CPH2 1 0.329632525712 0.093557084179
+ CP1 CS 1 0.365268474438 0.138767581228
+ CP1 CPT 1 0.334977918021 0.131646486622
+ CP1 CY 1 0.346559601357 0.113045454929
+ CP1 CAI 1 0.346559601357 0.113045454929
+ CP1 CT 1 0.338541512893 0.041840000000
+ CP1 CT1 1 0.338541512893 0.041840000000
+ CP1 CT2 1 0.338541512893 0.041840000000
+ CP1 CT2A 1 0.338541512893 0.041840000000
+ CP1 CT3 1 0.338541512893 0.041840000000
+ CP1 H 1 0.189271432669 0.089736802707
+ CP1 HA 1 0.286869387241 0.062058748940
+ CP1 HB1 1 0.286869387241 0.062058748940
+ CP1 HB2 1 0.288651184677 0.070011711020
+ CP1 HE1 1 0.280633096214 0.073666921749
+ CP1 HE2 1 0.281523994932 0.067464972838
+ CP1 HC 1 0.189271432669 0.089736802707
+ CP1 HP 1 0.290272620344 0.072469005789
+ CP1 HR1 1 0.249451641079 0.089736802707
+ CP1 HR2 1 0.231633666716 0.089736802707
+ CP1 HR3 1 0.300054688270 0.036952087465
+ CP1 HS 1 0.209361198763 0.132309697301
+ CP1 HA1 1 0.288651184677 0.088756043175
+ CP1 HA2 1 0.288651184677 0.077149148019
+ CP1 HA3 1 0.288651184677 0.064818249282
+ CP1 N 1 0.334087019303 0.004184000000
+ CP1 NC2 1 0.334087019303 0.187114168357
+ CP1 NH1 1 0.307360057758 0.187114168357
+ CP1 NH2 1 0.334087019303 0.187114168357
+ CP1 NH3 1 0.334087019303 0.187114168357
+ CP1 NP 1 0.334087019303 0.187114168357
+ CP1 NR1 1 0.334087019303 0.187114168357
+ CP1 NR2 1 0.334087019303 0.187114168357
+ CP1 NR3 1 0.334087019303 0.187114168357
+ CP1 NY 1 0.334087019303 0.187114168357
+ CP1 O 1 0.293996576986 0.144938011577
+ CP1 OB 1 0.293996576986 0.144938011577
+ CP1 OC 1 0.320723538531 0.144938011577
+ CP1 OH1 1 0.326959829558 0.163176000000
+ CP1 OS 1 0.326959829558 0.163176000000
+ CP1 S 1 0.347450500075 0.280671252536
+ CP1 SM 1 0.345223253279 0.257919081884
+ CP1 SS 1 0.365268474438 0.286840588481
+ CP1 HT 1 0.189271432669 0.089736802707
+ CP1 OT 1 0.326799467788 0.163176000000
+ CP1 OX 1 0.320723538531 0.144938011577
+ CP1 HX 1 0.189271432669 0.089736802707
+ CP1 LIT 1 0.284864865125 0.020196198771
+ CP1 SOD 1 0.294954293108 0.090610410351
+ CP1 MG 1 0.274842254546 0.051243325419
+ CP1 POT 1 0.326403017859 0.123410269913
+ CP1 CAL 1 0.291056611216 0.144938011577
+ CP1 RUB 1 0.338541512893 0.162045623205
+ CP1 CES 1 0.356359487256 0.182376331798
+ CP1 BAR 1 0.337650614175 0.162045623205
+ CP1 ZN 1 0.266378716724 0.209200000000
+ CP1 CAD 1 0.290165712498 0.144938011577
+ CP1 CLA 1 0.371504765465 0.162045623205
+ CP1 HGA1 1 0.288651184677 0.088756043175
+ CP1 HGA2 1 0.288651184677 0.078275472531
+ CP1 HGA3 1 0.288651184677 0.064818249282
+ CP1 HGA4 1 0.280633096214 0.073666921749
+ CP1 HGA5 1 0.281523994932 0.067464972838
+ CP1 HGA6 1 0.286869387241 0.070011711020
+ CP1 HGA7 1 0.285087589805 0.072469005789
+ CP1 HGAAM0 1 0.283305792369 0.070011711020
+ CP1 HGAAM1 1 0.283305792369 0.070011711020
+ CP1 HGAAM2 1 0.281523994932 0.083680000000
+ CP1 HGP1 1 0.189271432669 0.089736802707
+ CP1 HGP2 1 0.189271432669 0.089736802707
+ CP1 HGP3 1 0.209361198763 0.132309697301
+ CP1 HGP4 1 0.189271432669 0.089736802707
+ CP1 HGP5 1 0.231633666716 0.089736802707
+ CP1 HGPAM1 1 0.247224394284 0.039692909190
+ CP1 HGPAM2 1 0.247224394284 0.041840000000
+ CP1 HGPAM3 1 0.246778944925 0.045833423612
+ CP1 HGR51 1 0.290272620344 0.072469005789
+ CP1 HGR52 1 0.249451641079 0.089736802707
+ CP1 HGR53 1 0.231633666716 0.089736802707
+ CP1 HGR61 1 0.290272620344 0.072469005789
+ CP1 HGR62 1 0.267269615442 0.089736802707
+ CP1 HGR63 1 0.249451641079 0.089736802707
+ CP1 HGR71 1 0.290272620344 0.072469005789
+ CP1 CG1T1 1 0.333196120584 0.170981810495
+ CP1 CG1T2 1 0.346782326036 0.134409982486
+ CP1 CG1N1 1 0.335868816739 0.177512086349
+ CP1 CG2D1 1 0.355468588538 0.109105371453
+ CP1 CG2D2 1 0.354577689820 0.105847757841
+ CP1 CG2D1O 1 0.355468588538 0.109105371453
+ CP1 CG2D2O 1 0.355468588538 0.109105371453
+ CP1 CG2DC1 1 0.355468588538 0.109105371453
+ CP1 CG2DC2 1 0.355468588538 0.109105371453
+ CP1 CG2DC3 1 0.354577689820 0.105847757841
+ CP1 CG25C1 1 0.355468588538 0.109105371453
+ CP1 CG25C2 1 0.355468588538 0.109105371453
+ CP1 CG251O 1 0.355468588538 0.109105371453
+ CP1 CG252O 1 0.355468588538 0.109105371453
+ CP1 CG2N1 1 0.347450500075 0.138767581228
+ CP1 CG2N2 1 0.347450500075 0.138767581228
+ CP1 CG2O1 1 0.347450500075 0.138767581228
+ CP1 CG2O2 1 0.320723538531 0.130979917850
+ CP1 CG2O3 1 0.347450500075 0.110698234855
+ CP1 CG2O4 1 0.329632525712 0.102486650838
+ CP1 CG2O5 1 0.347450500075 0.125520000000
+ CP1 CG2O6 1 0.347450500075 0.110698234855
+ CP1 CG2O7 1 0.308518226092 0.100764063435
+ CP1 CG2R51 1 0.356359487256 0.093557084179
+ CP1 CG2R52 1 0.365268474438 0.059170695450
+ CP1 CG2R53 1 0.365268474438 0.059170695450
+ CP1 CG2R57 1 0.356359487256 0.093557084179
+ CP1 CG2R61 1 0.346773417049 0.110698234855
+ CP1 CG2R62 1 0.338541512893 0.125520000000
+ CP1 CG2R63 1 0.338541512893 0.132309697301
+ CP1 CG2R64 1 0.356359487256 0.083680000000
+ CP1 CG2R66 1 0.338541512893 0.110698234855
+ CP1 CG2R67 1 0.346773417049 0.110698234855
+ CP1 CG2RC0 1 0.334977918021 0.131646486622
+ CP1 CG2R71 1 0.346987232741 0.108300154755
+ CP1 CG2RC7 1 0.334977918021 0.131646486622
+ CP1 CG301 1 0.338541512893 0.041840000000
+ CP1 CG302 1 0.374177461619 0.059170695450
+ CP1 CG311 1 0.338541512893 0.041840000000
+ CP1 CG312 1 0.351904993665 0.085746484010
+ CP1 CG314 1 0.338541512893 0.041840000000
+ CP1 CG321 1 0.338541512893 0.041840000000
+ CP1 CG322 1 0.338541512893 0.102486650838
+ CP1 CG323 1 0.365268474438 0.138767581228
+ CP1 CG324 1 0.338541512893 0.041840000000
+ CP1 CG331 1 0.338541512893 0.041840000000
+ CP1 CG334 1 0.338541512893 0.041840000000
+ CP1 CG3C50 1 0.338541512893 0.041840000000
+ CP1 CG3C51 1 0.338541512893 0.041840000000
+ CP1 CG3C52 1 0.338541512893 0.041840000000
+ CP1 CG3C53 1 0.338541512893 0.041840000000
+ CP1 CG3C54 1 0.338541512893 0.041840000000
+ CP1 CG3C31 1 0.338541512893 0.041840000000
+ CP1 CG3C41 1 0.338541512893 0.041840000000
+ CP1 CG3RC1 1 0.338541512893 0.041840000000
+ CP1 CG3AM0 1 0.344777803920 0.110698234855
+ CP1 CG3AM1 1 0.345668702638 0.116852760686
+ CP1 CG3AM2 1 0.346559601357 0.118341390899
+ CP1 NG1T1 1 0.328741626994 0.177512086349
+ CP1 NG2D1 1 0.334087019303 0.187114168357
+ CP1 NG2S0 1 0.334087019303 0.004184000000
+ CP1 NG2S1 1 0.307360057758 0.187114168357
+ CP1 NG2S2 1 0.334087019303 0.187114168357
+ CP1 NG2S3 1 0.334087019303 0.187114168357
+ CP1 NG2O1 1 0.334087019303 0.187114168357
+ CP1 NG2P1 1 0.334087019303 0.187114168357
+ CP1 NG2R43 1 0.334087019303 0.187114168357
+ CP1 NG2R50 1 0.334087019303 0.187114168357
+ CP1 NG2R51 1 0.334087019303 0.187114168357
+ CP1 NG2R52 1 0.334087019303 0.187114168357
+ CP1 NG2R53 1 0.334087019303 0.187114168357
+ CP1 NG2R57 1 0.334087019303 0.187114168357
+ CP1 NG2R60 1 0.337650614175 0.102486650838
+ CP1 NG2R61 1 0.334087019303 0.187114168357
+ CP1 NG2R62 1 0.352795892384 0.093557084179
+ CP1 NG2R67 1 0.334087019303 0.187114168357
+ CP1 NG2RC0 1 0.334087019303 0.187114168357
+ CP1 NG301 1 0.347450500075 0.078275472531
+ CP1 NG311 1 0.347450500075 0.088756043175
+ CP1 NG321 1 0.346559601357 0.102486650838
+ CP1 NG331 1 0.345668702638 0.110698234855
+ CP1 NG3C51 1 0.334087019303 0.187114168357
+ CP1 NG3N1 1 0.351904993665 0.102486650838
+ CP1 NG3P0 1 0.334087019303 0.187114168357
+ CP1 NG3P1 1 0.334087019303 0.187114168357
+ CP1 NG3P2 1 0.334087019303 0.187114168357
+ CP1 NG3P3 1 0.334087019303 0.187114168357
+ CP1 OG2D1 1 0.293996576986 0.144938011577
+ CP1 OG2D2 1 0.320723538531 0.144938011577
+ CP1 OG2D3 1 0.293996576986 0.144938011577
+ CP1 OG2D4 1 0.320723538531 0.144938011577
+ CP1 OG2D5 1 0.320010819556 0.169954883425
+ CP1 OG2N1 1 0.320723538531 0.144938011577
+ CP1 OG2P1 1 0.320723538531 0.144938011577
+ CP1 OG2R50 1 0.320723538531 0.144938011577
+ CP1 OG3R60 1 0.316269044940 0.132309697301
+ CP1 OG301 1 0.316269044940 0.132309697301
+ CP1 OG302 1 0.316269044940 0.132309697301
+ CP1 OG303 1 0.316269044940 0.132309697301
+ CP1 OG304 1 0.316269044940 0.132309697301
+ CP1 OG311 1 0.326514380198 0.183381431383
+ CP1 OG312 1 0.325178032121 0.144938011577
+ CP1 OG3C31 1 0.316269044940 0.132309697301
+ CP1 OG3C51 1 0.316269044940 0.132309697301
+ CP1 OG3C61 1 0.316269044940 0.132309697301
+ CP1 SG2D1 1 0.351904993665 0.314496560236
+ CP1 SG2R50 1 0.347450500075 0.280671252536
+ CP1 SG311 1 0.347450500075 0.280671252536
+ CP1 SG301 1 0.345223253279 0.257919081884
+ CP1 SG302 1 0.365268474438 0.286840588481
+ CP1 SG3O1 1 0.356359487256 0.286840588481
+ CP1 SG3O2 1 0.347450500075 0.247528778125
+ CP1 SG3O3 1 0.347450500075 0.247528778125
+ CP1 FGA1 1 0.314487247504 0.153729976257
+ CP1 FGA2 1 0.314487247504 0.135577095411
+ CP1 FGA3 1 0.311814551349 0.130309939452
+ CP1 FGP1 1 0.311814551349 0.130309939452
+ CP1 FGR1 1 0.320723538531 0.144938011577
+ CP1 CLGA1 1 0.339432411611 0.245040988571
+ CP1 CLGA3 1 0.339432411611 0.232955260941
+ CP1 CLGR1 1 0.341214209048 0.236682781799
+ CP1 BRGA1 1 0.344777803920 0.289876023155
+ CP1 BRGA2 1 0.351904993665 0.304599797767
+ CP1 BRGA3 1 0.347450500075 0.307459952514
+ CP1 BRGR1 1 0.353686791102 0.271154190821
+ CP1 IGR1 1 0.364377575719 0.310293744700
+ CP1 PG0 1 0.360813980847 0.320014464673
+ CP1 PG1 1 0.360813980847 0.320014464673
+ CP1 PG2 1 0.360813980847 0.320014464673
+ CP1 ALG1 1 0.347450500075 0.337324864189
+ CP1 CC301 1 0.338541512893 0.041840000000
+ CP1 CC3062 1 0.338541512893 0.041840000000
+ CP1 CC311 1 0.338541512893 0.041840000000
+ CP1 CC3161 1 0.338541512893 0.041840000000
+ CP1 CC3162 1 0.338541512893 0.041840000000
+ CP1 CC3163 1 0.338541512893 0.041840000000
+ CP1 CC321 1 0.338541512893 0.041840000000
+ CP1 CC3261 1 0.338541512893 0.041840000000
+ CP1 CC3263 1 0.338541512893 0.041840000000
+ CP1 CC331 1 0.338541512893 0.041840000000
+ CP1 CC2O1 1 0.347450500075 0.138767581228
+ CP1 CC2O2 1 0.347450500075 0.110698234855
+ CP1 CC2O3 1 0.347450500075 0.125520000000
+ CP1 CC2O4 1 0.329632525712 0.102486650838
+ CP1 OC2D1 1 0.293996576986 0.144938011577
+ CP1 OC2D2 1 0.320723538531 0.144938011577
+ CP1 OC2D3 1 0.293996576986 0.144938011577
+ CP1 OC2D4 1 0.293996576986 0.144938011577
+ CP1 OC3C61 1 0.316269044940 0.132309697301
+ CP1 OC311 1 0.326514380198 0.183381431383
+ CP1 NC2D1 1 0.307360057758 0.187114168357
+ CP1 HCP1 1 0.189271432669 0.089736802707
+ CP1 HCA1 1 0.288651184677 0.088756043175
+ CP1 HCA2 1 0.288651184677 0.078275472531
+ CP1 HCA3 1 0.288651184677 0.064818249282
+ CP1 CC312 1 0.338541512893 0.041840000000
+ CP1 CC322 1 0.338541512893 0.041840000000
+ CP1 HCR1 1 0.240542653898 0.089736802707
+ CP1 HCA3M 1 0.288651184677 0.064818249282
+ CP1 CC321C 1 0.338541512893 0.041840000000
+ CP1 CC321D 1 0.338541512893 0.041840000000
+ CP1 CC311C 1 0.338541512893 0.041840000000
+ CP1 CC311D 1 0.338541512893 0.041840000000
+ CP1 OC301 1 0.316269044940 0.132309697301
+ CP1 OC302 1 0.316269044940 0.132309697301
+ CP1 HCP1M 1 0.189271432669 0.089736802707
+ CP1 OC311M 1 0.326514380198 0.183381431383
+ CP1 OC3C5M 1 0.316269044940 0.132309697301
+ CP1 CC322C 1 0.338541512893 0.041840000000
+ CP1 HCA2C2 1 0.285087589805 0.078275472531
+ CP1 CC312C 1 0.338541512893 0.041840000000
+ CP1 HCA1C2 1 0.288651184677 0.088756043175
+ CP1 OC3C51 1 0.316269044940 0.132309697301
+ CP1 CC3152 1 0.338541512893 0.041840000000
+ CP1 CC3051 1 0.338541512893 0.041840000000
+ CP1 CC3251 1 0.338541512893 0.041840000000
+ CP1 CC3151 1 0.338541512893 0.041840000000
+ CP1 CC3153 1 0.338541512893 0.041840000000
+ CP1 OC2DP 1 0.320723538531 0.144938011577
+ CP1 OC312 1 0.326959829558 0.163176000000
+ CP1 OC30P 1 0.326959829558 0.163176000000
+ CP1 PC 1 0.360813980847 0.320014464673
+ CP1 SC 1 0.356359487256 0.286840588481
+ CP1 CC312D 1 0.338541512893 0.041840000000
+ CP1 OC303 1 0.316269044940 0.132309697301
+ CP1 HN1 1 0.189271432669 0.089736802707
+ CP1 HN2 1 0.189271432669 0.089736802707
+ CP1 HN3 1 0.267269615442 0.089736802707
+ CP1 HN4 1 0.189271432669 0.089736802707
+ CP1 HN5 1 0.189271432669 0.089736802707
+ CP1 HN6 1 0.286869387241 0.062058748940
+ CP1 HN7 1 0.286869387241 0.062058748940
+ CP1 HN8 1 0.288651184677 0.070011711020
+ CP1 HN9 1 0.288651184677 0.064818249282
+ CP1 NN1 1 0.334087019303 0.187114168357
+ CP1 NN2 1 0.334087019303 0.187114168357
+ CP1 NN2B 1 0.334087019303 0.187114168357
+ CP1 NN2G 1 0.334087019303 0.187114168357
+ CP1 NN2U 1 0.334087019303 0.187114168357
+ CP1 NN3 1 0.334087019303 0.187114168357
+ CP1 NN3A 1 0.334087019303 0.187114168357
+ CP1 NN3G 1 0.334087019303 0.187114168357
+ CP1 NN4 1 0.334087019303 0.187114168357
+ CP1 NN6 1 0.334087019303 0.187114168357
+ CP1 ON1 1 0.320723538531 0.144938011577
+ CP1 ON1C 1 0.320723538531 0.144938011577
+ CP1 ON2 1 0.326959829558 0.163176000000
+ CP1 ON3 1 0.320723538531 0.144938011577
+ CP1 ON4 1 0.326959829558 0.163176000000
+ CP1 ON5 1 0.326959829558 0.163176000000
+ CP1 ON6 1 0.326959829558 0.163176000000
+ CP1 ON6B 1 0.326959829558 0.163176000000
+ CP1 CN1 1 0.338541512893 0.132309697301
+ CP1 CN1T 1 0.338541512893 0.132309697301
+ CP1 CN2 1 0.338541512893 0.132309697301
+ CP1 CN3 1 0.338541512893 0.125520000000
+ CP1 CN3T 1 0.338541512893 0.125520000000
+ CP1 CN4 1 0.338541512893 0.114583559030
+ CP1 CN5 1 0.338541512893 0.114583559030
+ CP1 CN5G 1 0.338541512893 0.114583559030
+ CP1 CN7 1 0.338541512893 0.041840000000
+ CP1 CN7B 1 0.338541512893 0.041840000000
+ CP1 CN8 1 0.338541512893 0.041840000000
+ CP1 CN8B 1 0.338541512893 0.041840000000
+ CP1 CN9 1 0.338541512893 0.041840000000
+ CP1 P 1 0.360813980847 0.320014464673
+ CP1 P2 1 0.360813980847 0.320014464673
+ CP1 HOL 1 0.189271432669 0.089736802707
+ CP1 HAL1 1 0.286869387241 0.062058748940
+ CP1 HAL2 1 0.288651184677 0.070011711020
+ CP1 HAL3 1 0.288651184677 0.064818249282
+ CP1 HBL 1 0.286869387241 0.062058748940
+ CP1 HCL 1 0.189271432669 0.089736802707
+ CP1 HL 1 0.231633666716 0.089736802707
+ CP1 HEL1 1 0.280633096214 0.073666921749
+ CP1 HEL2 1 0.281523994932 0.067464972838
+ CP1 CL 1 0.347450500075 0.110698234855
+ CP1 CCL 1 0.347450500075 0.110698234855
+ CP1 CTL1 1 0.338541512893 0.041840000000
+ CP1 CTL2 1 0.338541512893 0.041840000000
+ CP1 CTL3 1 0.338541512893 0.041840000000
+ CP1 CTL5 1 0.338541512893 0.041840000000
+ CP1 CEL1 1 0.355468588538 0.109105371453
+ CP1 CEL2 1 0.354577689820 0.105847757841
+ CP1 CRL1 1 0.338541512893 0.041840000000
+ CP1 CRL2 1 0.338541512893 0.041840000000
+ CP1 OBL 1 0.293996576986 0.144938011577
+ CP1 OCL 1 0.320723538531 0.144938011577
+ CP1 O2L 1 0.320723538531 0.144938011577
+ CP1 OHL 1 0.326959829558 0.163176000000
+ CP1 OSL 1 0.316269044940 0.132309697301
+ CP1 OSLP 1 0.316269044940 0.132309697301
+ CP1 NH3L 1 0.334087019303 0.187114168357
+ CP1 NTL 1 0.334087019303 0.187114168357
+ CP1 SL 1 0.356359487256 0.286840588481
+ CP1 PL 1 0.360813980847 0.320014464673
+ CP1 HCA1A 1 0.288651184677 0.088756043175
+ CP1 HCA2A 1 0.288651184677 0.078275472531
+ CP1 HCA3A 1 0.288651184677 0.064818249282
+ CP1 CC30A 1 0.338541512893 0.041840000000
+ CP1 CC31A 1 0.338541512893 0.041840000000
+ CP1 CC32A 1 0.338541512893 0.041840000000
+ CP1 CC33A 1 0.338541512893 0.041840000000
+ CP1 CC326A 1 0.338541512893 0.041840000000
+ CP1 HCA25A 1 0.285087589805 0.078275472531
+ CP1 CC325A 1 0.338541512893 0.041840000000
+ CP1 CC325B 1 0.338541512893 0.041840000000
+ CP1 OC305A 1 0.316269044940 0.132309697301
+ CP1 OC30A 1 0.316269044940 0.132309697301
+ CP1 CPA 1 0.329632525712 0.125520000000
+ CP1 CPB 1 0.329632525712 0.125520000000
+ CP1 CPM 1 0.329632525712 0.125520000000
+ CP1 CM 1 0.356359487256 0.138767581228
+ CP1 CST 1 0.308518226092 0.100764063435
+ CP1 NPH 1 0.334087019303 0.187114168357
+ CP1 OM 1 0.320723538531 0.144938011577
+ CP1 OST 1 0.320010819556 0.169954883425
+ CP1 FE 1 0.227179173126 0.000000000000
+ CP1 ON2B 1 0.326959829558 0.163176000000
+ CP1 SP 1 0.365268474438 0.280671252536
+ CP2 C 1 0.347450500075 0.138767581228
+ CP2 CA 1 0.346773417049 0.110698234855
+ CP2 CC 1 0.347450500075 0.110698234855
+ CP2 CD 1 0.347450500075 0.110698234855
+ CP2 CE1 1 0.355468588538 0.109105371453
+ CP2 CE2 1 0.354577689820 0.105847757841
+ CP2 CP1 1 0.338541512893 0.041840000000
+ CP2 CP2 1 0.338541512893 0.041840000000
+ CP2 CP3 1 0.338541512893 0.041840000000
+ CP2 CPH1 1 0.329632525712 0.093557084179
+ CP2 CPH2 1 0.329632525712 0.093557084179
+ CP2 CS 1 0.365268474438 0.138767581228
+ CP2 CPT 1 0.334977918021 0.131646486622
+ CP2 CY 1 0.346559601357 0.113045454929
+ CP2 CAI 1 0.346559601357 0.113045454929
+ CP2 CT 1 0.338541512893 0.041840000000
+ CP2 CT1 1 0.338541512893 0.041840000000
+ CP2 CT2 1 0.338541512893 0.041840000000
+ CP2 CT2A 1 0.338541512893 0.041840000000
+ CP2 CT3 1 0.338541512893 0.041840000000
+ CP2 H 1 0.189271432669 0.089736802707
+ CP2 HA 1 0.286869387241 0.062058748940
+ CP2 HB1 1 0.286869387241 0.062058748940
+ CP2 HB2 1 0.288651184677 0.070011711020
+ CP2 HE1 1 0.280633096214 0.073666921749
+ CP2 HE2 1 0.281523994932 0.067464972838
+ CP2 HC 1 0.189271432669 0.089736802707
+ CP2 HP 1 0.290272620344 0.072469005789
+ CP2 HR1 1 0.249451641079 0.089736802707
+ CP2 HR2 1 0.231633666716 0.089736802707
+ CP2 HR3 1 0.300054688270 0.036952087465
+ CP2 HS 1 0.209361198763 0.132309697301
+ CP2 HA1 1 0.288651184677 0.088756043175
+ CP2 HA2 1 0.288651184677 0.077149148019
+ CP2 HA3 1 0.288651184677 0.064818249282
+ CP2 N 1 0.334087019303 0.004184000000
+ CP2 NC2 1 0.334087019303 0.187114168357
+ CP2 NH1 1 0.307360057758 0.187114168357
+ CP2 NH2 1 0.334087019303 0.187114168357
+ CP2 NH3 1 0.334087019303 0.187114168357
+ CP2 NP 1 0.334087019303 0.187114168357
+ CP2 NR1 1 0.334087019303 0.187114168357
+ CP2 NR2 1 0.334087019303 0.187114168357
+ CP2 NR3 1 0.334087019303 0.187114168357
+ CP2 NY 1 0.334087019303 0.187114168357
+ CP2 O 1 0.293996576986 0.144938011577
+ CP2 OB 1 0.293996576986 0.144938011577
+ CP2 OC 1 0.320723538531 0.144938011577
+ CP2 OH1 1 0.326959829558 0.163176000000
+ CP2 OS 1 0.326959829558 0.163176000000
+ CP2 S 1 0.347450500075 0.280671252536
+ CP2 SM 1 0.345223253279 0.257919081884
+ CP2 SS 1 0.365268474438 0.286840588481
+ CP2 HT 1 0.189271432669 0.089736802707
+ CP2 OT 1 0.326799467788 0.163176000000
+ CP2 OX 1 0.320723538531 0.144938011577
+ CP2 HX 1 0.189271432669 0.089736802707
+ CP2 LIT 1 0.284864865125 0.020196198771
+ CP2 SOD 1 0.294954293108 0.090610410351
+ CP2 MG 1 0.274842254546 0.051243325419
+ CP2 POT 1 0.326403017859 0.123410269913
+ CP2 CAL 1 0.291056611216 0.144938011577
+ CP2 RUB 1 0.338541512893 0.162045623205
+ CP2 CES 1 0.356359487256 0.182376331798
+ CP2 BAR 1 0.337650614175 0.162045623205
+ CP2 ZN 1 0.266378716724 0.209200000000
+ CP2 CAD 1 0.290165712498 0.144938011577
+ CP2 CLA 1 0.371504765465 0.162045623205
+ CP2 HGA1 1 0.288651184677 0.088756043175
+ CP2 HGA2 1 0.288651184677 0.078275472531
+ CP2 HGA3 1 0.288651184677 0.064818249282
+ CP2 HGA4 1 0.280633096214 0.073666921749
+ CP2 HGA5 1 0.281523994932 0.067464972838
+ CP2 HGA6 1 0.286869387241 0.070011711020
+ CP2 HGA7 1 0.285087589805 0.072469005789
+ CP2 HGAAM0 1 0.283305792369 0.070011711020
+ CP2 HGAAM1 1 0.283305792369 0.070011711020
+ CP2 HGAAM2 1 0.281523994932 0.083680000000
+ CP2 HGP1 1 0.189271432669 0.089736802707
+ CP2 HGP2 1 0.189271432669 0.089736802707
+ CP2 HGP3 1 0.209361198763 0.132309697301
+ CP2 HGP4 1 0.189271432669 0.089736802707
+ CP2 HGP5 1 0.231633666716 0.089736802707
+ CP2 HGPAM1 1 0.247224394284 0.039692909190
+ CP2 HGPAM2 1 0.247224394284 0.041840000000
+ CP2 HGPAM3 1 0.246778944925 0.045833423612
+ CP2 HGR51 1 0.290272620344 0.072469005789
+ CP2 HGR52 1 0.249451641079 0.089736802707
+ CP2 HGR53 1 0.231633666716 0.089736802707
+ CP2 HGR61 1 0.290272620344 0.072469005789
+ CP2 HGR62 1 0.267269615442 0.089736802707
+ CP2 HGR63 1 0.249451641079 0.089736802707
+ CP2 HGR71 1 0.290272620344 0.072469005789
+ CP2 CG1T1 1 0.333196120584 0.170981810495
+ CP2 CG1T2 1 0.346782326036 0.134409982486
+ CP2 CG1N1 1 0.335868816739 0.177512086349
+ CP2 CG2D1 1 0.355468588538 0.109105371453
+ CP2 CG2D2 1 0.354577689820 0.105847757841
+ CP2 CG2D1O 1 0.355468588538 0.109105371453
+ CP2 CG2D2O 1 0.355468588538 0.109105371453
+ CP2 CG2DC1 1 0.355468588538 0.109105371453
+ CP2 CG2DC2 1 0.355468588538 0.109105371453
+ CP2 CG2DC3 1 0.354577689820 0.105847757841
+ CP2 CG25C1 1 0.355468588538 0.109105371453
+ CP2 CG25C2 1 0.355468588538 0.109105371453
+ CP2 CG251O 1 0.355468588538 0.109105371453
+ CP2 CG252O 1 0.355468588538 0.109105371453
+ CP2 CG2N1 1 0.347450500075 0.138767581228
+ CP2 CG2N2 1 0.347450500075 0.138767581228
+ CP2 CG2O1 1 0.347450500075 0.138767581228
+ CP2 CG2O2 1 0.320723538531 0.130979917850
+ CP2 CG2O3 1 0.347450500075 0.110698234855
+ CP2 CG2O4 1 0.329632525712 0.102486650838
+ CP2 CG2O5 1 0.347450500075 0.125520000000
+ CP2 CG2O6 1 0.347450500075 0.110698234855
+ CP2 CG2O7 1 0.308518226092 0.100764063435
+ CP2 CG2R51 1 0.356359487256 0.093557084179
+ CP2 CG2R52 1 0.365268474438 0.059170695450
+ CP2 CG2R53 1 0.365268474438 0.059170695450
+ CP2 CG2R57 1 0.356359487256 0.093557084179
+ CP2 CG2R61 1 0.346773417049 0.110698234855
+ CP2 CG2R62 1 0.338541512893 0.125520000000
+ CP2 CG2R63 1 0.338541512893 0.132309697301
+ CP2 CG2R64 1 0.356359487256 0.083680000000
+ CP2 CG2R66 1 0.338541512893 0.110698234855
+ CP2 CG2R67 1 0.346773417049 0.110698234855
+ CP2 CG2RC0 1 0.334977918021 0.131646486622
+ CP2 CG2R71 1 0.346987232741 0.108300154755
+ CP2 CG2RC7 1 0.334977918021 0.131646486622
+ CP2 CG301 1 0.338541512893 0.041840000000
+ CP2 CG302 1 0.374177461619 0.059170695450
+ CP2 CG311 1 0.338541512893 0.041840000000
+ CP2 CG312 1 0.351904993665 0.085746484010
+ CP2 CG314 1 0.338541512893 0.041840000000
+ CP2 CG321 1 0.338541512893 0.041840000000
+ CP2 CG322 1 0.338541512893 0.102486650838
+ CP2 CG323 1 0.365268474438 0.138767581228
+ CP2 CG324 1 0.338541512893 0.041840000000
+ CP2 CG331 1 0.338541512893 0.041840000000
+ CP2 CG334 1 0.338541512893 0.041840000000
+ CP2 CG3C50 1 0.338541512893 0.041840000000
+ CP2 CG3C51 1 0.338541512893 0.041840000000
+ CP2 CG3C52 1 0.338541512893 0.041840000000
+ CP2 CG3C53 1 0.338541512893 0.041840000000
+ CP2 CG3C54 1 0.338541512893 0.041840000000
+ CP2 CG3C31 1 0.338541512893 0.041840000000
+ CP2 CG3C41 1 0.338541512893 0.041840000000
+ CP2 CG3RC1 1 0.338541512893 0.041840000000
+ CP2 CG3AM0 1 0.344777803920 0.110698234855
+ CP2 CG3AM1 1 0.345668702638 0.116852760686
+ CP2 CG3AM2 1 0.346559601357 0.118341390899
+ CP2 NG1T1 1 0.328741626994 0.177512086349
+ CP2 NG2D1 1 0.334087019303 0.187114168357
+ CP2 NG2S0 1 0.334087019303 0.004184000000
+ CP2 NG2S1 1 0.307360057758 0.187114168357
+ CP2 NG2S2 1 0.334087019303 0.187114168357
+ CP2 NG2S3 1 0.334087019303 0.187114168357
+ CP2 NG2O1 1 0.334087019303 0.187114168357
+ CP2 NG2P1 1 0.334087019303 0.187114168357
+ CP2 NG2R43 1 0.334087019303 0.187114168357
+ CP2 NG2R50 1 0.334087019303 0.187114168357
+ CP2 NG2R51 1 0.334087019303 0.187114168357
+ CP2 NG2R52 1 0.334087019303 0.187114168357
+ CP2 NG2R53 1 0.334087019303 0.187114168357
+ CP2 NG2R57 1 0.334087019303 0.187114168357
+ CP2 NG2R60 1 0.337650614175 0.102486650838
+ CP2 NG2R61 1 0.334087019303 0.187114168357
+ CP2 NG2R62 1 0.352795892384 0.093557084179
+ CP2 NG2R67 1 0.334087019303 0.187114168357
+ CP2 NG2RC0 1 0.334087019303 0.187114168357
+ CP2 NG301 1 0.347450500075 0.078275472531
+ CP2 NG311 1 0.347450500075 0.088756043175
+ CP2 NG321 1 0.346559601357 0.102486650838
+ CP2 NG331 1 0.345668702638 0.110698234855
+ CP2 NG3C51 1 0.334087019303 0.187114168357
+ CP2 NG3N1 1 0.351904993665 0.102486650838
+ CP2 NG3P0 1 0.334087019303 0.187114168357
+ CP2 NG3P1 1 0.334087019303 0.187114168357
+ CP2 NG3P2 1 0.334087019303 0.187114168357
+ CP2 NG3P3 1 0.334087019303 0.187114168357
+ CP2 OG2D1 1 0.293996576986 0.144938011577
+ CP2 OG2D2 1 0.320723538531 0.144938011577
+ CP2 OG2D3 1 0.293996576986 0.144938011577
+ CP2 OG2D4 1 0.320723538531 0.144938011577
+ CP2 OG2D5 1 0.320010819556 0.169954883425
+ CP2 OG2N1 1 0.320723538531 0.144938011577
+ CP2 OG2P1 1 0.320723538531 0.144938011577
+ CP2 OG2R50 1 0.320723538531 0.144938011577
+ CP2 OG3R60 1 0.316269044940 0.132309697301
+ CP2 OG301 1 0.316269044940 0.132309697301
+ CP2 OG302 1 0.316269044940 0.132309697301
+ CP2 OG303 1 0.316269044940 0.132309697301
+ CP2 OG304 1 0.316269044940 0.132309697301
+ CP2 OG311 1 0.326514380198 0.183381431383
+ CP2 OG312 1 0.325178032121 0.144938011577
+ CP2 OG3C31 1 0.316269044940 0.132309697301
+ CP2 OG3C51 1 0.316269044940 0.132309697301
+ CP2 OG3C61 1 0.316269044940 0.132309697301
+ CP2 SG2D1 1 0.351904993665 0.314496560236
+ CP2 SG2R50 1 0.347450500075 0.280671252536
+ CP2 SG311 1 0.347450500075 0.280671252536
+ CP2 SG301 1 0.345223253279 0.257919081884
+ CP2 SG302 1 0.365268474438 0.286840588481
+ CP2 SG3O1 1 0.356359487256 0.286840588481
+ CP2 SG3O2 1 0.347450500075 0.247528778125
+ CP2 SG3O3 1 0.347450500075 0.247528778125
+ CP2 FGA1 1 0.314487247504 0.153729976257
+ CP2 FGA2 1 0.314487247504 0.135577095411
+ CP2 FGA3 1 0.311814551349 0.130309939452
+ CP2 FGP1 1 0.311814551349 0.130309939452
+ CP2 FGR1 1 0.320723538531 0.144938011577
+ CP2 CLGA1 1 0.339432411611 0.245040988571
+ CP2 CLGA3 1 0.339432411611 0.232955260941
+ CP2 CLGR1 1 0.341214209048 0.236682781799
+ CP2 BRGA1 1 0.344777803920 0.289876023155
+ CP2 BRGA2 1 0.351904993665 0.304599797767
+ CP2 BRGA3 1 0.347450500075 0.307459952514
+ CP2 BRGR1 1 0.353686791102 0.271154190821
+ CP2 IGR1 1 0.364377575719 0.310293744700
+ CP2 PG0 1 0.360813980847 0.320014464673
+ CP2 PG1 1 0.360813980847 0.320014464673
+ CP2 PG2 1 0.360813980847 0.320014464673
+ CP2 ALG1 1 0.347450500075 0.337324864189
+ CP2 CC301 1 0.338541512893 0.041840000000
+ CP2 CC3062 1 0.338541512893 0.041840000000
+ CP2 CC311 1 0.338541512893 0.041840000000
+ CP2 CC3161 1 0.338541512893 0.041840000000
+ CP2 CC3162 1 0.338541512893 0.041840000000
+ CP2 CC3163 1 0.338541512893 0.041840000000
+ CP2 CC321 1 0.338541512893 0.041840000000
+ CP2 CC3261 1 0.338541512893 0.041840000000
+ CP2 CC3263 1 0.338541512893 0.041840000000
+ CP2 CC331 1 0.338541512893 0.041840000000
+ CP2 CC2O1 1 0.347450500075 0.138767581228
+ CP2 CC2O2 1 0.347450500075 0.110698234855
+ CP2 CC2O3 1 0.347450500075 0.125520000000
+ CP2 CC2O4 1 0.329632525712 0.102486650838
+ CP2 OC2D1 1 0.293996576986 0.144938011577
+ CP2 OC2D2 1 0.320723538531 0.144938011577
+ CP2 OC2D3 1 0.293996576986 0.144938011577
+ CP2 OC2D4 1 0.293996576986 0.144938011577
+ CP2 OC3C61 1 0.316269044940 0.132309697301
+ CP2 OC311 1 0.326514380198 0.183381431383
+ CP2 NC2D1 1 0.307360057758 0.187114168357
+ CP2 HCP1 1 0.189271432669 0.089736802707
+ CP2 HCA1 1 0.288651184677 0.088756043175
+ CP2 HCA2 1 0.288651184677 0.078275472531
+ CP2 HCA3 1 0.288651184677 0.064818249282
+ CP2 CC312 1 0.338541512893 0.041840000000
+ CP2 CC322 1 0.338541512893 0.041840000000
+ CP2 HCR1 1 0.240542653898 0.089736802707
+ CP2 HCA3M 1 0.288651184677 0.064818249282
+ CP2 CC321C 1 0.338541512893 0.041840000000
+ CP2 CC321D 1 0.338541512893 0.041840000000
+ CP2 CC311C 1 0.338541512893 0.041840000000
+ CP2 CC311D 1 0.338541512893 0.041840000000
+ CP2 OC301 1 0.316269044940 0.132309697301
+ CP2 OC302 1 0.316269044940 0.132309697301
+ CP2 HCP1M 1 0.189271432669 0.089736802707
+ CP2 OC311M 1 0.326514380198 0.183381431383
+ CP2 OC3C5M 1 0.316269044940 0.132309697301
+ CP2 CC322C 1 0.338541512893 0.041840000000
+ CP2 HCA2C2 1 0.285087589805 0.078275472531
+ CP2 CC312C 1 0.338541512893 0.041840000000
+ CP2 HCA1C2 1 0.288651184677 0.088756043175
+ CP2 OC3C51 1 0.316269044940 0.132309697301
+ CP2 CC3152 1 0.338541512893 0.041840000000
+ CP2 CC3051 1 0.338541512893 0.041840000000
+ CP2 CC3251 1 0.338541512893 0.041840000000
+ CP2 CC3151 1 0.338541512893 0.041840000000
+ CP2 CC3153 1 0.338541512893 0.041840000000
+ CP2 OC2DP 1 0.320723538531 0.144938011577
+ CP2 OC312 1 0.326959829558 0.163176000000
+ CP2 OC30P 1 0.326959829558 0.163176000000
+ CP2 PC 1 0.360813980847 0.320014464673
+ CP2 SC 1 0.356359487256 0.286840588481
+ CP2 CC312D 1 0.338541512893 0.041840000000
+ CP2 OC303 1 0.316269044940 0.132309697301
+ CP2 HN1 1 0.189271432669 0.089736802707
+ CP2 HN2 1 0.189271432669 0.089736802707
+ CP2 HN3 1 0.267269615442 0.089736802707
+ CP2 HN4 1 0.189271432669 0.089736802707
+ CP2 HN5 1 0.189271432669 0.089736802707
+ CP2 HN6 1 0.286869387241 0.062058748940
+ CP2 HN7 1 0.286869387241 0.062058748940
+ CP2 HN8 1 0.288651184677 0.070011711020
+ CP2 HN9 1 0.288651184677 0.064818249282
+ CP2 NN1 1 0.334087019303 0.187114168357
+ CP2 NN2 1 0.334087019303 0.187114168357
+ CP2 NN2B 1 0.334087019303 0.187114168357
+ CP2 NN2G 1 0.334087019303 0.187114168357
+ CP2 NN2U 1 0.334087019303 0.187114168357
+ CP2 NN3 1 0.334087019303 0.187114168357
+ CP2 NN3A 1 0.334087019303 0.187114168357
+ CP2 NN3G 1 0.334087019303 0.187114168357
+ CP2 NN4 1 0.334087019303 0.187114168357
+ CP2 NN6 1 0.334087019303 0.187114168357
+ CP2 ON1 1 0.320723538531 0.144938011577
+ CP2 ON1C 1 0.320723538531 0.144938011577
+ CP2 ON2 1 0.326959829558 0.163176000000
+ CP2 ON3 1 0.320723538531 0.144938011577
+ CP2 ON4 1 0.326959829558 0.163176000000
+ CP2 ON5 1 0.326959829558 0.163176000000
+ CP2 ON6 1 0.326959829558 0.163176000000
+ CP2 ON6B 1 0.326959829558 0.163176000000
+ CP2 CN1 1 0.338541512893 0.132309697301
+ CP2 CN1T 1 0.338541512893 0.132309697301
+ CP2 CN2 1 0.338541512893 0.132309697301
+ CP2 CN3 1 0.338541512893 0.125520000000
+ CP2 CN3T 1 0.338541512893 0.125520000000
+ CP2 CN4 1 0.338541512893 0.114583559030
+ CP2 CN5 1 0.338541512893 0.114583559030
+ CP2 CN5G 1 0.338541512893 0.114583559030
+ CP2 CN7 1 0.338541512893 0.041840000000
+ CP2 CN7B 1 0.338541512893 0.041840000000
+ CP2 CN8 1 0.338541512893 0.041840000000
+ CP2 CN8B 1 0.338541512893 0.041840000000
+ CP2 CN9 1 0.338541512893 0.041840000000
+ CP2 P 1 0.360813980847 0.320014464673
+ CP2 P2 1 0.360813980847 0.320014464673
+ CP2 HOL 1 0.189271432669 0.089736802707
+ CP2 HAL1 1 0.286869387241 0.062058748940
+ CP2 HAL2 1 0.288651184677 0.070011711020
+ CP2 HAL3 1 0.288651184677 0.064818249282
+ CP2 HBL 1 0.286869387241 0.062058748940
+ CP2 HCL 1 0.189271432669 0.089736802707
+ CP2 HL 1 0.231633666716 0.089736802707
+ CP2 HEL1 1 0.280633096214 0.073666921749
+ CP2 HEL2 1 0.281523994932 0.067464972838
+ CP2 CL 1 0.347450500075 0.110698234855
+ CP2 CCL 1 0.347450500075 0.110698234855
+ CP2 CTL1 1 0.338541512893 0.041840000000
+ CP2 CTL2 1 0.338541512893 0.041840000000
+ CP2 CTL3 1 0.338541512893 0.041840000000
+ CP2 CTL5 1 0.338541512893 0.041840000000
+ CP2 CEL1 1 0.355468588538 0.109105371453
+ CP2 CEL2 1 0.354577689820 0.105847757841
+ CP2 CRL1 1 0.338541512893 0.041840000000
+ CP2 CRL2 1 0.338541512893 0.041840000000
+ CP2 OBL 1 0.293996576986 0.144938011577
+ CP2 OCL 1 0.320723538531 0.144938011577
+ CP2 O2L 1 0.320723538531 0.144938011577
+ CP2 OHL 1 0.326959829558 0.163176000000
+ CP2 OSL 1 0.316269044940 0.132309697301
+ CP2 OSLP 1 0.316269044940 0.132309697301
+ CP2 NH3L 1 0.334087019303 0.187114168357
+ CP2 NTL 1 0.334087019303 0.187114168357
+ CP2 SL 1 0.356359487256 0.286840588481
+ CP2 PL 1 0.360813980847 0.320014464673
+ CP2 HCA1A 1 0.288651184677 0.088756043175
+ CP2 HCA2A 1 0.288651184677 0.078275472531
+ CP2 HCA3A 1 0.288651184677 0.064818249282
+ CP2 CC30A 1 0.338541512893 0.041840000000
+ CP2 CC31A 1 0.338541512893 0.041840000000
+ CP2 CC32A 1 0.338541512893 0.041840000000
+ CP2 CC33A 1 0.338541512893 0.041840000000
+ CP2 CC326A 1 0.338541512893 0.041840000000
+ CP2 HCA25A 1 0.285087589805 0.078275472531
+ CP2 CC325A 1 0.338541512893 0.041840000000
+ CP2 CC325B 1 0.338541512893 0.041840000000
+ CP2 OC305A 1 0.316269044940 0.132309697301
+ CP2 OC30A 1 0.316269044940 0.132309697301
+ CP2 CPA 1 0.329632525712 0.125520000000
+ CP2 CPB 1 0.329632525712 0.125520000000
+ CP2 CPM 1 0.329632525712 0.125520000000
+ CP2 CM 1 0.356359487256 0.138767581228
+ CP2 CST 1 0.308518226092 0.100764063435
+ CP2 NPH 1 0.334087019303 0.187114168357
+ CP2 OM 1 0.320723538531 0.144938011577
+ CP2 OST 1 0.320010819556 0.169954883425
+ CP2 FE 1 0.227179173126 0.000000000000
+ CP2 ON2B 1 0.326959829558 0.163176000000
+ CP2 SP 1 0.365268474438 0.280671252536
+ CP3 C 1 0.347450500075 0.138767581228
+ CP3 CA 1 0.346773417049 0.110698234855
+ CP3 CC 1 0.347450500075 0.110698234855
+ CP3 CD 1 0.347450500075 0.110698234855
+ CP3 CE1 1 0.355468588538 0.109105371453
+ CP3 CE2 1 0.354577689820 0.105847757841
+ CP3 CP1 1 0.338541512893 0.041840000000
+ CP3 CP2 1 0.338541512893 0.041840000000
+ CP3 CP3 1 0.338541512893 0.041840000000
+ CP3 CPH1 1 0.329632525712 0.093557084179
+ CP3 CPH2 1 0.329632525712 0.093557084179
+ CP3 CS 1 0.365268474438 0.138767581228
+ CP3 CPT 1 0.334977918021 0.131646486622
+ CP3 CY 1 0.346559601357 0.113045454929
+ CP3 CAI 1 0.346559601357 0.113045454929
+ CP3 CT 1 0.338541512893 0.041840000000
+ CP3 CT1 1 0.338541512893 0.041840000000
+ CP3 CT2 1 0.338541512893 0.041840000000
+ CP3 CT2A 1 0.338541512893 0.041840000000
+ CP3 CT3 1 0.338541512893 0.041840000000
+ CP3 H 1 0.189271432669 0.089736802707
+ CP3 HA 1 0.286869387241 0.062058748940
+ CP3 HB1 1 0.286869387241 0.062058748940
+ CP3 HB2 1 0.288651184677 0.070011711020
+ CP3 HE1 1 0.280633096214 0.073666921749
+ CP3 HE2 1 0.281523994932 0.067464972838
+ CP3 HC 1 0.189271432669 0.089736802707
+ CP3 HP 1 0.290272620344 0.072469005789
+ CP3 HR1 1 0.249451641079 0.089736802707
+ CP3 HR2 1 0.231633666716 0.089736802707
+ CP3 HR3 1 0.300054688270 0.036952087465
+ CP3 HS 1 0.209361198763 0.132309697301
+ CP3 HA1 1 0.288651184677 0.088756043175
+ CP3 HA2 1 0.288651184677 0.077149148019
+ CP3 HA3 1 0.288651184677 0.064818249282
+ CP3 N 1 0.334087019303 0.004184000000
+ CP3 NC2 1 0.334087019303 0.187114168357
+ CP3 NH1 1 0.307360057758 0.187114168357
+ CP3 NH2 1 0.334087019303 0.187114168357
+ CP3 NH3 1 0.334087019303 0.187114168357
+ CP3 NP 1 0.334087019303 0.187114168357
+ CP3 NR1 1 0.334087019303 0.187114168357
+ CP3 NR2 1 0.334087019303 0.187114168357
+ CP3 NR3 1 0.334087019303 0.187114168357
+ CP3 NY 1 0.334087019303 0.187114168357
+ CP3 O 1 0.293996576986 0.144938011577
+ CP3 OB 1 0.293996576986 0.144938011577
+ CP3 OC 1 0.320723538531 0.144938011577
+ CP3 OH1 1 0.326959829558 0.163176000000
+ CP3 OS 1 0.326959829558 0.163176000000
+ CP3 S 1 0.347450500075 0.280671252536
+ CP3 SM 1 0.345223253279 0.257919081884
+ CP3 SS 1 0.365268474438 0.286840588481
+ CP3 HT 1 0.189271432669 0.089736802707
+ CP3 OT 1 0.326799467788 0.163176000000
+ CP3 OX 1 0.320723538531 0.144938011577
+ CP3 HX 1 0.189271432669 0.089736802707
+ CP3 LIT 1 0.284864865125 0.020196198771
+ CP3 SOD 1 0.294954293108 0.090610410351
+ CP3 MG 1 0.274842254546 0.051243325419
+ CP3 POT 1 0.326403017859 0.123410269913
+ CP3 CAL 1 0.291056611216 0.144938011577
+ CP3 RUB 1 0.338541512893 0.162045623205
+ CP3 CES 1 0.356359487256 0.182376331798
+ CP3 BAR 1 0.337650614175 0.162045623205
+ CP3 ZN 1 0.266378716724 0.209200000000
+ CP3 CAD 1 0.290165712498 0.144938011577
+ CP3 CLA 1 0.371504765465 0.162045623205
+ CP3 HGA1 1 0.288651184677 0.088756043175
+ CP3 HGA2 1 0.288651184677 0.078275472531
+ CP3 HGA3 1 0.288651184677 0.064818249282
+ CP3 HGA4 1 0.280633096214 0.073666921749
+ CP3 HGA5 1 0.281523994932 0.067464972838
+ CP3 HGA6 1 0.286869387241 0.070011711020
+ CP3 HGA7 1 0.285087589805 0.072469005789
+ CP3 HGAAM0 1 0.283305792369 0.070011711020
+ CP3 HGAAM1 1 0.283305792369 0.070011711020
+ CP3 HGAAM2 1 0.281523994932 0.083680000000
+ CP3 HGP1 1 0.189271432669 0.089736802707
+ CP3 HGP2 1 0.189271432669 0.089736802707
+ CP3 HGP3 1 0.209361198763 0.132309697301
+ CP3 HGP4 1 0.189271432669 0.089736802707
+ CP3 HGP5 1 0.231633666716 0.089736802707
+ CP3 HGPAM1 1 0.247224394284 0.039692909190
+ CP3 HGPAM2 1 0.247224394284 0.041840000000
+ CP3 HGPAM3 1 0.246778944925 0.045833423612
+ CP3 HGR51 1 0.290272620344 0.072469005789
+ CP3 HGR52 1 0.249451641079 0.089736802707
+ CP3 HGR53 1 0.231633666716 0.089736802707
+ CP3 HGR61 1 0.290272620344 0.072469005789
+ CP3 HGR62 1 0.267269615442 0.089736802707
+ CP3 HGR63 1 0.249451641079 0.089736802707
+ CP3 HGR71 1 0.290272620344 0.072469005789
+ CP3 CG1T1 1 0.333196120584 0.170981810495
+ CP3 CG1T2 1 0.346782326036 0.134409982486
+ CP3 CG1N1 1 0.335868816739 0.177512086349
+ CP3 CG2D1 1 0.355468588538 0.109105371453
+ CP3 CG2D2 1 0.354577689820 0.105847757841
+ CP3 CG2D1O 1 0.355468588538 0.109105371453
+ CP3 CG2D2O 1 0.355468588538 0.109105371453
+ CP3 CG2DC1 1 0.355468588538 0.109105371453
+ CP3 CG2DC2 1 0.355468588538 0.109105371453
+ CP3 CG2DC3 1 0.354577689820 0.105847757841
+ CP3 CG25C1 1 0.355468588538 0.109105371453
+ CP3 CG25C2 1 0.355468588538 0.109105371453
+ CP3 CG251O 1 0.355468588538 0.109105371453
+ CP3 CG252O 1 0.355468588538 0.109105371453
+ CP3 CG2N1 1 0.347450500075 0.138767581228
+ CP3 CG2N2 1 0.347450500075 0.138767581228
+ CP3 CG2O1 1 0.347450500075 0.138767581228
+ CP3 CG2O2 1 0.320723538531 0.130979917850
+ CP3 CG2O3 1 0.347450500075 0.110698234855
+ CP3 CG2O4 1 0.329632525712 0.102486650838
+ CP3 CG2O5 1 0.347450500075 0.125520000000
+ CP3 CG2O6 1 0.347450500075 0.110698234855
+ CP3 CG2O7 1 0.308518226092 0.100764063435
+ CP3 CG2R51 1 0.356359487256 0.093557084179
+ CP3 CG2R52 1 0.365268474438 0.059170695450
+ CP3 CG2R53 1 0.365268474438 0.059170695450
+ CP3 CG2R57 1 0.356359487256 0.093557084179
+ CP3 CG2R61 1 0.346773417049 0.110698234855
+ CP3 CG2R62 1 0.338541512893 0.125520000000
+ CP3 CG2R63 1 0.338541512893 0.132309697301
+ CP3 CG2R64 1 0.356359487256 0.083680000000
+ CP3 CG2R66 1 0.338541512893 0.110698234855
+ CP3 CG2R67 1 0.346773417049 0.110698234855
+ CP3 CG2RC0 1 0.334977918021 0.131646486622
+ CP3 CG2R71 1 0.346987232741 0.108300154755
+ CP3 CG2RC7 1 0.334977918021 0.131646486622
+ CP3 CG301 1 0.338541512893 0.041840000000
+ CP3 CG302 1 0.374177461619 0.059170695450
+ CP3 CG311 1 0.338541512893 0.041840000000
+ CP3 CG312 1 0.351904993665 0.085746484010
+ CP3 CG314 1 0.338541512893 0.041840000000
+ CP3 CG321 1 0.338541512893 0.041840000000
+ CP3 CG322 1 0.338541512893 0.102486650838
+ CP3 CG323 1 0.365268474438 0.138767581228
+ CP3 CG324 1 0.338541512893 0.041840000000
+ CP3 CG331 1 0.338541512893 0.041840000000
+ CP3 CG334 1 0.338541512893 0.041840000000
+ CP3 CG3C50 1 0.338541512893 0.041840000000
+ CP3 CG3C51 1 0.338541512893 0.041840000000
+ CP3 CG3C52 1 0.338541512893 0.041840000000
+ CP3 CG3C53 1 0.338541512893 0.041840000000
+ CP3 CG3C54 1 0.338541512893 0.041840000000
+ CP3 CG3C31 1 0.338541512893 0.041840000000
+ CP3 CG3C41 1 0.338541512893 0.041840000000
+ CP3 CG3RC1 1 0.338541512893 0.041840000000
+ CP3 CG3AM0 1 0.344777803920 0.110698234855
+ CP3 CG3AM1 1 0.345668702638 0.116852760686
+ CP3 CG3AM2 1 0.346559601357 0.118341390899
+ CP3 NG1T1 1 0.328741626994 0.177512086349
+ CP3 NG2D1 1 0.334087019303 0.187114168357
+ CP3 NG2S0 1 0.334087019303 0.004184000000
+ CP3 NG2S1 1 0.307360057758 0.187114168357
+ CP3 NG2S2 1 0.334087019303 0.187114168357
+ CP3 NG2S3 1 0.334087019303 0.187114168357
+ CP3 NG2O1 1 0.334087019303 0.187114168357
+ CP3 NG2P1 1 0.334087019303 0.187114168357
+ CP3 NG2R43 1 0.334087019303 0.187114168357
+ CP3 NG2R50 1 0.334087019303 0.187114168357
+ CP3 NG2R51 1 0.334087019303 0.187114168357
+ CP3 NG2R52 1 0.334087019303 0.187114168357
+ CP3 NG2R53 1 0.334087019303 0.187114168357
+ CP3 NG2R57 1 0.334087019303 0.187114168357
+ CP3 NG2R60 1 0.337650614175 0.102486650838
+ CP3 NG2R61 1 0.334087019303 0.187114168357
+ CP3 NG2R62 1 0.352795892384 0.093557084179
+ CP3 NG2R67 1 0.334087019303 0.187114168357
+ CP3 NG2RC0 1 0.334087019303 0.187114168357
+ CP3 NG301 1 0.347450500075 0.078275472531
+ CP3 NG311 1 0.347450500075 0.088756043175
+ CP3 NG321 1 0.346559601357 0.102486650838
+ CP3 NG331 1 0.345668702638 0.110698234855
+ CP3 NG3C51 1 0.334087019303 0.187114168357
+ CP3 NG3N1 1 0.351904993665 0.102486650838
+ CP3 NG3P0 1 0.334087019303 0.187114168357
+ CP3 NG3P1 1 0.334087019303 0.187114168357
+ CP3 NG3P2 1 0.334087019303 0.187114168357
+ CP3 NG3P3 1 0.334087019303 0.187114168357
+ CP3 OG2D1 1 0.293996576986 0.144938011577
+ CP3 OG2D2 1 0.320723538531 0.144938011577
+ CP3 OG2D3 1 0.293996576986 0.144938011577
+ CP3 OG2D4 1 0.320723538531 0.144938011577
+ CP3 OG2D5 1 0.320010819556 0.169954883425
+ CP3 OG2N1 1 0.320723538531 0.144938011577
+ CP3 OG2P1 1 0.320723538531 0.144938011577
+ CP3 OG2R50 1 0.320723538531 0.144938011577
+ CP3 OG3R60 1 0.316269044940 0.132309697301
+ CP3 OG301 1 0.316269044940 0.132309697301
+ CP3 OG302 1 0.316269044940 0.132309697301
+ CP3 OG303 1 0.316269044940 0.132309697301
+ CP3 OG304 1 0.316269044940 0.132309697301
+ CP3 OG311 1 0.326514380198 0.183381431383
+ CP3 OG312 1 0.325178032121 0.144938011577
+ CP3 OG3C31 1 0.316269044940 0.132309697301
+ CP3 OG3C51 1 0.316269044940 0.132309697301
+ CP3 OG3C61 1 0.316269044940 0.132309697301
+ CP3 SG2D1 1 0.351904993665 0.314496560236
+ CP3 SG2R50 1 0.347450500075 0.280671252536
+ CP3 SG311 1 0.347450500075 0.280671252536
+ CP3 SG301 1 0.345223253279 0.257919081884
+ CP3 SG302 1 0.365268474438 0.286840588481
+ CP3 SG3O1 1 0.356359487256 0.286840588481
+ CP3 SG3O2 1 0.347450500075 0.247528778125
+ CP3 SG3O3 1 0.347450500075 0.247528778125
+ CP3 FGA1 1 0.314487247504 0.153729976257
+ CP3 FGA2 1 0.314487247504 0.135577095411
+ CP3 FGA3 1 0.311814551349 0.130309939452
+ CP3 FGP1 1 0.311814551349 0.130309939452
+ CP3 FGR1 1 0.320723538531 0.144938011577
+ CP3 CLGA1 1 0.339432411611 0.245040988571
+ CP3 CLGA3 1 0.339432411611 0.232955260941
+ CP3 CLGR1 1 0.341214209048 0.236682781799
+ CP3 BRGA1 1 0.344777803920 0.289876023155
+ CP3 BRGA2 1 0.351904993665 0.304599797767
+ CP3 BRGA3 1 0.347450500075 0.307459952514
+ CP3 BRGR1 1 0.353686791102 0.271154190821
+ CP3 IGR1 1 0.364377575719 0.310293744700
+ CP3 PG0 1 0.360813980847 0.320014464673
+ CP3 PG1 1 0.360813980847 0.320014464673
+ CP3 PG2 1 0.360813980847 0.320014464673
+ CP3 ALG1 1 0.347450500075 0.337324864189
+ CP3 CC301 1 0.338541512893 0.041840000000
+ CP3 CC3062 1 0.338541512893 0.041840000000
+ CP3 CC311 1 0.338541512893 0.041840000000
+ CP3 CC3161 1 0.338541512893 0.041840000000
+ CP3 CC3162 1 0.338541512893 0.041840000000
+ CP3 CC3163 1 0.338541512893 0.041840000000
+ CP3 CC321 1 0.338541512893 0.041840000000
+ CP3 CC3261 1 0.338541512893 0.041840000000
+ CP3 CC3263 1 0.338541512893 0.041840000000
+ CP3 CC331 1 0.338541512893 0.041840000000
+ CP3 CC2O1 1 0.347450500075 0.138767581228
+ CP3 CC2O2 1 0.347450500075 0.110698234855
+ CP3 CC2O3 1 0.347450500075 0.125520000000
+ CP3 CC2O4 1 0.329632525712 0.102486650838
+ CP3 OC2D1 1 0.293996576986 0.144938011577
+ CP3 OC2D2 1 0.320723538531 0.144938011577
+ CP3 OC2D3 1 0.293996576986 0.144938011577
+ CP3 OC2D4 1 0.293996576986 0.144938011577
+ CP3 OC3C61 1 0.316269044940 0.132309697301
+ CP3 OC311 1 0.326514380198 0.183381431383
+ CP3 NC2D1 1 0.307360057758 0.187114168357
+ CP3 HCP1 1 0.189271432669 0.089736802707
+ CP3 HCA1 1 0.288651184677 0.088756043175
+ CP3 HCA2 1 0.288651184677 0.078275472531
+ CP3 HCA3 1 0.288651184677 0.064818249282
+ CP3 CC312 1 0.338541512893 0.041840000000
+ CP3 CC322 1 0.338541512893 0.041840000000
+ CP3 HCR1 1 0.240542653898 0.089736802707
+ CP3 HCA3M 1 0.288651184677 0.064818249282
+ CP3 CC321C 1 0.338541512893 0.041840000000
+ CP3 CC321D 1 0.338541512893 0.041840000000
+ CP3 CC311C 1 0.338541512893 0.041840000000
+ CP3 CC311D 1 0.338541512893 0.041840000000
+ CP3 OC301 1 0.316269044940 0.132309697301
+ CP3 OC302 1 0.316269044940 0.132309697301
+ CP3 HCP1M 1 0.189271432669 0.089736802707
+ CP3 OC311M 1 0.326514380198 0.183381431383
+ CP3 OC3C5M 1 0.316269044940 0.132309697301
+ CP3 CC322C 1 0.338541512893 0.041840000000
+ CP3 HCA2C2 1 0.285087589805 0.078275472531
+ CP3 CC312C 1 0.338541512893 0.041840000000
+ CP3 HCA1C2 1 0.288651184677 0.088756043175
+ CP3 OC3C51 1 0.316269044940 0.132309697301
+ CP3 CC3152 1 0.338541512893 0.041840000000
+ CP3 CC3051 1 0.338541512893 0.041840000000
+ CP3 CC3251 1 0.338541512893 0.041840000000
+ CP3 CC3151 1 0.338541512893 0.041840000000
+ CP3 CC3153 1 0.338541512893 0.041840000000
+ CP3 OC2DP 1 0.320723538531 0.144938011577
+ CP3 OC312 1 0.326959829558 0.163176000000
+ CP3 OC30P 1 0.326959829558 0.163176000000
+ CP3 PC 1 0.360813980847 0.320014464673
+ CP3 SC 1 0.356359487256 0.286840588481
+ CP3 CC312D 1 0.338541512893 0.041840000000
+ CP3 OC303 1 0.316269044940 0.132309697301
+ CP3 HN1 1 0.189271432669 0.089736802707
+ CP3 HN2 1 0.189271432669 0.089736802707
+ CP3 HN3 1 0.267269615442 0.089736802707
+ CP3 HN4 1 0.189271432669 0.089736802707
+ CP3 HN5 1 0.189271432669 0.089736802707
+ CP3 HN6 1 0.286869387241 0.062058748940
+ CP3 HN7 1 0.286869387241 0.062058748940
+ CP3 HN8 1 0.288651184677 0.070011711020
+ CP3 HN9 1 0.288651184677 0.064818249282
+ CP3 NN1 1 0.334087019303 0.187114168357
+ CP3 NN2 1 0.334087019303 0.187114168357
+ CP3 NN2B 1 0.334087019303 0.187114168357
+ CP3 NN2G 1 0.334087019303 0.187114168357
+ CP3 NN2U 1 0.334087019303 0.187114168357
+ CP3 NN3 1 0.334087019303 0.187114168357
+ CP3 NN3A 1 0.334087019303 0.187114168357
+ CP3 NN3G 1 0.334087019303 0.187114168357
+ CP3 NN4 1 0.334087019303 0.187114168357
+ CP3 NN6 1 0.334087019303 0.187114168357
+ CP3 ON1 1 0.320723538531 0.144938011577
+ CP3 ON1C 1 0.320723538531 0.144938011577
+ CP3 ON2 1 0.326959829558 0.163176000000
+ CP3 ON3 1 0.320723538531 0.144938011577
+ CP3 ON4 1 0.326959829558 0.163176000000
+ CP3 ON5 1 0.326959829558 0.163176000000
+ CP3 ON6 1 0.326959829558 0.163176000000
+ CP3 ON6B 1 0.326959829558 0.163176000000
+ CP3 CN1 1 0.338541512893 0.132309697301
+ CP3 CN1T 1 0.338541512893 0.132309697301
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+ CP3 CN3 1 0.338541512893 0.125520000000
+ CP3 CN3T 1 0.338541512893 0.125520000000
+ CP3 CN4 1 0.338541512893 0.114583559030
+ CP3 CN5 1 0.338541512893 0.114583559030
+ CP3 CN5G 1 0.338541512893 0.114583559030
+ CP3 CN7 1 0.338541512893 0.041840000000
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+ CP3 CN8 1 0.338541512893 0.041840000000
+ CP3 CN8B 1 0.338541512893 0.041840000000
+ CP3 CN9 1 0.338541512893 0.041840000000
+ CP3 P 1 0.360813980847 0.320014464673
+ CP3 P2 1 0.360813980847 0.320014464673
+ CP3 HOL 1 0.189271432669 0.089736802707
+ CP3 HAL1 1 0.286869387241 0.062058748940
+ CP3 HAL2 1 0.288651184677 0.070011711020
+ CP3 HAL3 1 0.288651184677 0.064818249282
+ CP3 HBL 1 0.286869387241 0.062058748940
+ CP3 HCL 1 0.189271432669 0.089736802707
+ CP3 HL 1 0.231633666716 0.089736802707
+ CP3 HEL1 1 0.280633096214 0.073666921749
+ CP3 HEL2 1 0.281523994932 0.067464972838
+ CP3 CL 1 0.347450500075 0.110698234855
+ CP3 CCL 1 0.347450500075 0.110698234855
+ CP3 CTL1 1 0.338541512893 0.041840000000
+ CP3 CTL2 1 0.338541512893 0.041840000000
+ CP3 CTL3 1 0.338541512893 0.041840000000
+ CP3 CTL5 1 0.338541512893 0.041840000000
+ CP3 CEL1 1 0.355468588538 0.109105371453
+ CP3 CEL2 1 0.354577689820 0.105847757841
+ CP3 CRL1 1 0.338541512893 0.041840000000
+ CP3 CRL2 1 0.338541512893 0.041840000000
+ CP3 OBL 1 0.293996576986 0.144938011577
+ CP3 OCL 1 0.320723538531 0.144938011577
+ CP3 O2L 1 0.320723538531 0.144938011577
+ CP3 OHL 1 0.326959829558 0.163176000000
+ CP3 OSL 1 0.316269044940 0.132309697301
+ CP3 OSLP 1 0.316269044940 0.132309697301
+ CP3 NH3L 1 0.334087019303 0.187114168357
+ CP3 NTL 1 0.334087019303 0.187114168357
+ CP3 SL 1 0.356359487256 0.286840588481
+ CP3 PL 1 0.360813980847 0.320014464673
+ CP3 HCA1A 1 0.288651184677 0.088756043175
+ CP3 HCA2A 1 0.288651184677 0.078275472531
+ CP3 HCA3A 1 0.288651184677 0.064818249282
+ CP3 CC30A 1 0.338541512893 0.041840000000
+ CP3 CC31A 1 0.338541512893 0.041840000000
+ CP3 CC32A 1 0.338541512893 0.041840000000
+ CP3 CC33A 1 0.338541512893 0.041840000000
+ CP3 CC326A 1 0.338541512893 0.041840000000
+ CP3 HCA25A 1 0.285087589805 0.078275472531
+ CP3 CC325A 1 0.338541512893 0.041840000000
+ CP3 CC325B 1 0.338541512893 0.041840000000
+ CP3 OC305A 1 0.316269044940 0.132309697301
+ CP3 OC30A 1 0.316269044940 0.132309697301
+ CP3 CPA 1 0.329632525712 0.125520000000
+ CP3 CPB 1 0.329632525712 0.125520000000
+ CP3 CPM 1 0.329632525712 0.125520000000
+ CP3 CM 1 0.356359487256 0.138767581228
+ CP3 CST 1 0.308518226092 0.100764063435
+ CP3 NPH 1 0.334087019303 0.187114168357
+ CP3 OM 1 0.320723538531 0.144938011577
+ CP3 OST 1 0.320010819556 0.169954883425
+ CP3 FE 1 0.227179173126 0.000000000000
+ CP3 ON2B 1 0.326959829558 0.163176000000
+ CP3 SP 1 0.365268474438 0.280671252536
+ CT C 1 0.347450500075 0.138767581228
+ CT CA 1 0.346773417049 0.110698234855
+ CT CC 1 0.347450500075 0.110698234855
+ CT CD 1 0.347450500075 0.110698234855
+ CT CE1 1 0.355468588538 0.109105371453
+ CT CE2 1 0.354577689820 0.105847757841
+ CT CP1 1 0.338541512893 0.041840000000
+ CT CP2 1 0.338541512893 0.041840000000
+ CT CP3 1 0.338541512893 0.041840000000
+ CT CPH1 1 0.329632525712 0.093557084179
+ CT CPH2 1 0.329632525712 0.093557084179
+ CT CS 1 0.365268474438 0.138767581228
+ CT CPT 1 0.334977918021 0.131646486622
+ CT CY 1 0.346559601357 0.113045454929
+ CT CAI 1 0.346559601357 0.113045454929
+ CT CT 1 0.338541512893 0.041840000000
+ CT CT1 1 0.338541512893 0.041840000000
+ CT CT2 1 0.338541512893 0.041840000000
+ CT CT2A 1 0.338541512893 0.041840000000
+ CT CT3 1 0.338541512893 0.041840000000
+ CT H 1 0.189271432669 0.089736802707
+ CT HA 1 0.286869387241 0.062058748940
+ CT HB1 1 0.286869387241 0.062058748940
+ CT HB2 1 0.288651184677 0.070011711020
+ CT HE1 1 0.280633096214 0.073666921749
+ CT HE2 1 0.281523994932 0.067464972838
+ CT HC 1 0.189271432669 0.089736802707
+ CT HP 1 0.290272620344 0.072469005789
+ CT HR1 1 0.249451641079 0.089736802707
+ CT HR2 1 0.231633666716 0.089736802707
+ CT HR3 1 0.300054688270 0.036952087465
+ CT HS 1 0.209361198763 0.132309697301
+ CT HA1 1 0.288651184677 0.088756043175
+ CT HA2 1 0.288651184677 0.077149148019
+ CT HA3 1 0.288651184677 0.064818249282
+ CT N 1 0.334087019303 0.004184000000
+ CT NC2 1 0.334087019303 0.187114168357
+ CT NH1 1 0.307360057758 0.187114168357
+ CT NH2 1 0.334087019303 0.187114168357
+ CT NH3 1 0.334087019303 0.187114168357
+ CT NP 1 0.334087019303 0.187114168357
+ CT NR1 1 0.334087019303 0.187114168357
+ CT NR2 1 0.334087019303 0.187114168357
+ CT NR3 1 0.334087019303 0.187114168357
+ CT NY 1 0.334087019303 0.187114168357
+ CT O 1 0.293996576986 0.144938011577
+ CT OB 1 0.293996576986 0.144938011577
+ CT OC 1 0.320723538531 0.144938011577
+ CT OH1 1 0.326959829558 0.163176000000
+ CT OS 1 0.326959829558 0.163176000000
+ CT S 1 0.347450500075 0.280671252536
+ CT SM 1 0.345223253279 0.257919081884
+ CT SS 1 0.365268474438 0.286840588481
+ CT HT 1 0.189271432669 0.089736802707
+ CT OT 1 0.326799467788 0.163176000000
+ CT OX 1 0.320723538531 0.144938011577
+ CT HX 1 0.189271432669 0.089736802707
+ CT LIT 1 0.284864865125 0.020196198771
+ CT SOD 1 0.294954293108 0.090610410351
+ CT MG 1 0.274842254546 0.051243325419
+ CT POT 1 0.326403017859 0.123410269913
+ CT CAL 1 0.291056611216 0.144938011577
+ CT RUB 1 0.338541512893 0.162045623205
+ CT CES 1 0.356359487256 0.182376331798
+ CT BAR 1 0.337650614175 0.162045623205
+ CT ZN 1 0.266378716724 0.209200000000
+ CT CAD 1 0.290165712498 0.144938011577
+ CT CLA 1 0.371504765465 0.162045623205
+ CT HGA1 1 0.288651184677 0.088756043175
+ CT HGA2 1 0.288651184677 0.078275472531
+ CT HGA3 1 0.288651184677 0.064818249282
+ CT HGA4 1 0.280633096214 0.073666921749
+ CT HGA5 1 0.281523994932 0.067464972838
+ CT HGA6 1 0.286869387241 0.070011711020
+ CT HGA7 1 0.285087589805 0.072469005789
+ CT HGAAM0 1 0.283305792369 0.070011711020
+ CT HGAAM1 1 0.283305792369 0.070011711020
+ CT HGAAM2 1 0.281523994932 0.083680000000
+ CT HGP1 1 0.189271432669 0.089736802707
+ CT HGP2 1 0.189271432669 0.089736802707
+ CT HGP3 1 0.209361198763 0.132309697301
+ CT HGP4 1 0.189271432669 0.089736802707
+ CT HGP5 1 0.231633666716 0.089736802707
+ CT HGPAM1 1 0.247224394284 0.039692909190
+ CT HGPAM2 1 0.247224394284 0.041840000000
+ CT HGPAM3 1 0.246778944925 0.045833423612
+ CT HGR51 1 0.290272620344 0.072469005789
+ CT HGR52 1 0.249451641079 0.089736802707
+ CT HGR53 1 0.231633666716 0.089736802707
+ CT HGR61 1 0.290272620344 0.072469005789
+ CT HGR62 1 0.267269615442 0.089736802707
+ CT HGR63 1 0.249451641079 0.089736802707
+ CT HGR71 1 0.290272620344 0.072469005789
+ CT CG1T1 1 0.333196120584 0.170981810495
+ CT CG1T2 1 0.346782326036 0.134409982486
+ CT CG1N1 1 0.335868816739 0.177512086349
+ CT CG2D1 1 0.355468588538 0.109105371453
+ CT CG2D2 1 0.354577689820 0.105847757841
+ CT CG2D1O 1 0.355468588538 0.109105371453
+ CT CG2D2O 1 0.355468588538 0.109105371453
+ CT CG2DC1 1 0.355468588538 0.109105371453
+ CT CG2DC2 1 0.355468588538 0.109105371453
+ CT CG2DC3 1 0.354577689820 0.105847757841
+ CT CG25C1 1 0.355468588538 0.109105371453
+ CT CG25C2 1 0.355468588538 0.109105371453
+ CT CG251O 1 0.355468588538 0.109105371453
+ CT CG252O 1 0.355468588538 0.109105371453
+ CT CG2N1 1 0.347450500075 0.138767581228
+ CT CG2N2 1 0.347450500075 0.138767581228
+ CT CG2O1 1 0.347450500075 0.138767581228
+ CT CG2O2 1 0.320723538531 0.130979917850
+ CT CG2O3 1 0.347450500075 0.110698234855
+ CT CG2O4 1 0.329632525712 0.102486650838
+ CT CG2O5 1 0.347450500075 0.125520000000
+ CT CG2O6 1 0.347450500075 0.110698234855
+ CT CG2O7 1 0.308518226092 0.100764063435
+ CT CG2R51 1 0.356359487256 0.093557084179
+ CT CG2R52 1 0.365268474438 0.059170695450
+ CT CG2R53 1 0.365268474438 0.059170695450
+ CT CG2R57 1 0.356359487256 0.093557084179
+ CT CG2R61 1 0.346773417049 0.110698234855
+ CT CG2R62 1 0.338541512893 0.125520000000
+ CT CG2R63 1 0.338541512893 0.132309697301
+ CT CG2R64 1 0.356359487256 0.083680000000
+ CT CG2R66 1 0.338541512893 0.110698234855
+ CT CG2R67 1 0.346773417049 0.110698234855
+ CT CG2RC0 1 0.334977918021 0.131646486622
+ CT CG2R71 1 0.346987232741 0.108300154755
+ CT CG2RC7 1 0.334977918021 0.131646486622
+ CT CG301 1 0.338541512893 0.041840000000
+ CT CG302 1 0.374177461619 0.059170695450
+ CT CG311 1 0.338541512893 0.041840000000
+ CT CG312 1 0.351904993665 0.085746484010
+ CT CG314 1 0.338541512893 0.041840000000
+ CT CG321 1 0.338541512893 0.041840000000
+ CT CG322 1 0.338541512893 0.102486650838
+ CT CG323 1 0.365268474438 0.138767581228
+ CT CG324 1 0.338541512893 0.041840000000
+ CT CG331 1 0.338541512893 0.041840000000
+ CT CG334 1 0.338541512893 0.041840000000
+ CT CG3C50 1 0.338541512893 0.041840000000
+ CT CG3C51 1 0.338541512893 0.041840000000
+ CT CG3C52 1 0.338541512893 0.041840000000
+ CT CG3C53 1 0.338541512893 0.041840000000
+ CT CG3C54 1 0.338541512893 0.041840000000
+ CT CG3C31 1 0.338541512893 0.041840000000
+ CT CG3C41 1 0.338541512893 0.041840000000
+ CT CG3RC1 1 0.338541512893 0.041840000000
+ CT CG3AM0 1 0.344777803920 0.110698234855
+ CT CG3AM1 1 0.345668702638 0.116852760686
+ CT CG3AM2 1 0.346559601357 0.118341390899
+ CT NG1T1 1 0.328741626994 0.177512086349
+ CT NG2D1 1 0.334087019303 0.187114168357
+ CT NG2S0 1 0.334087019303 0.004184000000
+ CT NG2S1 1 0.307360057758 0.187114168357
+ CT NG2S2 1 0.334087019303 0.187114168357
+ CT NG2S3 1 0.334087019303 0.187114168357
+ CT NG2O1 1 0.334087019303 0.187114168357
+ CT NG2P1 1 0.334087019303 0.187114168357
+ CT NG2R43 1 0.334087019303 0.187114168357
+ CT NG2R50 1 0.334087019303 0.187114168357
+ CT NG2R51 1 0.334087019303 0.187114168357
+ CT NG2R52 1 0.334087019303 0.187114168357
+ CT NG2R53 1 0.334087019303 0.187114168357
+ CT NG2R57 1 0.334087019303 0.187114168357
+ CT NG2R60 1 0.337650614175 0.102486650838
+ CT NG2R61 1 0.334087019303 0.187114168357
+ CT NG2R62 1 0.352795892384 0.093557084179
+ CT NG2R67 1 0.334087019303 0.187114168357
+ CT NG2RC0 1 0.334087019303 0.187114168357
+ CT NG301 1 0.347450500075 0.078275472531
+ CT NG311 1 0.347450500075 0.088756043175
+ CT NG321 1 0.346559601357 0.102486650838
+ CT NG331 1 0.345668702638 0.110698234855
+ CT NG3C51 1 0.334087019303 0.187114168357
+ CT NG3N1 1 0.351904993665 0.102486650838
+ CT NG3P0 1 0.334087019303 0.187114168357
+ CT NG3P1 1 0.334087019303 0.187114168357
+ CT NG3P2 1 0.334087019303 0.187114168357
+ CT NG3P3 1 0.334087019303 0.187114168357
+ CT OG2D1 1 0.293996576986 0.144938011577
+ CT OG2D2 1 0.320723538531 0.144938011577
+ CT OG2D3 1 0.293996576986 0.144938011577
+ CT OG2D4 1 0.320723538531 0.144938011577
+ CT OG2D5 1 0.320010819556 0.169954883425
+ CT OG2N1 1 0.320723538531 0.144938011577
+ CT OG2P1 1 0.320723538531 0.144938011577
+ CT OG2R50 1 0.320723538531 0.144938011577
+ CT OG3R60 1 0.316269044940 0.132309697301
+ CT OG301 1 0.316269044940 0.132309697301
+ CT OG302 1 0.316269044940 0.132309697301
+ CT OG303 1 0.316269044940 0.132309697301
+ CT OG304 1 0.316269044940 0.132309697301
+ CT OG311 1 0.326514380198 0.183381431383
+ CT OG312 1 0.325178032121 0.144938011577
+ CT OG3C31 1 0.316269044940 0.132309697301
+ CT OG3C51 1 0.316269044940 0.132309697301
+ CT OG3C61 1 0.316269044940 0.132309697301
+ CT SG2D1 1 0.351904993665 0.314496560236
+ CT SG2R50 1 0.347450500075 0.280671252536
+ CT SG311 1 0.347450500075 0.280671252536
+ CT SG301 1 0.345223253279 0.257919081884
+ CT SG302 1 0.365268474438 0.286840588481
+ CT SG3O1 1 0.356359487256 0.286840588481
+ CT SG3O2 1 0.347450500075 0.247528778125
+ CT SG3O3 1 0.347450500075 0.247528778125
+ CT FGA1 1 0.314487247504 0.153729976257
+ CT FGA2 1 0.314487247504 0.135577095411
+ CT FGA3 1 0.311814551349 0.130309939452
+ CT FGP1 1 0.311814551349 0.130309939452
+ CT FGR1 1 0.320723538531 0.144938011577
+ CT CLGA1 1 0.339432411611 0.245040988571
+ CT CLGA3 1 0.339432411611 0.232955260941
+ CT CLGR1 1 0.341214209048 0.236682781799
+ CT BRGA1 1 0.344777803920 0.289876023155
+ CT BRGA2 1 0.351904993665 0.304599797767
+ CT BRGA3 1 0.347450500075 0.307459952514
+ CT BRGR1 1 0.353686791102 0.271154190821
+ CT IGR1 1 0.364377575719 0.310293744700
+ CT PG0 1 0.360813980847 0.320014464673
+ CT PG1 1 0.360813980847 0.320014464673
+ CT PG2 1 0.360813980847 0.320014464673
+ CT ALG1 1 0.347450500075 0.337324864189
+ CT CC301 1 0.338541512893 0.041840000000
+ CT CC3062 1 0.338541512893 0.041840000000
+ CT CC311 1 0.338541512893 0.041840000000
+ CT CC3161 1 0.338541512893 0.041840000000
+ CT CC3162 1 0.338541512893 0.041840000000
+ CT CC3163 1 0.338541512893 0.041840000000
+ CT CC321 1 0.338541512893 0.041840000000
+ CT CC3261 1 0.338541512893 0.041840000000
+ CT CC3263 1 0.338541512893 0.041840000000
+ CT CC331 1 0.338541512893 0.041840000000
+ CT CC2O1 1 0.347450500075 0.138767581228
+ CT CC2O2 1 0.347450500075 0.110698234855
+ CT CC2O3 1 0.347450500075 0.125520000000
+ CT CC2O4 1 0.329632525712 0.102486650838
+ CT OC2D1 1 0.293996576986 0.144938011577
+ CT OC2D2 1 0.320723538531 0.144938011577
+ CT OC2D3 1 0.293996576986 0.144938011577
+ CT OC2D4 1 0.293996576986 0.144938011577
+ CT OC3C61 1 0.316269044940 0.132309697301
+ CT OC311 1 0.326514380198 0.183381431383
+ CT NC2D1 1 0.307360057758 0.187114168357
+ CT HCP1 1 0.189271432669 0.089736802707
+ CT HCA1 1 0.288651184677 0.088756043175
+ CT HCA2 1 0.288651184677 0.078275472531
+ CT HCA3 1 0.288651184677 0.064818249282
+ CT CC312 1 0.338541512893 0.041840000000
+ CT CC322 1 0.338541512893 0.041840000000
+ CT HCR1 1 0.240542653898 0.089736802707
+ CT HCA3M 1 0.288651184677 0.064818249282
+ CT CC321C 1 0.338541512893 0.041840000000
+ CT CC321D 1 0.338541512893 0.041840000000
+ CT CC311C 1 0.338541512893 0.041840000000
+ CT CC311D 1 0.338541512893 0.041840000000
+ CT OC301 1 0.316269044940 0.132309697301
+ CT OC302 1 0.316269044940 0.132309697301
+ CT HCP1M 1 0.189271432669 0.089736802707
+ CT OC311M 1 0.326514380198 0.183381431383
+ CT OC3C5M 1 0.316269044940 0.132309697301
+ CT CC322C 1 0.338541512893 0.041840000000
+ CT HCA2C2 1 0.285087589805 0.078275472531
+ CT CC312C 1 0.338541512893 0.041840000000
+ CT HCA1C2 1 0.288651184677 0.088756043175
+ CT OC3C51 1 0.316269044940 0.132309697301
+ CT CC3152 1 0.338541512893 0.041840000000
+ CT CC3051 1 0.338541512893 0.041840000000
+ CT CC3251 1 0.338541512893 0.041840000000
+ CT CC3151 1 0.338541512893 0.041840000000
+ CT CC3153 1 0.338541512893 0.041840000000
+ CT OC2DP 1 0.320723538531 0.144938011577
+ CT OC312 1 0.326959829558 0.163176000000
+ CT OC30P 1 0.326959829558 0.163176000000
+ CT PC 1 0.360813980847 0.320014464673
+ CT SC 1 0.356359487256 0.286840588481
+ CT CC312D 1 0.338541512893 0.041840000000
+ CT OC303 1 0.316269044940 0.132309697301
+ CT HN1 1 0.189271432669 0.089736802707
+ CT HN2 1 0.189271432669 0.089736802707
+ CT HN3 1 0.267269615442 0.089736802707
+ CT HN4 1 0.189271432669 0.089736802707
+ CT HN5 1 0.189271432669 0.089736802707
+ CT HN6 1 0.286869387241 0.062058748940
+ CT HN7 1 0.286869387241 0.062058748940
+ CT HN8 1 0.288651184677 0.070011711020
+ CT HN9 1 0.288651184677 0.064818249282
+ CT NN1 1 0.334087019303 0.187114168357
+ CT NN2 1 0.334087019303 0.187114168357
+ CT NN2B 1 0.334087019303 0.187114168357
+ CT NN2G 1 0.334087019303 0.187114168357
+ CT NN2U 1 0.334087019303 0.187114168357
+ CT NN3 1 0.334087019303 0.187114168357
+ CT NN3A 1 0.334087019303 0.187114168357
+ CT NN3G 1 0.334087019303 0.187114168357
+ CT NN4 1 0.334087019303 0.187114168357
+ CT NN6 1 0.334087019303 0.187114168357
+ CT ON1 1 0.320723538531 0.144938011577
+ CT ON1C 1 0.320723538531 0.144938011577
+ CT ON2 1 0.326959829558 0.163176000000
+ CT ON3 1 0.320723538531 0.144938011577
+ CT ON4 1 0.326959829558 0.163176000000
+ CT ON5 1 0.326959829558 0.163176000000
+ CT ON6 1 0.326959829558 0.163176000000
+ CT ON6B 1 0.326959829558 0.163176000000
+ CT CN1 1 0.338541512893 0.132309697301
+ CT CN1T 1 0.338541512893 0.132309697301
+ CT CN2 1 0.338541512893 0.132309697301
+ CT CN3 1 0.338541512893 0.125520000000
+ CT CN3T 1 0.338541512893 0.125520000000
+ CT CN4 1 0.338541512893 0.114583559030
+ CT CN5 1 0.338541512893 0.114583559030
+ CT CN5G 1 0.338541512893 0.114583559030
+ CT CN7 1 0.338541512893 0.041840000000
+ CT CN7B 1 0.338541512893 0.041840000000
+ CT CN8 1 0.338541512893 0.041840000000
+ CT CN8B 1 0.338541512893 0.041840000000
+ CT CN9 1 0.338541512893 0.041840000000
+ CT P 1 0.360813980847 0.320014464673
+ CT P2 1 0.360813980847 0.320014464673
+ CT HOL 1 0.189271432669 0.089736802707
+ CT HAL1 1 0.286869387241 0.062058748940
+ CT HAL2 1 0.288651184677 0.070011711020
+ CT HAL3 1 0.288651184677 0.064818249282
+ CT HBL 1 0.286869387241 0.062058748940
+ CT HCL 1 0.189271432669 0.089736802707
+ CT HL 1 0.231633666716 0.089736802707
+ CT HEL1 1 0.280633096214 0.073666921749
+ CT HEL2 1 0.281523994932 0.067464972838
+ CT CL 1 0.347450500075 0.110698234855
+ CT CCL 1 0.347450500075 0.110698234855
+ CT CTL1 1 0.338541512893 0.041840000000
+ CT CTL2 1 0.338541512893 0.041840000000
+ CT CTL3 1 0.338541512893 0.041840000000
+ CT CTL5 1 0.338541512893 0.041840000000
+ CT CEL1 1 0.355468588538 0.109105371453
+ CT CEL2 1 0.354577689820 0.105847757841
+ CT CRL1 1 0.338541512893 0.041840000000
+ CT CRL2 1 0.338541512893 0.041840000000
+ CT OBL 1 0.293996576986 0.144938011577
+ CT OCL 1 0.320723538531 0.144938011577
+ CT O2L 1 0.320723538531 0.144938011577
+ CT OHL 1 0.326959829558 0.163176000000
+ CT OSL 1 0.316269044940 0.132309697301
+ CT OSLP 1 0.316269044940 0.132309697301
+ CT NH3L 1 0.334087019303 0.187114168357
+ CT NTL 1 0.334087019303 0.187114168357
+ CT SL 1 0.356359487256 0.286840588481
+ CT PL 1 0.360813980847 0.320014464673
+ CT HCA1A 1 0.288651184677 0.088756043175
+ CT HCA2A 1 0.288651184677 0.078275472531
+ CT HCA3A 1 0.288651184677 0.064818249282
+ CT CC30A 1 0.338541512893 0.041840000000
+ CT CC31A 1 0.338541512893 0.041840000000
+ CT CC32A 1 0.338541512893 0.041840000000
+ CT CC33A 1 0.338541512893 0.041840000000
+ CT CC326A 1 0.338541512893 0.041840000000
+ CT HCA25A 1 0.285087589805 0.078275472531
+ CT CC325A 1 0.338541512893 0.041840000000
+ CT CC325B 1 0.338541512893 0.041840000000
+ CT OC305A 1 0.316269044940 0.132309697301
+ CT OC30A 1 0.316269044940 0.132309697301
+ CT CPA 1 0.329632525712 0.125520000000
+ CT CPB 1 0.329632525712 0.125520000000
+ CT CPM 1 0.329632525712 0.125520000000
+ CT CM 1 0.356359487256 0.138767581228
+ CT CST 1 0.308518226092 0.100764063435
+ CT NPH 1 0.334087019303 0.187114168357
+ CT OM 1 0.320723538531 0.144938011577
+ CT OST 1 0.320010819556 0.169954883425
+ CT FE 1 0.227179173126 0.000000000000
+ CT ON2B 1 0.326959829558 0.163176000000
+ CT SP 1 0.365268474438 0.280671252536
+ CT1 C 1 0.347450500075 0.138767581228
+ CT1 CA 1 0.346773417049 0.110698234855
+ CT1 CC 1 0.347450500075 0.110698234855
+ CT1 CD 1 0.347450500075 0.110698234855
+ CT1 CE1 1 0.355468588538 0.109105371453
+ CT1 CE2 1 0.354577689820 0.105847757841
+ CT1 CP1 1 0.338541512893 0.041840000000
+ CT1 CP2 1 0.338541512893 0.041840000000
+ CT1 CP3 1 0.338541512893 0.041840000000
+ CT1 CPH1 1 0.329632525712 0.093557084179
+ CT1 CPH2 1 0.329632525712 0.093557084179
+ CT1 CS 1 0.365268474438 0.138767581228
+ CT1 CPT 1 0.334977918021 0.131646486622
+ CT1 CY 1 0.346559601357 0.113045454929
+ CT1 CAI 1 0.346559601357 0.113045454929
+ CT1 CT 1 0.338541512893 0.041840000000
+ CT1 CT1 1 0.338541512893 0.041840000000
+ CT1 CT2 1 0.338541512893 0.041840000000
+ CT1 CT2A 1 0.338541512893 0.041840000000
+ CT1 CT3 1 0.338541512893 0.041840000000
+ CT1 H 1 0.189271432669 0.089736802707
+ CT1 HA 1 0.286869387241 0.062058748940
+ CT1 HB1 1 0.286869387241 0.062058748940
+ CT1 HB2 1 0.288651184677 0.070011711020
+ CT1 HE1 1 0.280633096214 0.073666921749
+ CT1 HE2 1 0.281523994932 0.067464972838
+ CT1 HC 1 0.189271432669 0.089736802707
+ CT1 HP 1 0.290272620344 0.072469005789
+ CT1 HR1 1 0.249451641079 0.089736802707
+ CT1 HR2 1 0.231633666716 0.089736802707
+ CT1 HR3 1 0.300054688270 0.036952087465
+ CT1 HS 1 0.209361198763 0.132309697301
+ CT1 HA1 1 0.288651184677 0.088756043175
+ CT1 HA2 1 0.288651184677 0.077149148019
+ CT1 HA3 1 0.288651184677 0.064818249282
+ CT1 N 1 0.334087019303 0.004184000000
+ CT1 NC2 1 0.334087019303 0.187114168357
+ CT1 NH1 1 0.307360057758 0.187114168357
+ CT1 NH2 1 0.334087019303 0.187114168357
+ CT1 NH3 1 0.334087019303 0.187114168357
+ CT1 NP 1 0.334087019303 0.187114168357
+ CT1 NR1 1 0.334087019303 0.187114168357
+ CT1 NR2 1 0.334087019303 0.187114168357
+ CT1 NR3 1 0.334087019303 0.187114168357
+ CT1 NY 1 0.334087019303 0.187114168357
+ CT1 O 1 0.293996576986 0.144938011577
+ CT1 OB 1 0.293996576986 0.144938011577
+ CT1 OC 1 0.320723538531 0.144938011577
+ CT1 OH1 1 0.326959829558 0.163176000000
+ CT1 OS 1 0.326959829558 0.163176000000
+ CT1 S 1 0.347450500075 0.280671252536
+ CT1 SM 1 0.345223253279 0.257919081884
+ CT1 SS 1 0.365268474438 0.286840588481
+ CT1 HT 1 0.189271432669 0.089736802707
+ CT1 OT 1 0.326799467788 0.163176000000
+ CT1 OX 1 0.320723538531 0.144938011577
+ CT1 HX 1 0.189271432669 0.089736802707
+ CT1 LIT 1 0.284864865125 0.020196198771
+ CT1 SOD 1 0.294954293108 0.090610410351
+ CT1 MG 1 0.274842254546 0.051243325419
+ CT1 POT 1 0.326403017859 0.123410269913
+ CT1 CAL 1 0.291056611216 0.144938011577
+ CT1 RUB 1 0.338541512893 0.162045623205
+ CT1 CES 1 0.356359487256 0.182376331798
+ CT1 BAR 1 0.337650614175 0.162045623205
+ CT1 ZN 1 0.266378716724 0.209200000000
+ CT1 CAD 1 0.290165712498 0.144938011577
+ CT1 CLA 1 0.371504765465 0.162045623205
+ CT1 HGA1 1 0.288651184677 0.088756043175
+ CT1 HGA2 1 0.288651184677 0.078275472531
+ CT1 HGA3 1 0.288651184677 0.064818249282
+ CT1 HGA4 1 0.280633096214 0.073666921749
+ CT1 HGA5 1 0.281523994932 0.067464972838
+ CT1 HGA6 1 0.286869387241 0.070011711020
+ CT1 HGA7 1 0.285087589805 0.072469005789
+ CT1 HGAAM0 1 0.283305792369 0.070011711020
+ CT1 HGAAM1 1 0.283305792369 0.070011711020
+ CT1 HGAAM2 1 0.281523994932 0.083680000000
+ CT1 HGP1 1 0.189271432669 0.089736802707
+ CT1 HGP2 1 0.189271432669 0.089736802707
+ CT1 HGP3 1 0.209361198763 0.132309697301
+ CT1 HGP4 1 0.189271432669 0.089736802707
+ CT1 HGP5 1 0.231633666716 0.089736802707
+ CT1 HGPAM1 1 0.247224394284 0.039692909190
+ CT1 HGPAM2 1 0.247224394284 0.041840000000
+ CT1 HGPAM3 1 0.246778944925 0.045833423612
+ CT1 HGR51 1 0.290272620344 0.072469005789
+ CT1 HGR52 1 0.249451641079 0.089736802707
+ CT1 HGR53 1 0.231633666716 0.089736802707
+ CT1 HGR61 1 0.290272620344 0.072469005789
+ CT1 HGR62 1 0.267269615442 0.089736802707
+ CT1 HGR63 1 0.249451641079 0.089736802707
+ CT1 HGR71 1 0.290272620344 0.072469005789
+ CT1 CG1T1 1 0.333196120584 0.170981810495
+ CT1 CG1T2 1 0.346782326036 0.134409982486
+ CT1 CG1N1 1 0.335868816739 0.177512086349
+ CT1 CG2D1 1 0.355468588538 0.109105371453
+ CT1 CG2D2 1 0.354577689820 0.105847757841
+ CT1 CG2D1O 1 0.355468588538 0.109105371453
+ CT1 CG2D2O 1 0.355468588538 0.109105371453
+ CT1 CG2DC1 1 0.355468588538 0.109105371453
+ CT1 CG2DC2 1 0.355468588538 0.109105371453
+ CT1 CG2DC3 1 0.354577689820 0.105847757841
+ CT1 CG25C1 1 0.355468588538 0.109105371453
+ CT1 CG25C2 1 0.355468588538 0.109105371453
+ CT1 CG251O 1 0.355468588538 0.109105371453
+ CT1 CG252O 1 0.355468588538 0.109105371453
+ CT1 CG2N1 1 0.347450500075 0.138767581228
+ CT1 CG2N2 1 0.347450500075 0.138767581228
+ CT1 CG2O1 1 0.347450500075 0.138767581228
+ CT1 CG2O2 1 0.320723538531 0.130979917850
+ CT1 CG2O3 1 0.347450500075 0.110698234855
+ CT1 CG2O4 1 0.329632525712 0.102486650838
+ CT1 CG2O5 1 0.347450500075 0.125520000000
+ CT1 CG2O6 1 0.347450500075 0.110698234855
+ CT1 CG2O7 1 0.308518226092 0.100764063435
+ CT1 CG2R51 1 0.356359487256 0.093557084179
+ CT1 CG2R52 1 0.365268474438 0.059170695450
+ CT1 CG2R53 1 0.365268474438 0.059170695450
+ CT1 CG2R57 1 0.356359487256 0.093557084179
+ CT1 CG2R61 1 0.346773417049 0.110698234855
+ CT1 CG2R62 1 0.338541512893 0.125520000000
+ CT1 CG2R63 1 0.338541512893 0.132309697301
+ CT1 CG2R64 1 0.356359487256 0.083680000000
+ CT1 CG2R66 1 0.338541512893 0.110698234855
+ CT1 CG2R67 1 0.346773417049 0.110698234855
+ CT1 CG2RC0 1 0.334977918021 0.131646486622
+ CT1 CG2R71 1 0.346987232741 0.108300154755
+ CT1 CG2RC7 1 0.334977918021 0.131646486622
+ CT1 CG301 1 0.338541512893 0.041840000000
+ CT1 CG302 1 0.374177461619 0.059170695450
+ CT1 CG311 1 0.338541512893 0.041840000000
+ CT1 CG312 1 0.351904993665 0.085746484010
+ CT1 CG314 1 0.338541512893 0.041840000000
+ CT1 CG321 1 0.338541512893 0.041840000000
+ CT1 CG322 1 0.338541512893 0.102486650838
+ CT1 CG323 1 0.365268474438 0.138767581228
+ CT1 CG324 1 0.338541512893 0.041840000000
+ CT1 CG331 1 0.338541512893 0.041840000000
+ CT1 CG334 1 0.338541512893 0.041840000000
+ CT1 CG3C50 1 0.338541512893 0.041840000000
+ CT1 CG3C51 1 0.338541512893 0.041840000000
+ CT1 CG3C52 1 0.338541512893 0.041840000000
+ CT1 CG3C53 1 0.338541512893 0.041840000000
+ CT1 CG3C54 1 0.338541512893 0.041840000000
+ CT1 CG3C31 1 0.338541512893 0.041840000000
+ CT1 CG3C41 1 0.338541512893 0.041840000000
+ CT1 CG3RC1 1 0.338541512893 0.041840000000
+ CT1 CG3AM0 1 0.344777803920 0.110698234855
+ CT1 CG3AM1 1 0.345668702638 0.116852760686
+ CT1 CG3AM2 1 0.346559601357 0.118341390899
+ CT1 NG1T1 1 0.328741626994 0.177512086349
+ CT1 NG2D1 1 0.334087019303 0.187114168357
+ CT1 NG2S0 1 0.334087019303 0.004184000000
+ CT1 NG2S1 1 0.307360057758 0.187114168357
+ CT1 NG2S2 1 0.334087019303 0.187114168357
+ CT1 NG2S3 1 0.334087019303 0.187114168357
+ CT1 NG2O1 1 0.334087019303 0.187114168357
+ CT1 NG2P1 1 0.334087019303 0.187114168357
+ CT1 NG2R43 1 0.334087019303 0.187114168357
+ CT1 NG2R50 1 0.334087019303 0.187114168357
+ CT1 NG2R51 1 0.334087019303 0.187114168357
+ CT1 NG2R52 1 0.334087019303 0.187114168357
+ CT1 NG2R53 1 0.334087019303 0.187114168357
+ CT1 NG2R57 1 0.334087019303 0.187114168357
+ CT1 NG2R60 1 0.337650614175 0.102486650838
+ CT1 NG2R61 1 0.334087019303 0.187114168357
+ CT1 NG2R62 1 0.352795892384 0.093557084179
+ CT1 NG2R67 1 0.334087019303 0.187114168357
+ CT1 NG2RC0 1 0.334087019303 0.187114168357
+ CT1 NG301 1 0.347450500075 0.078275472531
+ CT1 NG311 1 0.347450500075 0.088756043175
+ CT1 NG321 1 0.346559601357 0.102486650838
+ CT1 NG331 1 0.345668702638 0.110698234855
+ CT1 NG3C51 1 0.334087019303 0.187114168357
+ CT1 NG3N1 1 0.351904993665 0.102486650838
+ CT1 NG3P0 1 0.334087019303 0.187114168357
+ CT1 NG3P1 1 0.334087019303 0.187114168357
+ CT1 NG3P2 1 0.334087019303 0.187114168357
+ CT1 NG3P3 1 0.334087019303 0.187114168357
+ CT1 OG2D1 1 0.293996576986 0.144938011577
+ CT1 OG2D2 1 0.320723538531 0.144938011577
+ CT1 OG2D3 1 0.293996576986 0.144938011577
+ CT1 OG2D4 1 0.320723538531 0.144938011577
+ CT1 OG2D5 1 0.320010819556 0.169954883425
+ CT1 OG2N1 1 0.320723538531 0.144938011577
+ CT1 OG2P1 1 0.320723538531 0.144938011577
+ CT1 OG2R50 1 0.320723538531 0.144938011577
+ CT1 OG3R60 1 0.316269044940 0.132309697301
+ CT1 OG301 1 0.316269044940 0.132309697301
+ CT1 OG302 1 0.316269044940 0.132309697301
+ CT1 OG303 1 0.316269044940 0.132309697301
+ CT1 OG304 1 0.316269044940 0.132309697301
+ CT1 OG311 1 0.326514380198 0.183381431383
+ CT1 OG312 1 0.325178032121 0.144938011577
+ CT1 OG3C31 1 0.316269044940 0.132309697301
+ CT1 OG3C51 1 0.316269044940 0.132309697301
+ CT1 OG3C61 1 0.316269044940 0.132309697301
+ CT1 SG2D1 1 0.351904993665 0.314496560236
+ CT1 SG2R50 1 0.347450500075 0.280671252536
+ CT1 SG311 1 0.347450500075 0.280671252536
+ CT1 SG301 1 0.345223253279 0.257919081884
+ CT1 SG302 1 0.365268474438 0.286840588481
+ CT1 SG3O1 1 0.356359487256 0.286840588481
+ CT1 SG3O2 1 0.347450500075 0.247528778125
+ CT1 SG3O3 1 0.347450500075 0.247528778125
+ CT1 FGA1 1 0.314487247504 0.153729976257
+ CT1 FGA2 1 0.314487247504 0.135577095411
+ CT1 FGA3 1 0.311814551349 0.130309939452
+ CT1 FGP1 1 0.311814551349 0.130309939452
+ CT1 FGR1 1 0.320723538531 0.144938011577
+ CT1 CLGA1 1 0.339432411611 0.245040988571
+ CT1 CLGA3 1 0.339432411611 0.232955260941
+ CT1 CLGR1 1 0.341214209048 0.236682781799
+ CT1 BRGA1 1 0.344777803920 0.289876023155
+ CT1 BRGA2 1 0.351904993665 0.304599797767
+ CT1 BRGA3 1 0.347450500075 0.307459952514
+ CT1 BRGR1 1 0.353686791102 0.271154190821
+ CT1 IGR1 1 0.364377575719 0.310293744700
+ CT1 PG0 1 0.360813980847 0.320014464673
+ CT1 PG1 1 0.360813980847 0.320014464673
+ CT1 PG2 1 0.360813980847 0.320014464673
+ CT1 ALG1 1 0.347450500075 0.337324864189
+ CT1 CC301 1 0.338541512893 0.041840000000
+ CT1 CC3062 1 0.338541512893 0.041840000000
+ CT1 CC311 1 0.338541512893 0.041840000000
+ CT1 CC3161 1 0.338541512893 0.041840000000
+ CT1 CC3162 1 0.338541512893 0.041840000000
+ CT1 CC3163 1 0.338541512893 0.041840000000
+ CT1 CC321 1 0.338541512893 0.041840000000
+ CT1 CC3261 1 0.338541512893 0.041840000000
+ CT1 CC3263 1 0.338541512893 0.041840000000
+ CT1 CC331 1 0.338541512893 0.041840000000
+ CT1 CC2O1 1 0.347450500075 0.138767581228
+ CT1 CC2O2 1 0.347450500075 0.110698234855
+ CT1 CC2O3 1 0.347450500075 0.125520000000
+ CT1 CC2O4 1 0.329632525712 0.102486650838
+ CT1 OC2D1 1 0.293996576986 0.144938011577
+ CT1 OC2D2 1 0.320723538531 0.144938011577
+ CT1 OC2D3 1 0.293996576986 0.144938011577
+ CT1 OC2D4 1 0.293996576986 0.144938011577
+ CT1 OC3C61 1 0.316269044940 0.132309697301
+ CT1 OC311 1 0.326514380198 0.183381431383
+ CT1 NC2D1 1 0.307360057758 0.187114168357
+ CT1 HCP1 1 0.189271432669 0.089736802707
+ CT1 HCA1 1 0.288651184677 0.088756043175
+ CT1 HCA2 1 0.288651184677 0.078275472531
+ CT1 HCA3 1 0.288651184677 0.064818249282
+ CT1 CC312 1 0.338541512893 0.041840000000
+ CT1 CC322 1 0.338541512893 0.041840000000
+ CT1 HCR1 1 0.240542653898 0.089736802707
+ CT1 HCA3M 1 0.288651184677 0.064818249282
+ CT1 CC321C 1 0.338541512893 0.041840000000
+ CT1 CC321D 1 0.338541512893 0.041840000000
+ CT1 CC311C 1 0.338541512893 0.041840000000
+ CT1 CC311D 1 0.338541512893 0.041840000000
+ CT1 OC301 1 0.316269044940 0.132309697301
+ CT1 OC302 1 0.316269044940 0.132309697301
+ CT1 HCP1M 1 0.189271432669 0.089736802707
+ CT1 OC311M 1 0.326514380198 0.183381431383
+ CT1 OC3C5M 1 0.316269044940 0.132309697301
+ CT1 CC322C 1 0.338541512893 0.041840000000
+ CT1 HCA2C2 1 0.285087589805 0.078275472531
+ CT1 CC312C 1 0.338541512893 0.041840000000
+ CT1 HCA1C2 1 0.288651184677 0.088756043175
+ CT1 OC3C51 1 0.316269044940 0.132309697301
+ CT1 CC3152 1 0.338541512893 0.041840000000
+ CT1 CC3051 1 0.338541512893 0.041840000000
+ CT1 CC3251 1 0.338541512893 0.041840000000
+ CT1 CC3151 1 0.338541512893 0.041840000000
+ CT1 CC3153 1 0.338541512893 0.041840000000
+ CT1 OC2DP 1 0.320723538531 0.144938011577
+ CT1 OC312 1 0.326959829558 0.163176000000
+ CT1 OC30P 1 0.326959829558 0.163176000000
+ CT1 PC 1 0.360813980847 0.320014464673
+ CT1 SC 1 0.356359487256 0.286840588481
+ CT1 CC312D 1 0.338541512893 0.041840000000
+ CT1 OC303 1 0.316269044940 0.132309697301
+ CT1 HN1 1 0.189271432669 0.089736802707
+ CT1 HN2 1 0.189271432669 0.089736802707
+ CT1 HN3 1 0.267269615442 0.089736802707
+ CT1 HN4 1 0.189271432669 0.089736802707
+ CT1 HN5 1 0.189271432669 0.089736802707
+ CT1 HN6 1 0.286869387241 0.062058748940
+ CT1 HN7 1 0.286869387241 0.062058748940
+ CT1 HN8 1 0.288651184677 0.070011711020
+ CT1 HN9 1 0.288651184677 0.064818249282
+ CT1 NN1 1 0.334087019303 0.187114168357
+ CT1 NN2 1 0.334087019303 0.187114168357
+ CT1 NN2B 1 0.334087019303 0.187114168357
+ CT1 NN2G 1 0.334087019303 0.187114168357
+ CT1 NN2U 1 0.334087019303 0.187114168357
+ CT1 NN3 1 0.334087019303 0.187114168357
+ CT1 NN3A 1 0.334087019303 0.187114168357
+ CT1 NN3G 1 0.334087019303 0.187114168357
+ CT1 NN4 1 0.334087019303 0.187114168357
+ CT1 NN6 1 0.334087019303 0.187114168357
+ CT1 ON1 1 0.320723538531 0.144938011577
+ CT1 ON1C 1 0.320723538531 0.144938011577
+ CT1 ON2 1 0.326959829558 0.163176000000
+ CT1 ON3 1 0.320723538531 0.144938011577
+ CT1 ON4 1 0.326959829558 0.163176000000
+ CT1 ON5 1 0.326959829558 0.163176000000
+ CT1 ON6 1 0.326959829558 0.163176000000
+ CT1 ON6B 1 0.326959829558 0.163176000000
+ CT1 CN1 1 0.338541512893 0.132309697301
+ CT1 CN1T 1 0.338541512893 0.132309697301
+ CT1 CN2 1 0.338541512893 0.132309697301
+ CT1 CN3 1 0.338541512893 0.125520000000
+ CT1 CN3T 1 0.338541512893 0.125520000000
+ CT1 CN4 1 0.338541512893 0.114583559030
+ CT1 CN5 1 0.338541512893 0.114583559030
+ CT1 CN5G 1 0.338541512893 0.114583559030
+ CT1 CN7 1 0.338541512893 0.041840000000
+ CT1 CN7B 1 0.338541512893 0.041840000000
+ CT1 CN8 1 0.338541512893 0.041840000000
+ CT1 CN8B 1 0.338541512893 0.041840000000
+ CT1 CN9 1 0.338541512893 0.041840000000
+ CT1 P 1 0.360813980847 0.320014464673
+ CT1 P2 1 0.360813980847 0.320014464673
+ CT1 HOL 1 0.189271432669 0.089736802707
+ CT1 HAL1 1 0.286869387241 0.062058748940
+ CT1 HAL2 1 0.288651184677 0.070011711020
+ CT1 HAL3 1 0.288651184677 0.064818249282
+ CT1 HBL 1 0.286869387241 0.062058748940
+ CT1 HCL 1 0.189271432669 0.089736802707
+ CT1 HL 1 0.231633666716 0.089736802707
+ CT1 HEL1 1 0.280633096214 0.073666921749
+ CT1 HEL2 1 0.281523994932 0.067464972838
+ CT1 CL 1 0.347450500075 0.110698234855
+ CT1 CCL 1 0.347450500075 0.110698234855
+ CT1 CTL1 1 0.338541512893 0.041840000000
+ CT1 CTL2 1 0.338541512893 0.041840000000
+ CT1 CTL3 1 0.338541512893 0.041840000000
+ CT1 CTL5 1 0.338541512893 0.041840000000
+ CT1 CEL1 1 0.355468588538 0.109105371453
+ CT1 CEL2 1 0.354577689820 0.105847757841
+ CT1 CRL1 1 0.338541512893 0.041840000000
+ CT1 CRL2 1 0.338541512893 0.041840000000
+ CT1 OBL 1 0.293996576986 0.144938011577
+ CT1 OCL 1 0.320723538531 0.144938011577
+ CT1 O2L 1 0.320723538531 0.144938011577
+ CT1 OHL 1 0.326959829558 0.163176000000
+ CT1 OSL 1 0.316269044940 0.132309697301
+ CT1 OSLP 1 0.316269044940 0.132309697301
+ CT1 NH3L 1 0.334087019303 0.187114168357
+ CT1 NTL 1 0.334087019303 0.187114168357
+ CT1 SL 1 0.356359487256 0.286840588481
+ CT1 PL 1 0.360813980847 0.320014464673
+ CT1 HCA1A 1 0.288651184677 0.088756043175
+ CT1 HCA2A 1 0.288651184677 0.078275472531
+ CT1 HCA3A 1 0.288651184677 0.064818249282
+ CT1 CC30A 1 0.338541512893 0.041840000000
+ CT1 CC31A 1 0.338541512893 0.041840000000
+ CT1 CC32A 1 0.338541512893 0.041840000000
+ CT1 CC33A 1 0.338541512893 0.041840000000
+ CT1 CC326A 1 0.338541512893 0.041840000000
+ CT1 HCA25A 1 0.285087589805 0.078275472531
+ CT1 CC325A 1 0.338541512893 0.041840000000
+ CT1 CC325B 1 0.338541512893 0.041840000000
+ CT1 OC305A 1 0.316269044940 0.132309697301
+ CT1 OC30A 1 0.316269044940 0.132309697301
+ CT1 CPA 1 0.329632525712 0.125520000000
+ CT1 CPB 1 0.329632525712 0.125520000000
+ CT1 CPM 1 0.329632525712 0.125520000000
+ CT1 CM 1 0.356359487256 0.138767581228
+ CT1 CST 1 0.308518226092 0.100764063435
+ CT1 NPH 1 0.334087019303 0.187114168357
+ CT1 OM 1 0.320723538531 0.144938011577
+ CT1 OST 1 0.320010819556 0.169954883425
+ CT1 FE 1 0.227179173126 0.000000000000
+ CT1 ON2B 1 0.326959829558 0.163176000000
+ CT1 SP 1 0.365268474438 0.280671252536
+ CT2 C 1 0.347450500075 0.138767581228
+ CT2 CA 1 0.346773417049 0.110698234855
+ CT2 CC 1 0.347450500075 0.110698234855
+ CT2 CD 1 0.347450500075 0.110698234855
+ CT2 CE1 1 0.355468588538 0.109105371453
+ CT2 CE2 1 0.354577689820 0.105847757841
+ CT2 CP1 1 0.338541512893 0.041840000000
+ CT2 CP2 1 0.338541512893 0.041840000000
+ CT2 CP3 1 0.338541512893 0.041840000000
+ CT2 CPH1 1 0.329632525712 0.093557084179
+ CT2 CPH2 1 0.329632525712 0.093557084179
+ CT2 CS 1 0.365268474438 0.138767581228
+ CT2 CPT 1 0.334977918021 0.131646486622
+ CT2 CY 1 0.346559601357 0.113045454929
+ CT2 CAI 1 0.346559601357 0.113045454929
+ CT2 CT 1 0.338541512893 0.041840000000
+ CT2 CT1 1 0.338541512893 0.041840000000
+ CT2 CT2 1 0.338541512893 0.041840000000
+ CT2 CT2A 1 0.338541512893 0.041840000000
+ CT2 CT3 1 0.338541512893 0.041840000000
+ CT2 H 1 0.189271432669 0.089736802707
+ CT2 HA 1 0.286869387241 0.062058748940
+ CT2 HB1 1 0.286869387241 0.062058748940
+ CT2 HB2 1 0.288651184677 0.070011711020
+ CT2 HE1 1 0.280633096214 0.073666921749
+ CT2 HE2 1 0.281523994932 0.067464972838
+ CT2 HC 1 0.189271432669 0.089736802707
+ CT2 HP 1 0.290272620344 0.072469005789
+ CT2 HR1 1 0.249451641079 0.089736802707
+ CT2 HR2 1 0.231633666716 0.089736802707
+ CT2 HR3 1 0.300054688270 0.036952087465
+ CT2 HS 1 0.209361198763 0.132309697301
+ CT2 HA1 1 0.288651184677 0.088756043175
+ CT2 HA2 1 0.288651184677 0.077149148019
+ CT2 HA3 1 0.288651184677 0.064818249282
+ CT2 N 1 0.334087019303 0.004184000000
+ CT2 NC2 1 0.334087019303 0.187114168357
+ CT2 NH1 1 0.307360057758 0.187114168357
+ CT2 NH2 1 0.334087019303 0.187114168357
+ CT2 NH3 1 0.334087019303 0.187114168357
+ CT2 NP 1 0.334087019303 0.187114168357
+ CT2 NR1 1 0.334087019303 0.187114168357
+ CT2 NR2 1 0.334087019303 0.187114168357
+ CT2 NR3 1 0.334087019303 0.187114168357
+ CT2 NY 1 0.334087019303 0.187114168357
+ CT2 O 1 0.293996576986 0.144938011577
+ CT2 OB 1 0.293996576986 0.144938011577
+ CT2 OC 1 0.320723538531 0.144938011577
+ CT2 OH1 1 0.326959829558 0.163176000000
+ CT2 OS 1 0.326959829558 0.163176000000
+ CT2 S 1 0.347450500075 0.280671252536
+ CT2 SM 1 0.345223253279 0.257919081884
+ CT2 SS 1 0.365268474438 0.286840588481
+ CT2 HT 1 0.189271432669 0.089736802707
+ CT2 OT 1 0.326799467788 0.163176000000
+ CT2 OX 1 0.320723538531 0.144938011577
+ CT2 HX 1 0.189271432669 0.089736802707
+ CT2 LIT 1 0.284864865125 0.020196198771
+ CT2 SOD 1 0.294954293108 0.090610410351
+ CT2 MG 1 0.274842254546 0.051243325419
+ CT2 POT 1 0.326403017859 0.123410269913
+ CT2 CAL 1 0.291056611216 0.144938011577
+ CT2 RUB 1 0.338541512893 0.162045623205
+ CT2 CES 1 0.356359487256 0.182376331798
+ CT2 BAR 1 0.337650614175 0.162045623205
+ CT2 ZN 1 0.266378716724 0.209200000000
+ CT2 CAD 1 0.290165712498 0.144938011577
+ CT2 CLA 1 0.371504765465 0.162045623205
+ CT2 HGA1 1 0.288651184677 0.088756043175
+ CT2 HGA2 1 0.288651184677 0.078275472531
+ CT2 HGA3 1 0.288651184677 0.064818249282
+ CT2 HGA4 1 0.280633096214 0.073666921749
+ CT2 HGA5 1 0.281523994932 0.067464972838
+ CT2 HGA6 1 0.286869387241 0.070011711020
+ CT2 HGA7 1 0.285087589805 0.072469005789
+ CT2 HGAAM0 1 0.283305792369 0.070011711020
+ CT2 HGAAM1 1 0.283305792369 0.070011711020
+ CT2 HGAAM2 1 0.281523994932 0.083680000000
+ CT2 HGP1 1 0.189271432669 0.089736802707
+ CT2 HGP2 1 0.189271432669 0.089736802707
+ CT2 HGP3 1 0.209361198763 0.132309697301
+ CT2 HGP4 1 0.189271432669 0.089736802707
+ CT2 HGP5 1 0.231633666716 0.089736802707
+ CT2 HGPAM1 1 0.247224394284 0.039692909190
+ CT2 HGPAM2 1 0.247224394284 0.041840000000
+ CT2 HGPAM3 1 0.246778944925 0.045833423612
+ CT2 HGR51 1 0.290272620344 0.072469005789
+ CT2 HGR52 1 0.249451641079 0.089736802707
+ CT2 HGR53 1 0.231633666716 0.089736802707
+ CT2 HGR61 1 0.290272620344 0.072469005789
+ CT2 HGR62 1 0.267269615442 0.089736802707
+ CT2 HGR63 1 0.249451641079 0.089736802707
+ CT2 HGR71 1 0.290272620344 0.072469005789
+ CT2 CG1T1 1 0.333196120584 0.170981810495
+ CT2 CG1T2 1 0.346782326036 0.134409982486
+ CT2 CG1N1 1 0.335868816739 0.177512086349
+ CT2 CG2D1 1 0.355468588538 0.109105371453
+ CT2 CG2D2 1 0.354577689820 0.105847757841
+ CT2 CG2D1O 1 0.355468588538 0.109105371453
+ CT2 CG2D2O 1 0.355468588538 0.109105371453
+ CT2 CG2DC1 1 0.355468588538 0.109105371453
+ CT2 CG2DC2 1 0.355468588538 0.109105371453
+ CT2 CG2DC3 1 0.354577689820 0.105847757841
+ CT2 CG25C1 1 0.355468588538 0.109105371453
+ CT2 CG25C2 1 0.355468588538 0.109105371453
+ CT2 CG251O 1 0.355468588538 0.109105371453
+ CT2 CG252O 1 0.355468588538 0.109105371453
+ CT2 CG2N1 1 0.347450500075 0.138767581228
+ CT2 CG2N2 1 0.347450500075 0.138767581228
+ CT2 CG2O1 1 0.347450500075 0.138767581228
+ CT2 CG2O2 1 0.320723538531 0.130979917850
+ CT2 CG2O3 1 0.347450500075 0.110698234855
+ CT2 CG2O4 1 0.329632525712 0.102486650838
+ CT2 CG2O5 1 0.347450500075 0.125520000000
+ CT2 CG2O6 1 0.347450500075 0.110698234855
+ CT2 CG2O7 1 0.308518226092 0.100764063435
+ CT2 CG2R51 1 0.356359487256 0.093557084179
+ CT2 CG2R52 1 0.365268474438 0.059170695450
+ CT2 CG2R53 1 0.365268474438 0.059170695450
+ CT2 CG2R57 1 0.356359487256 0.093557084179
+ CT2 CG2R61 1 0.346773417049 0.110698234855
+ CT2 CG2R62 1 0.338541512893 0.125520000000
+ CT2 CG2R63 1 0.338541512893 0.132309697301
+ CT2 CG2R64 1 0.356359487256 0.083680000000
+ CT2 CG2R66 1 0.338541512893 0.110698234855
+ CT2 CG2R67 1 0.346773417049 0.110698234855
+ CT2 CG2RC0 1 0.334977918021 0.131646486622
+ CT2 CG2R71 1 0.346987232741 0.108300154755
+ CT2 CG2RC7 1 0.334977918021 0.131646486622
+ CT2 CG301 1 0.338541512893 0.041840000000
+ CT2 CG302 1 0.374177461619 0.059170695450
+ CT2 CG311 1 0.338541512893 0.041840000000
+ CT2 CG312 1 0.351904993665 0.085746484010
+ CT2 CG314 1 0.338541512893 0.041840000000
+ CT2 CG321 1 0.338541512893 0.041840000000
+ CT2 CG322 1 0.338541512893 0.102486650838
+ CT2 CG323 1 0.365268474438 0.138767581228
+ CT2 CG324 1 0.338541512893 0.041840000000
+ CT2 CG331 1 0.338541512893 0.041840000000
+ CT2 CG334 1 0.338541512893 0.041840000000
+ CT2 CG3C50 1 0.338541512893 0.041840000000
+ CT2 CG3C51 1 0.338541512893 0.041840000000
+ CT2 CG3C52 1 0.338541512893 0.041840000000
+ CT2 CG3C53 1 0.338541512893 0.041840000000
+ CT2 CG3C54 1 0.338541512893 0.041840000000
+ CT2 CG3C31 1 0.338541512893 0.041840000000
+ CT2 CG3C41 1 0.338541512893 0.041840000000
+ CT2 CG3RC1 1 0.338541512893 0.041840000000
+ CT2 CG3AM0 1 0.344777803920 0.110698234855
+ CT2 CG3AM1 1 0.345668702638 0.116852760686
+ CT2 CG3AM2 1 0.346559601357 0.118341390899
+ CT2 NG1T1 1 0.328741626994 0.177512086349
+ CT2 NG2D1 1 0.334087019303 0.187114168357
+ CT2 NG2S0 1 0.334087019303 0.004184000000
+ CT2 NG2S1 1 0.307360057758 0.187114168357
+ CT2 NG2S2 1 0.334087019303 0.187114168357
+ CT2 NG2S3 1 0.334087019303 0.187114168357
+ CT2 NG2O1 1 0.334087019303 0.187114168357
+ CT2 NG2P1 1 0.334087019303 0.187114168357
+ CT2 NG2R43 1 0.334087019303 0.187114168357
+ CT2 NG2R50 1 0.334087019303 0.187114168357
+ CT2 NG2R51 1 0.334087019303 0.187114168357
+ CT2 NG2R52 1 0.334087019303 0.187114168357
+ CT2 NG2R53 1 0.334087019303 0.187114168357
+ CT2 NG2R57 1 0.334087019303 0.187114168357
+ CT2 NG2R60 1 0.337650614175 0.102486650838
+ CT2 NG2R61 1 0.334087019303 0.187114168357
+ CT2 NG2R62 1 0.352795892384 0.093557084179
+ CT2 NG2R67 1 0.334087019303 0.187114168357
+ CT2 NG2RC0 1 0.334087019303 0.187114168357
+ CT2 NG301 1 0.347450500075 0.078275472531
+ CT2 NG311 1 0.347450500075 0.088756043175
+ CT2 NG321 1 0.346559601357 0.102486650838
+ CT2 NG331 1 0.345668702638 0.110698234855
+ CT2 NG3C51 1 0.334087019303 0.187114168357
+ CT2 NG3N1 1 0.351904993665 0.102486650838
+ CT2 NG3P0 1 0.334087019303 0.187114168357
+ CT2 NG3P1 1 0.334087019303 0.187114168357
+ CT2 NG3P2 1 0.334087019303 0.187114168357
+ CT2 NG3P3 1 0.334087019303 0.187114168357
+ CT2 OG2D1 1 0.293996576986 0.144938011577
+ CT2 OG2D2 1 0.320723538531 0.144938011577
+ CT2 OG2D3 1 0.293996576986 0.144938011577
+ CT2 OG2D4 1 0.320723538531 0.144938011577
+ CT2 OG2D5 1 0.320010819556 0.169954883425
+ CT2 OG2N1 1 0.320723538531 0.144938011577
+ CT2 OG2P1 1 0.320723538531 0.144938011577
+ CT2 OG2R50 1 0.320723538531 0.144938011577
+ CT2 OG3R60 1 0.316269044940 0.132309697301
+ CT2 OG301 1 0.316269044940 0.132309697301
+ CT2 OG302 1 0.316269044940 0.132309697301
+ CT2 OG303 1 0.316269044940 0.132309697301
+ CT2 OG304 1 0.316269044940 0.132309697301
+ CT2 OG311 1 0.326514380198 0.183381431383
+ CT2 OG312 1 0.325178032121 0.144938011577
+ CT2 OG3C31 1 0.316269044940 0.132309697301
+ CT2 OG3C51 1 0.316269044940 0.132309697301
+ CT2 OG3C61 1 0.316269044940 0.132309697301
+ CT2 SG2D1 1 0.351904993665 0.314496560236
+ CT2 SG2R50 1 0.347450500075 0.280671252536
+ CT2 SG311 1 0.347450500075 0.280671252536
+ CT2 SG301 1 0.345223253279 0.257919081884
+ CT2 SG302 1 0.365268474438 0.286840588481
+ CT2 SG3O1 1 0.356359487256 0.286840588481
+ CT2 SG3O2 1 0.347450500075 0.247528778125
+ CT2 SG3O3 1 0.347450500075 0.247528778125
+ CT2 FGA1 1 0.314487247504 0.153729976257
+ CT2 FGA2 1 0.314487247504 0.135577095411
+ CT2 FGA3 1 0.311814551349 0.130309939452
+ CT2 FGP1 1 0.311814551349 0.130309939452
+ CT2 FGR1 1 0.320723538531 0.144938011577
+ CT2 CLGA1 1 0.339432411611 0.245040988571
+ CT2 CLGA3 1 0.339432411611 0.232955260941
+ CT2 CLGR1 1 0.341214209048 0.236682781799
+ CT2 BRGA1 1 0.344777803920 0.289876023155
+ CT2 BRGA2 1 0.351904993665 0.304599797767
+ CT2 BRGA3 1 0.347450500075 0.307459952514
+ CT2 BRGR1 1 0.353686791102 0.271154190821
+ CT2 IGR1 1 0.364377575719 0.310293744700
+ CT2 PG0 1 0.360813980847 0.320014464673
+ CT2 PG1 1 0.360813980847 0.320014464673
+ CT2 PG2 1 0.360813980847 0.320014464673
+ CT2 ALG1 1 0.347450500075 0.337324864189
+ CT2 CC301 1 0.338541512893 0.041840000000
+ CT2 CC3062 1 0.338541512893 0.041840000000
+ CT2 CC311 1 0.338541512893 0.041840000000
+ CT2 CC3161 1 0.338541512893 0.041840000000
+ CT2 CC3162 1 0.338541512893 0.041840000000
+ CT2 CC3163 1 0.338541512893 0.041840000000
+ CT2 CC321 1 0.338541512893 0.041840000000
+ CT2 CC3261 1 0.338541512893 0.041840000000
+ CT2 CC3263 1 0.338541512893 0.041840000000
+ CT2 CC331 1 0.338541512893 0.041840000000
+ CT2 CC2O1 1 0.347450500075 0.138767581228
+ CT2 CC2O2 1 0.347450500075 0.110698234855
+ CT2 CC2O3 1 0.347450500075 0.125520000000
+ CT2 CC2O4 1 0.329632525712 0.102486650838
+ CT2 OC2D1 1 0.293996576986 0.144938011577
+ CT2 OC2D2 1 0.320723538531 0.144938011577
+ CT2 OC2D3 1 0.293996576986 0.144938011577
+ CT2 OC2D4 1 0.293996576986 0.144938011577
+ CT2 OC3C61 1 0.316269044940 0.132309697301
+ CT2 OC311 1 0.326514380198 0.183381431383
+ CT2 NC2D1 1 0.307360057758 0.187114168357
+ CT2 HCP1 1 0.189271432669 0.089736802707
+ CT2 HCA1 1 0.288651184677 0.088756043175
+ CT2 HCA2 1 0.288651184677 0.078275472531
+ CT2 HCA3 1 0.288651184677 0.064818249282
+ CT2 CC312 1 0.338541512893 0.041840000000
+ CT2 CC322 1 0.338541512893 0.041840000000
+ CT2 HCR1 1 0.240542653898 0.089736802707
+ CT2 HCA3M 1 0.288651184677 0.064818249282
+ CT2 CC321C 1 0.338541512893 0.041840000000
+ CT2 CC321D 1 0.338541512893 0.041840000000
+ CT2 CC311C 1 0.338541512893 0.041840000000
+ CT2 CC311D 1 0.338541512893 0.041840000000
+ CT2 OC301 1 0.316269044940 0.132309697301
+ CT2 OC302 1 0.316269044940 0.132309697301
+ CT2 HCP1M 1 0.189271432669 0.089736802707
+ CT2 OC311M 1 0.326514380198 0.183381431383
+ CT2 OC3C5M 1 0.316269044940 0.132309697301
+ CT2 CC322C 1 0.338541512893 0.041840000000
+ CT2 HCA2C2 1 0.285087589805 0.078275472531
+ CT2 CC312C 1 0.338541512893 0.041840000000
+ CT2 HCA1C2 1 0.288651184677 0.088756043175
+ CT2 OC3C51 1 0.316269044940 0.132309697301
+ CT2 CC3152 1 0.338541512893 0.041840000000
+ CT2 CC3051 1 0.338541512893 0.041840000000
+ CT2 CC3251 1 0.338541512893 0.041840000000
+ CT2 CC3151 1 0.338541512893 0.041840000000
+ CT2 CC3153 1 0.338541512893 0.041840000000
+ CT2 OC2DP 1 0.320723538531 0.144938011577
+ CT2 OC312 1 0.326959829558 0.163176000000
+ CT2 OC30P 1 0.326959829558 0.163176000000
+ CT2 PC 1 0.360813980847 0.320014464673
+ CT2 SC 1 0.356359487256 0.286840588481
+ CT2 CC312D 1 0.338541512893 0.041840000000
+ CT2 OC303 1 0.316269044940 0.132309697301
+ CT2 HN1 1 0.189271432669 0.089736802707
+ CT2 HN2 1 0.189271432669 0.089736802707
+ CT2 HN3 1 0.267269615442 0.089736802707
+ CT2 HN4 1 0.189271432669 0.089736802707
+ CT2 HN5 1 0.189271432669 0.089736802707
+ CT2 HN6 1 0.286869387241 0.062058748940
+ CT2 HN7 1 0.286869387241 0.062058748940
+ CT2 HN8 1 0.288651184677 0.070011711020
+ CT2 HN9 1 0.288651184677 0.064818249282
+ CT2 NN1 1 0.334087019303 0.187114168357
+ CT2 NN2 1 0.334087019303 0.187114168357
+ CT2 NN2B 1 0.334087019303 0.187114168357
+ CT2 NN2G 1 0.334087019303 0.187114168357
+ CT2 NN2U 1 0.334087019303 0.187114168357
+ CT2 NN3 1 0.334087019303 0.187114168357
+ CT2 NN3A 1 0.334087019303 0.187114168357
+ CT2 NN3G 1 0.334087019303 0.187114168357
+ CT2 NN4 1 0.334087019303 0.187114168357
+ CT2 NN6 1 0.334087019303 0.187114168357
+ CT2 ON1 1 0.320723538531 0.144938011577
+ CT2 ON1C 1 0.320723538531 0.144938011577
+ CT2 ON2 1 0.326959829558 0.163176000000
+ CT2 ON3 1 0.320723538531 0.144938011577
+ CT2 ON4 1 0.326959829558 0.163176000000
+ CT2 ON5 1 0.326959829558 0.163176000000
+ CT2 ON6 1 0.326959829558 0.163176000000
+ CT2 ON6B 1 0.326959829558 0.163176000000
+ CT2 CN1 1 0.338541512893 0.132309697301
+ CT2 CN1T 1 0.338541512893 0.132309697301
+ CT2 CN2 1 0.338541512893 0.132309697301
+ CT2 CN3 1 0.338541512893 0.125520000000
+ CT2 CN3T 1 0.338541512893 0.125520000000
+ CT2 CN4 1 0.338541512893 0.114583559030
+ CT2 CN5 1 0.338541512893 0.114583559030
+ CT2 CN5G 1 0.338541512893 0.114583559030
+ CT2 CN7 1 0.338541512893 0.041840000000
+ CT2 CN7B 1 0.338541512893 0.041840000000
+ CT2 CN8 1 0.338541512893 0.041840000000
+ CT2 CN8B 1 0.338541512893 0.041840000000
+ CT2 CN9 1 0.338541512893 0.041840000000
+ CT2 P 1 0.360813980847 0.320014464673
+ CT2 P2 1 0.360813980847 0.320014464673
+ CT2 HOL 1 0.189271432669 0.089736802707
+ CT2 HAL1 1 0.286869387241 0.062058748940
+ CT2 HAL2 1 0.288651184677 0.070011711020
+ CT2 HAL3 1 0.288651184677 0.064818249282
+ CT2 HBL 1 0.286869387241 0.062058748940
+ CT2 HCL 1 0.189271432669 0.089736802707
+ CT2 HL 1 0.231633666716 0.089736802707
+ CT2 HEL1 1 0.280633096214 0.073666921749
+ CT2 HEL2 1 0.281523994932 0.067464972838
+ CT2 CL 1 0.347450500075 0.110698234855
+ CT2 CCL 1 0.347450500075 0.110698234855
+ CT2 CTL1 1 0.338541512893 0.041840000000
+ CT2 CTL2 1 0.338541512893 0.041840000000
+ CT2 CTL3 1 0.338541512893 0.041840000000
+ CT2 CTL5 1 0.338541512893 0.041840000000
+ CT2 CEL1 1 0.355468588538 0.109105371453
+ CT2 CEL2 1 0.354577689820 0.105847757841
+ CT2 CRL1 1 0.338541512893 0.041840000000
+ CT2 CRL2 1 0.338541512893 0.041840000000
+ CT2 OBL 1 0.293996576986 0.144938011577
+ CT2 OCL 1 0.320723538531 0.144938011577
+ CT2 O2L 1 0.320723538531 0.144938011577
+ CT2 OHL 1 0.326959829558 0.163176000000
+ CT2 OSL 1 0.316269044940 0.132309697301
+ CT2 OSLP 1 0.316269044940 0.132309697301
+ CT2 NH3L 1 0.334087019303 0.187114168357
+ CT2 NTL 1 0.334087019303 0.187114168357
+ CT2 SL 1 0.356359487256 0.286840588481
+ CT2 PL 1 0.360813980847 0.320014464673
+ CT2 HCA1A 1 0.288651184677 0.088756043175
+ CT2 HCA2A 1 0.288651184677 0.078275472531
+ CT2 HCA3A 1 0.288651184677 0.064818249282
+ CT2 CC30A 1 0.338541512893 0.041840000000
+ CT2 CC31A 1 0.338541512893 0.041840000000
+ CT2 CC32A 1 0.338541512893 0.041840000000
+ CT2 CC33A 1 0.338541512893 0.041840000000
+ CT2 CC326A 1 0.338541512893 0.041840000000
+ CT2 HCA25A 1 0.285087589805 0.078275472531
+ CT2 CC325A 1 0.338541512893 0.041840000000
+ CT2 CC325B 1 0.338541512893 0.041840000000
+ CT2 OC305A 1 0.316269044940 0.132309697301
+ CT2 OC30A 1 0.316269044940 0.132309697301
+ CT2 CPA 1 0.329632525712 0.125520000000
+ CT2 CPB 1 0.329632525712 0.125520000000
+ CT2 CPM 1 0.329632525712 0.125520000000
+ CT2 CM 1 0.356359487256 0.138767581228
+ CT2 CST 1 0.308518226092 0.100764063435
+ CT2 NPH 1 0.334087019303 0.187114168357
+ CT2 OM 1 0.320723538531 0.144938011577
+ CT2 OST 1 0.320010819556 0.169954883425
+ CT2 FE 1 0.227179173126 0.000000000000
+ CT2 ON2B 1 0.326959829558 0.163176000000
+ CT2 SP 1 0.365268474438 0.280671252536
+ CT2A C 1 0.347450500075 0.138767581228
+ CT2A CA 1 0.346773417049 0.110698234855
+ CT2A CC 1 0.347450500075 0.110698234855
+ CT2A CD 1 0.347450500075 0.110698234855
+ CT2A CE1 1 0.355468588538 0.109105371453
+ CT2A CE2 1 0.354577689820 0.105847757841
+ CT2A CP1 1 0.338541512893 0.041840000000
+ CT2A CP2 1 0.338541512893 0.041840000000
+ CT2A CP3 1 0.338541512893 0.041840000000
+ CT2A CPH1 1 0.329632525712 0.093557084179
+ CT2A CPH2 1 0.329632525712 0.093557084179
+ CT2A CS 1 0.365268474438 0.138767581228
+ CT2A CPT 1 0.334977918021 0.131646486622
+ CT2A CY 1 0.346559601357 0.113045454929
+ CT2A CAI 1 0.346559601357 0.113045454929
+ CT2A CT 1 0.338541512893 0.041840000000
+ CT2A CT1 1 0.338541512893 0.041840000000
+ CT2A CT2 1 0.338541512893 0.041840000000
+ CT2A CT2A 1 0.338541512893 0.041840000000
+ CT2A CT3 1 0.338541512893 0.041840000000
+ CT2A H 1 0.189271432669 0.089736802707
+ CT2A HA 1 0.286869387241 0.062058748940
+ CT2A HB1 1 0.286869387241 0.062058748940
+ CT2A HB2 1 0.288651184677 0.070011711020
+ CT2A HE1 1 0.280633096214 0.073666921749
+ CT2A HE2 1 0.281523994932 0.067464972838
+ CT2A HC 1 0.189271432669 0.089736802707
+ CT2A HP 1 0.290272620344 0.072469005789
+ CT2A HR1 1 0.249451641079 0.089736802707
+ CT2A HR2 1 0.231633666716 0.089736802707
+ CT2A HR3 1 0.300054688270 0.036952087465
+ CT2A HS 1 0.209361198763 0.132309697301
+ CT2A HA1 1 0.288651184677 0.088756043175
+ CT2A HA2 1 0.288651184677 0.077149148019
+ CT2A HA3 1 0.288651184677 0.064818249282
+ CT2A N 1 0.334087019303 0.004184000000
+ CT2A NC2 1 0.334087019303 0.187114168357
+ CT2A NH1 1 0.307360057758 0.187114168357
+ CT2A NH2 1 0.334087019303 0.187114168357
+ CT2A NH3 1 0.334087019303 0.187114168357
+ CT2A NP 1 0.334087019303 0.187114168357
+ CT2A NR1 1 0.334087019303 0.187114168357
+ CT2A NR2 1 0.334087019303 0.187114168357
+ CT2A NR3 1 0.334087019303 0.187114168357
+ CT2A NY 1 0.334087019303 0.187114168357
+ CT2A O 1 0.293996576986 0.144938011577
+ CT2A OB 1 0.293996576986 0.144938011577
+ CT2A OC 1 0.320723538531 0.144938011577
+ CT2A OH1 1 0.326959829558 0.163176000000
+ CT2A OS 1 0.326959829558 0.163176000000
+ CT2A S 1 0.347450500075 0.280671252536
+ CT2A SM 1 0.345223253279 0.257919081884
+ CT2A SS 1 0.365268474438 0.286840588481
+ CT2A HT 1 0.189271432669 0.089736802707
+ CT2A OT 1 0.326799467788 0.163176000000
+ CT2A OX 1 0.320723538531 0.144938011577
+ CT2A HX 1 0.189271432669 0.089736802707
+ CT2A LIT 1 0.284864865125 0.020196198771
+ CT2A SOD 1 0.294954293108 0.090610410351
+ CT2A MG 1 0.274842254546 0.051243325419
+ CT2A POT 1 0.326403017859 0.123410269913
+ CT2A CAL 1 0.291056611216 0.144938011577
+ CT2A RUB 1 0.338541512893 0.162045623205
+ CT2A CES 1 0.356359487256 0.182376331798
+ CT2A BAR 1 0.337650614175 0.162045623205
+ CT2A ZN 1 0.266378716724 0.209200000000
+ CT2A CAD 1 0.290165712498 0.144938011577
+ CT2A CLA 1 0.371504765465 0.162045623205
+ CT2A HGA1 1 0.288651184677 0.088756043175
+ CT2A HGA2 1 0.288651184677 0.078275472531
+ CT2A HGA3 1 0.288651184677 0.064818249282
+ CT2A HGA4 1 0.280633096214 0.073666921749
+ CT2A HGA5 1 0.281523994932 0.067464972838
+ CT2A HGA6 1 0.286869387241 0.070011711020
+ CT2A HGA7 1 0.285087589805 0.072469005789
+ CT2A HGAAM0 1 0.283305792369 0.070011711020
+ CT2A HGAAM1 1 0.283305792369 0.070011711020
+ CT2A HGAAM2 1 0.281523994932 0.083680000000
+ CT2A HGP1 1 0.189271432669 0.089736802707
+ CT2A HGP2 1 0.189271432669 0.089736802707
+ CT2A HGP3 1 0.209361198763 0.132309697301
+ CT2A HGP4 1 0.189271432669 0.089736802707
+ CT2A HGP5 1 0.231633666716 0.089736802707
+ CT2A HGPAM1 1 0.247224394284 0.039692909190
+ CT2A HGPAM2 1 0.247224394284 0.041840000000
+ CT2A HGPAM3 1 0.246778944925 0.045833423612
+ CT2A HGR51 1 0.290272620344 0.072469005789
+ CT2A HGR52 1 0.249451641079 0.089736802707
+ CT2A HGR53 1 0.231633666716 0.089736802707
+ CT2A HGR61 1 0.290272620344 0.072469005789
+ CT2A HGR62 1 0.267269615442 0.089736802707
+ CT2A HGR63 1 0.249451641079 0.089736802707
+ CT2A HGR71 1 0.290272620344 0.072469005789
+ CT2A CG1T1 1 0.333196120584 0.170981810495
+ CT2A CG1T2 1 0.346782326036 0.134409982486
+ CT2A CG1N1 1 0.335868816739 0.177512086349
+ CT2A CG2D1 1 0.355468588538 0.109105371453
+ CT2A CG2D2 1 0.354577689820 0.105847757841
+ CT2A CG2D1O 1 0.355468588538 0.109105371453
+ CT2A CG2D2O 1 0.355468588538 0.109105371453
+ CT2A CG2DC1 1 0.355468588538 0.109105371453
+ CT2A CG2DC2 1 0.355468588538 0.109105371453
+ CT2A CG2DC3 1 0.354577689820 0.105847757841
+ CT2A CG25C1 1 0.355468588538 0.109105371453
+ CT2A CG25C2 1 0.355468588538 0.109105371453
+ CT2A CG251O 1 0.355468588538 0.109105371453
+ CT2A CG252O 1 0.355468588538 0.109105371453
+ CT2A CG2N1 1 0.347450500075 0.138767581228
+ CT2A CG2N2 1 0.347450500075 0.138767581228
+ CT2A CG2O1 1 0.347450500075 0.138767581228
+ CT2A CG2O2 1 0.320723538531 0.130979917850
+ CT2A CG2O3 1 0.347450500075 0.110698234855
+ CT2A CG2O4 1 0.329632525712 0.102486650838
+ CT2A CG2O5 1 0.347450500075 0.125520000000
+ CT2A CG2O6 1 0.347450500075 0.110698234855
+ CT2A CG2O7 1 0.308518226092 0.100764063435
+ CT2A CG2R51 1 0.356359487256 0.093557084179
+ CT2A CG2R52 1 0.365268474438 0.059170695450
+ CT2A CG2R53 1 0.365268474438 0.059170695450
+ CT2A CG2R57 1 0.356359487256 0.093557084179
+ CT2A CG2R61 1 0.346773417049 0.110698234855
+ CT2A CG2R62 1 0.338541512893 0.125520000000
+ CT2A CG2R63 1 0.338541512893 0.132309697301
+ CT2A CG2R64 1 0.356359487256 0.083680000000
+ CT2A CG2R66 1 0.338541512893 0.110698234855
+ CT2A CG2R67 1 0.346773417049 0.110698234855
+ CT2A CG2RC0 1 0.334977918021 0.131646486622
+ CT2A CG2R71 1 0.346987232741 0.108300154755
+ CT2A CG2RC7 1 0.334977918021 0.131646486622
+ CT2A CG301 1 0.338541512893 0.041840000000
+ CT2A CG302 1 0.374177461619 0.059170695450
+ CT2A CG311 1 0.338541512893 0.041840000000
+ CT2A CG312 1 0.351904993665 0.085746484010
+ CT2A CG314 1 0.338541512893 0.041840000000
+ CT2A CG321 1 0.338541512893 0.041840000000
+ CT2A CG322 1 0.338541512893 0.102486650838
+ CT2A CG323 1 0.365268474438 0.138767581228
+ CT2A CG324 1 0.338541512893 0.041840000000
+ CT2A CG331 1 0.338541512893 0.041840000000
+ CT2A CG334 1 0.338541512893 0.041840000000
+ CT2A CG3C50 1 0.338541512893 0.041840000000
+ CT2A CG3C51 1 0.338541512893 0.041840000000
+ CT2A CG3C52 1 0.338541512893 0.041840000000
+ CT2A CG3C53 1 0.338541512893 0.041840000000
+ CT2A CG3C54 1 0.338541512893 0.041840000000
+ CT2A CG3C31 1 0.338541512893 0.041840000000
+ CT2A CG3C41 1 0.338541512893 0.041840000000
+ CT2A CG3RC1 1 0.338541512893 0.041840000000
+ CT2A CG3AM0 1 0.344777803920 0.110698234855
+ CT2A CG3AM1 1 0.345668702638 0.116852760686
+ CT2A CG3AM2 1 0.346559601357 0.118341390899
+ CT2A NG1T1 1 0.328741626994 0.177512086349
+ CT2A NG2D1 1 0.334087019303 0.187114168357
+ CT2A NG2S0 1 0.334087019303 0.004184000000
+ CT2A NG2S1 1 0.307360057758 0.187114168357
+ CT2A NG2S2 1 0.334087019303 0.187114168357
+ CT2A NG2S3 1 0.334087019303 0.187114168357
+ CT2A NG2O1 1 0.334087019303 0.187114168357
+ CT2A NG2P1 1 0.334087019303 0.187114168357
+ CT2A NG2R43 1 0.334087019303 0.187114168357
+ CT2A NG2R50 1 0.334087019303 0.187114168357
+ CT2A NG2R51 1 0.334087019303 0.187114168357
+ CT2A NG2R52 1 0.334087019303 0.187114168357
+ CT2A NG2R53 1 0.334087019303 0.187114168357
+ CT2A NG2R57 1 0.334087019303 0.187114168357
+ CT2A NG2R60 1 0.337650614175 0.102486650838
+ CT2A NG2R61 1 0.334087019303 0.187114168357
+ CT2A NG2R62 1 0.352795892384 0.093557084179
+ CT2A NG2R67 1 0.334087019303 0.187114168357
+ CT2A NG2RC0 1 0.334087019303 0.187114168357
+ CT2A NG301 1 0.347450500075 0.078275472531
+ CT2A NG311 1 0.347450500075 0.088756043175
+ CT2A NG321 1 0.346559601357 0.102486650838
+ CT2A NG331 1 0.345668702638 0.110698234855
+ CT2A NG3C51 1 0.334087019303 0.187114168357
+ CT2A NG3N1 1 0.351904993665 0.102486650838
+ CT2A NG3P0 1 0.334087019303 0.187114168357
+ CT2A NG3P1 1 0.334087019303 0.187114168357
+ CT2A NG3P2 1 0.334087019303 0.187114168357
+ CT2A NG3P3 1 0.334087019303 0.187114168357
+ CT2A OG2D1 1 0.293996576986 0.144938011577
+ CT2A OG2D2 1 0.320723538531 0.144938011577
+ CT2A OG2D3 1 0.293996576986 0.144938011577
+ CT2A OG2D4 1 0.320723538531 0.144938011577
+ CT2A OG2D5 1 0.320010819556 0.169954883425
+ CT2A OG2N1 1 0.320723538531 0.144938011577
+ CT2A OG2P1 1 0.320723538531 0.144938011577
+ CT2A OG2R50 1 0.320723538531 0.144938011577
+ CT2A OG3R60 1 0.316269044940 0.132309697301
+ CT2A OG301 1 0.316269044940 0.132309697301
+ CT2A OG302 1 0.316269044940 0.132309697301
+ CT2A OG303 1 0.316269044940 0.132309697301
+ CT2A OG304 1 0.316269044940 0.132309697301
+ CT2A OG311 1 0.326514380198 0.183381431383
+ CT2A OG312 1 0.325178032121 0.144938011577
+ CT2A OG3C31 1 0.316269044940 0.132309697301
+ CT2A OG3C51 1 0.316269044940 0.132309697301
+ CT2A OG3C61 1 0.316269044940 0.132309697301
+ CT2A SG2D1 1 0.351904993665 0.314496560236
+ CT2A SG2R50 1 0.347450500075 0.280671252536
+ CT2A SG311 1 0.347450500075 0.280671252536
+ CT2A SG301 1 0.345223253279 0.257919081884
+ CT2A SG302 1 0.365268474438 0.286840588481
+ CT2A SG3O1 1 0.356359487256 0.286840588481
+ CT2A SG3O2 1 0.347450500075 0.247528778125
+ CT2A SG3O3 1 0.347450500075 0.247528778125
+ CT2A FGA1 1 0.314487247504 0.153729976257
+ CT2A FGA2 1 0.314487247504 0.135577095411
+ CT2A FGA3 1 0.311814551349 0.130309939452
+ CT2A FGP1 1 0.311814551349 0.130309939452
+ CT2A FGR1 1 0.320723538531 0.144938011577
+ CT2A CLGA1 1 0.339432411611 0.245040988571
+ CT2A CLGA3 1 0.339432411611 0.232955260941
+ CT2A CLGR1 1 0.341214209048 0.236682781799
+ CT2A BRGA1 1 0.344777803920 0.289876023155
+ CT2A BRGA2 1 0.351904993665 0.304599797767
+ CT2A BRGA3 1 0.347450500075 0.307459952514
+ CT2A BRGR1 1 0.353686791102 0.271154190821
+ CT2A IGR1 1 0.364377575719 0.310293744700
+ CT2A PG0 1 0.360813980847 0.320014464673
+ CT2A PG1 1 0.360813980847 0.320014464673
+ CT2A PG2 1 0.360813980847 0.320014464673
+ CT2A ALG1 1 0.347450500075 0.337324864189
+ CT2A CC301 1 0.338541512893 0.041840000000
+ CT2A CC3062 1 0.338541512893 0.041840000000
+ CT2A CC311 1 0.338541512893 0.041840000000
+ CT2A CC3161 1 0.338541512893 0.041840000000
+ CT2A CC3162 1 0.338541512893 0.041840000000
+ CT2A CC3163 1 0.338541512893 0.041840000000
+ CT2A CC321 1 0.338541512893 0.041840000000
+ CT2A CC3261 1 0.338541512893 0.041840000000
+ CT2A CC3263 1 0.338541512893 0.041840000000
+ CT2A CC331 1 0.338541512893 0.041840000000
+ CT2A CC2O1 1 0.347450500075 0.138767581228
+ CT2A CC2O2 1 0.347450500075 0.110698234855
+ CT2A CC2O3 1 0.347450500075 0.125520000000
+ CT2A CC2O4 1 0.329632525712 0.102486650838
+ CT2A OC2D1 1 0.293996576986 0.144938011577
+ CT2A OC2D2 1 0.320723538531 0.144938011577
+ CT2A OC2D3 1 0.293996576986 0.144938011577
+ CT2A OC2D4 1 0.293996576986 0.144938011577
+ CT2A OC3C61 1 0.316269044940 0.132309697301
+ CT2A OC311 1 0.326514380198 0.183381431383
+ CT2A NC2D1 1 0.307360057758 0.187114168357
+ CT2A HCP1 1 0.189271432669 0.089736802707
+ CT2A HCA1 1 0.288651184677 0.088756043175
+ CT2A HCA2 1 0.288651184677 0.078275472531
+ CT2A HCA3 1 0.288651184677 0.064818249282
+ CT2A CC312 1 0.338541512893 0.041840000000
+ CT2A CC322 1 0.338541512893 0.041840000000
+ CT2A HCR1 1 0.240542653898 0.089736802707
+ CT2A HCA3M 1 0.288651184677 0.064818249282
+ CT2A CC321C 1 0.338541512893 0.041840000000
+ CT2A CC321D 1 0.338541512893 0.041840000000
+ CT2A CC311C 1 0.338541512893 0.041840000000
+ CT2A CC311D 1 0.338541512893 0.041840000000
+ CT2A OC301 1 0.316269044940 0.132309697301
+ CT2A OC302 1 0.316269044940 0.132309697301
+ CT2A HCP1M 1 0.189271432669 0.089736802707
+ CT2A OC311M 1 0.326514380198 0.183381431383
+ CT2A OC3C5M 1 0.316269044940 0.132309697301
+ CT2A CC322C 1 0.338541512893 0.041840000000
+ CT2A HCA2C2 1 0.285087589805 0.078275472531
+ CT2A CC312C 1 0.338541512893 0.041840000000
+ CT2A HCA1C2 1 0.288651184677 0.088756043175
+ CT2A OC3C51 1 0.316269044940 0.132309697301
+ CT2A CC3152 1 0.338541512893 0.041840000000
+ CT2A CC3051 1 0.338541512893 0.041840000000
+ CT2A CC3251 1 0.338541512893 0.041840000000
+ CT2A CC3151 1 0.338541512893 0.041840000000
+ CT2A CC3153 1 0.338541512893 0.041840000000
+ CT2A OC2DP 1 0.320723538531 0.144938011577
+ CT2A OC312 1 0.326959829558 0.163176000000
+ CT2A OC30P 1 0.326959829558 0.163176000000
+ CT2A PC 1 0.360813980847 0.320014464673
+ CT2A SC 1 0.356359487256 0.286840588481
+ CT2A CC312D 1 0.338541512893 0.041840000000
+ CT2A OC303 1 0.316269044940 0.132309697301
+ CT2A HN1 1 0.189271432669 0.089736802707
+ CT2A HN2 1 0.189271432669 0.089736802707
+ CT2A HN3 1 0.267269615442 0.089736802707
+ CT2A HN4 1 0.189271432669 0.089736802707
+ CT2A HN5 1 0.189271432669 0.089736802707
+ CT2A HN6 1 0.286869387241 0.062058748940
+ CT2A HN7 1 0.286869387241 0.062058748940
+ CT2A HN8 1 0.288651184677 0.070011711020
+ CT2A HN9 1 0.288651184677 0.064818249282
+ CT2A NN1 1 0.334087019303 0.187114168357
+ CT2A NN2 1 0.334087019303 0.187114168357
+ CT2A NN2B 1 0.334087019303 0.187114168357
+ CT2A NN2G 1 0.334087019303 0.187114168357
+ CT2A NN2U 1 0.334087019303 0.187114168357
+ CT2A NN3 1 0.334087019303 0.187114168357
+ CT2A NN3A 1 0.334087019303 0.187114168357
+ CT2A NN3G 1 0.334087019303 0.187114168357
+ CT2A NN4 1 0.334087019303 0.187114168357
+ CT2A NN6 1 0.334087019303 0.187114168357
+ CT2A ON1 1 0.320723538531 0.144938011577
+ CT2A ON1C 1 0.320723538531 0.144938011577
+ CT2A ON2 1 0.326959829558 0.163176000000
+ CT2A ON3 1 0.320723538531 0.144938011577
+ CT2A ON4 1 0.326959829558 0.163176000000
+ CT2A ON5 1 0.326959829558 0.163176000000
+ CT2A ON6 1 0.326959829558 0.163176000000
+ CT2A ON6B 1 0.326959829558 0.163176000000
+ CT2A CN1 1 0.338541512893 0.132309697301
+ CT2A CN1T 1 0.338541512893 0.132309697301
+ CT2A CN2 1 0.338541512893 0.132309697301
+ CT2A CN3 1 0.338541512893 0.125520000000
+ CT2A CN3T 1 0.338541512893 0.125520000000
+ CT2A CN4 1 0.338541512893 0.114583559030
+ CT2A CN5 1 0.338541512893 0.114583559030
+ CT2A CN5G 1 0.338541512893 0.114583559030
+ CT2A CN7 1 0.338541512893 0.041840000000
+ CT2A CN7B 1 0.338541512893 0.041840000000
+ CT2A CN8 1 0.338541512893 0.041840000000
+ CT2A CN8B 1 0.338541512893 0.041840000000
+ CT2A CN9 1 0.338541512893 0.041840000000
+ CT2A P 1 0.360813980847 0.320014464673
+ CT2A P2 1 0.360813980847 0.320014464673
+ CT2A HOL 1 0.189271432669 0.089736802707
+ CT2A HAL1 1 0.286869387241 0.062058748940
+ CT2A HAL2 1 0.288651184677 0.070011711020
+ CT2A HAL3 1 0.288651184677 0.064818249282
+ CT2A HBL 1 0.286869387241 0.062058748940
+ CT2A HCL 1 0.189271432669 0.089736802707
+ CT2A HL 1 0.231633666716 0.089736802707
+ CT2A HEL1 1 0.280633096214 0.073666921749
+ CT2A HEL2 1 0.281523994932 0.067464972838
+ CT2A CL 1 0.347450500075 0.110698234855
+ CT2A CCL 1 0.347450500075 0.110698234855
+ CT2A CTL1 1 0.338541512893 0.041840000000
+ CT2A CTL2 1 0.338541512893 0.041840000000
+ CT2A CTL3 1 0.338541512893 0.041840000000
+ CT2A CTL5 1 0.338541512893 0.041840000000
+ CT2A CEL1 1 0.355468588538 0.109105371453
+ CT2A CEL2 1 0.354577689820 0.105847757841
+ CT2A CRL1 1 0.338541512893 0.041840000000
+ CT2A CRL2 1 0.338541512893 0.041840000000
+ CT2A OBL 1 0.293996576986 0.144938011577
+ CT2A OCL 1 0.320723538531 0.144938011577
+ CT2A O2L 1 0.320723538531 0.144938011577
+ CT2A OHL 1 0.326959829558 0.163176000000
+ CT2A OSL 1 0.316269044940 0.132309697301
+ CT2A OSLP 1 0.316269044940 0.132309697301
+ CT2A NH3L 1 0.334087019303 0.187114168357
+ CT2A NTL 1 0.334087019303 0.187114168357
+ CT2A SL 1 0.356359487256 0.286840588481
+ CT2A PL 1 0.360813980847 0.320014464673
+ CT2A HCA1A 1 0.288651184677 0.088756043175
+ CT2A HCA2A 1 0.288651184677 0.078275472531
+ CT2A HCA3A 1 0.288651184677 0.064818249282
+ CT2A CC30A 1 0.338541512893 0.041840000000
+ CT2A CC31A 1 0.338541512893 0.041840000000
+ CT2A CC32A 1 0.338541512893 0.041840000000
+ CT2A CC33A 1 0.338541512893 0.041840000000
+ CT2A CC326A 1 0.338541512893 0.041840000000
+ CT2A HCA25A 1 0.285087589805 0.078275472531
+ CT2A CC325A 1 0.338541512893 0.041840000000
+ CT2A CC325B 1 0.338541512893 0.041840000000
+ CT2A OC305A 1 0.316269044940 0.132309697301
+ CT2A OC30A 1 0.316269044940 0.132309697301
+ CT2A CPA 1 0.329632525712 0.125520000000
+ CT2A CPB 1 0.329632525712 0.125520000000
+ CT2A CPM 1 0.329632525712 0.125520000000
+ CT2A CM 1 0.356359487256 0.138767581228
+ CT2A CST 1 0.308518226092 0.100764063435
+ CT2A NPH 1 0.334087019303 0.187114168357
+ CT2A OM 1 0.320723538531 0.144938011577
+ CT2A OST 1 0.320010819556 0.169954883425
+ CT2A FE 1 0.227179173126 0.000000000000
+ CT2A ON2B 1 0.326959829558 0.163176000000
+ CT2A SP 1 0.365268474438 0.280671252536
+ CT3 C 1 0.347450500075 0.138767581228
+ CT3 CA 1 0.346773417049 0.110698234855
+ CT3 CC 1 0.347450500075 0.110698234855
+ CT3 CD 1 0.347450500075 0.110698234855
+ CT3 CE1 1 0.355468588538 0.109105371453
+ CT3 CE2 1 0.354577689820 0.105847757841
+ CT3 CP1 1 0.338541512893 0.041840000000
+ CT3 CP2 1 0.338541512893 0.041840000000
+ CT3 CP3 1 0.338541512893 0.041840000000
+ CT3 CPH1 1 0.329632525712 0.093557084179
+ CT3 CPH2 1 0.329632525712 0.093557084179
+ CT3 CS 1 0.365268474438 0.138767581228
+ CT3 CPT 1 0.334977918021 0.131646486622
+ CT3 CY 1 0.346559601357 0.113045454929
+ CT3 CAI 1 0.346559601357 0.113045454929
+ CT3 CT 1 0.338541512893 0.041840000000
+ CT3 CT1 1 0.338541512893 0.041840000000
+ CT3 CT2 1 0.338541512893 0.041840000000
+ CT3 CT2A 1 0.338541512893 0.041840000000
+ CT3 CT3 1 0.338541512893 0.041840000000
+ CT3 H 1 0.189271432669 0.089736802707
+ CT3 HA 1 0.286869387241 0.062058748940
+ CT3 HB1 1 0.286869387241 0.062058748940
+ CT3 HB2 1 0.288651184677 0.070011711020
+ CT3 HE1 1 0.280633096214 0.073666921749
+ CT3 HE2 1 0.281523994932 0.067464972838
+ CT3 HC 1 0.189271432669 0.089736802707
+ CT3 HP 1 0.290272620344 0.072469005789
+ CT3 HR1 1 0.249451641079 0.089736802707
+ CT3 HR2 1 0.231633666716 0.089736802707
+ CT3 HR3 1 0.300054688270 0.036952087465
+ CT3 HS 1 0.209361198763 0.132309697301
+ CT3 HA1 1 0.288651184677 0.088756043175
+ CT3 HA2 1 0.288651184677 0.077149148019
+ CT3 HA3 1 0.288651184677 0.064818249282
+ CT3 N 1 0.334087019303 0.004184000000
+ CT3 NC2 1 0.334087019303 0.187114168357
+ CT3 NH1 1 0.307360057758 0.187114168357
+ CT3 NH2 1 0.334087019303 0.187114168357
+ CT3 NH3 1 0.334087019303 0.187114168357
+ CT3 NP 1 0.334087019303 0.187114168357
+ CT3 NR1 1 0.334087019303 0.187114168357
+ CT3 NR2 1 0.334087019303 0.187114168357
+ CT3 NR3 1 0.334087019303 0.187114168357
+ CT3 NY 1 0.334087019303 0.187114168357
+ CT3 O 1 0.293996576986 0.144938011577
+ CT3 OB 1 0.293996576986 0.144938011577
+ CT3 OC 1 0.320723538531 0.144938011577
+ CT3 OH1 1 0.326959829558 0.163176000000
+ CT3 OS 1 0.326959829558 0.163176000000
+ CT3 S 1 0.347450500075 0.280671252536
+ CT3 SM 1 0.345223253279 0.257919081884
+ CT3 SS 1 0.365268474438 0.286840588481
+ CT3 HT 1 0.189271432669 0.089736802707
+ CT3 OT 1 0.326799467788 0.163176000000
+ CT3 OX 1 0.320723538531 0.144938011577
+ CT3 HX 1 0.189271432669 0.089736802707
+ CT3 LIT 1 0.284864865125 0.020196198771
+ CT3 SOD 1 0.294954293108 0.090610410351
+ CT3 MG 1 0.274842254546 0.051243325419
+ CT3 POT 1 0.326403017859 0.123410269913
+ CT3 CAL 1 0.291056611216 0.144938011577
+ CT3 RUB 1 0.338541512893 0.162045623205
+ CT3 CES 1 0.356359487256 0.182376331798
+ CT3 BAR 1 0.337650614175 0.162045623205
+ CT3 ZN 1 0.266378716724 0.209200000000
+ CT3 CAD 1 0.290165712498 0.144938011577
+ CT3 CLA 1 0.371504765465 0.162045623205
+ CT3 HGA1 1 0.288651184677 0.088756043175
+ CT3 HGA2 1 0.288651184677 0.078275472531
+ CT3 HGA3 1 0.288651184677 0.064818249282
+ CT3 HGA4 1 0.280633096214 0.073666921749
+ CT3 HGA5 1 0.281523994932 0.067464972838
+ CT3 HGA6 1 0.286869387241 0.070011711020
+ CT3 HGA7 1 0.285087589805 0.072469005789
+ CT3 HGAAM0 1 0.283305792369 0.070011711020
+ CT3 HGAAM1 1 0.283305792369 0.070011711020
+ CT3 HGAAM2 1 0.281523994932 0.083680000000
+ CT3 HGP1 1 0.189271432669 0.089736802707
+ CT3 HGP2 1 0.189271432669 0.089736802707
+ CT3 HGP3 1 0.209361198763 0.132309697301
+ CT3 HGP4 1 0.189271432669 0.089736802707
+ CT3 HGP5 1 0.231633666716 0.089736802707
+ CT3 HGPAM1 1 0.247224394284 0.039692909190
+ CT3 HGPAM2 1 0.247224394284 0.041840000000
+ CT3 HGPAM3 1 0.246778944925 0.045833423612
+ CT3 HGR51 1 0.290272620344 0.072469005789
+ CT3 HGR52 1 0.249451641079 0.089736802707
+ CT3 HGR53 1 0.231633666716 0.089736802707
+ CT3 HGR61 1 0.290272620344 0.072469005789
+ CT3 HGR62 1 0.267269615442 0.089736802707
+ CT3 HGR63 1 0.249451641079 0.089736802707
+ CT3 HGR71 1 0.290272620344 0.072469005789
+ CT3 CG1T1 1 0.333196120584 0.170981810495
+ CT3 CG1T2 1 0.346782326036 0.134409982486
+ CT3 CG1N1 1 0.335868816739 0.177512086349
+ CT3 CG2D1 1 0.355468588538 0.109105371453
+ CT3 CG2D2 1 0.354577689820 0.105847757841
+ CT3 CG2D1O 1 0.355468588538 0.109105371453
+ CT3 CG2D2O 1 0.355468588538 0.109105371453
+ CT3 CG2DC1 1 0.355468588538 0.109105371453
+ CT3 CG2DC2 1 0.355468588538 0.109105371453
+ CT3 CG2DC3 1 0.354577689820 0.105847757841
+ CT3 CG25C1 1 0.355468588538 0.109105371453
+ CT3 CG25C2 1 0.355468588538 0.109105371453
+ CT3 CG251O 1 0.355468588538 0.109105371453
+ CT3 CG252O 1 0.355468588538 0.109105371453
+ CT3 CG2N1 1 0.347450500075 0.138767581228
+ CT3 CG2N2 1 0.347450500075 0.138767581228
+ CT3 CG2O1 1 0.347450500075 0.138767581228
+ CT3 CG2O2 1 0.320723538531 0.130979917850
+ CT3 CG2O3 1 0.347450500075 0.110698234855
+ CT3 CG2O4 1 0.329632525712 0.102486650838
+ CT3 CG2O5 1 0.347450500075 0.125520000000
+ CT3 CG2O6 1 0.347450500075 0.110698234855
+ CT3 CG2O7 1 0.308518226092 0.100764063435
+ CT3 CG2R51 1 0.356359487256 0.093557084179
+ CT3 CG2R52 1 0.365268474438 0.059170695450
+ CT3 CG2R53 1 0.365268474438 0.059170695450
+ CT3 CG2R57 1 0.356359487256 0.093557084179
+ CT3 CG2R61 1 0.346773417049 0.110698234855
+ CT3 CG2R62 1 0.338541512893 0.125520000000
+ CT3 CG2R63 1 0.338541512893 0.132309697301
+ CT3 CG2R64 1 0.356359487256 0.083680000000
+ CT3 CG2R66 1 0.338541512893 0.110698234855
+ CT3 CG2R67 1 0.346773417049 0.110698234855
+ CT3 CG2RC0 1 0.334977918021 0.131646486622
+ CT3 CG2R71 1 0.346987232741 0.108300154755
+ CT3 CG2RC7 1 0.334977918021 0.131646486622
+ CT3 CG301 1 0.338541512893 0.041840000000
+ CT3 CG302 1 0.374177461619 0.059170695450
+ CT3 CG311 1 0.338541512893 0.041840000000
+ CT3 CG312 1 0.351904993665 0.085746484010
+ CT3 CG314 1 0.338541512893 0.041840000000
+ CT3 CG321 1 0.338541512893 0.041840000000
+ CT3 CG322 1 0.338541512893 0.102486650838
+ CT3 CG323 1 0.365268474438 0.138767581228
+ CT3 CG324 1 0.338541512893 0.041840000000
+ CT3 CG331 1 0.338541512893 0.041840000000
+ CT3 CG334 1 0.338541512893 0.041840000000
+ CT3 CG3C50 1 0.338541512893 0.041840000000
+ CT3 CG3C51 1 0.338541512893 0.041840000000
+ CT3 CG3C52 1 0.338541512893 0.041840000000
+ CT3 CG3C53 1 0.338541512893 0.041840000000
+ CT3 CG3C54 1 0.338541512893 0.041840000000
+ CT3 CG3C31 1 0.338541512893 0.041840000000
+ CT3 CG3C41 1 0.338541512893 0.041840000000
+ CT3 CG3RC1 1 0.338541512893 0.041840000000
+ CT3 CG3AM0 1 0.344777803920 0.110698234855
+ CT3 CG3AM1 1 0.345668702638 0.116852760686
+ CT3 CG3AM2 1 0.346559601357 0.118341390899
+ CT3 NG1T1 1 0.328741626994 0.177512086349
+ CT3 NG2D1 1 0.334087019303 0.187114168357
+ CT3 NG2S0 1 0.334087019303 0.004184000000
+ CT3 NG2S1 1 0.307360057758 0.187114168357
+ CT3 NG2S2 1 0.334087019303 0.187114168357
+ CT3 NG2S3 1 0.334087019303 0.187114168357
+ CT3 NG2O1 1 0.334087019303 0.187114168357
+ CT3 NG2P1 1 0.334087019303 0.187114168357
+ CT3 NG2R43 1 0.334087019303 0.187114168357
+ CT3 NG2R50 1 0.334087019303 0.187114168357
+ CT3 NG2R51 1 0.334087019303 0.187114168357
+ CT3 NG2R52 1 0.334087019303 0.187114168357
+ CT3 NG2R53 1 0.334087019303 0.187114168357
+ CT3 NG2R57 1 0.334087019303 0.187114168357
+ CT3 NG2R60 1 0.337650614175 0.102486650838
+ CT3 NG2R61 1 0.334087019303 0.187114168357
+ CT3 NG2R62 1 0.352795892384 0.093557084179
+ CT3 NG2R67 1 0.334087019303 0.187114168357
+ CT3 NG2RC0 1 0.334087019303 0.187114168357
+ CT3 NG301 1 0.347450500075 0.078275472531
+ CT3 NG311 1 0.347450500075 0.088756043175
+ CT3 NG321 1 0.346559601357 0.102486650838
+ CT3 NG331 1 0.345668702638 0.110698234855
+ CT3 NG3C51 1 0.334087019303 0.187114168357
+ CT3 NG3N1 1 0.351904993665 0.102486650838
+ CT3 NG3P0 1 0.334087019303 0.187114168357
+ CT3 NG3P1 1 0.334087019303 0.187114168357
+ CT3 NG3P2 1 0.334087019303 0.187114168357
+ CT3 NG3P3 1 0.334087019303 0.187114168357
+ CT3 OG2D1 1 0.293996576986 0.144938011577
+ CT3 OG2D2 1 0.320723538531 0.144938011577
+ CT3 OG2D3 1 0.293996576986 0.144938011577
+ CT3 OG2D4 1 0.320723538531 0.144938011577
+ CT3 OG2D5 1 0.320010819556 0.169954883425
+ CT3 OG2N1 1 0.320723538531 0.144938011577
+ CT3 OG2P1 1 0.320723538531 0.144938011577
+ CT3 OG2R50 1 0.320723538531 0.144938011577
+ CT3 OG3R60 1 0.316269044940 0.132309697301
+ CT3 OG301 1 0.316269044940 0.132309697301
+ CT3 OG302 1 0.316269044940 0.132309697301
+ CT3 OG303 1 0.316269044940 0.132309697301
+ CT3 OG304 1 0.316269044940 0.132309697301
+ CT3 OG311 1 0.326514380198 0.183381431383
+ CT3 OG312 1 0.325178032121 0.144938011577
+ CT3 OG3C31 1 0.316269044940 0.132309697301
+ CT3 OG3C51 1 0.316269044940 0.132309697301
+ CT3 OG3C61 1 0.316269044940 0.132309697301
+ CT3 SG2D1 1 0.351904993665 0.314496560236
+ CT3 SG2R50 1 0.347450500075 0.280671252536
+ CT3 SG311 1 0.347450500075 0.280671252536
+ CT3 SG301 1 0.345223253279 0.257919081884
+ CT3 SG302 1 0.365268474438 0.286840588481
+ CT3 SG3O1 1 0.356359487256 0.286840588481
+ CT3 SG3O2 1 0.347450500075 0.247528778125
+ CT3 SG3O3 1 0.347450500075 0.247528778125
+ CT3 FGA1 1 0.314487247504 0.153729976257
+ CT3 FGA2 1 0.314487247504 0.135577095411
+ CT3 FGA3 1 0.311814551349 0.130309939452
+ CT3 FGP1 1 0.311814551349 0.130309939452
+ CT3 FGR1 1 0.320723538531 0.144938011577
+ CT3 CLGA1 1 0.339432411611 0.245040988571
+ CT3 CLGA3 1 0.339432411611 0.232955260941
+ CT3 CLGR1 1 0.341214209048 0.236682781799
+ CT3 BRGA1 1 0.344777803920 0.289876023155
+ CT3 BRGA2 1 0.351904993665 0.304599797767
+ CT3 BRGA3 1 0.347450500075 0.307459952514
+ CT3 BRGR1 1 0.353686791102 0.271154190821
+ CT3 IGR1 1 0.364377575719 0.310293744700
+ CT3 PG0 1 0.360813980847 0.320014464673
+ CT3 PG1 1 0.360813980847 0.320014464673
+ CT3 PG2 1 0.360813980847 0.320014464673
+ CT3 ALG1 1 0.347450500075 0.337324864189
+ CT3 CC301 1 0.338541512893 0.041840000000
+ CT3 CC3062 1 0.338541512893 0.041840000000
+ CT3 CC311 1 0.338541512893 0.041840000000
+ CT3 CC3161 1 0.338541512893 0.041840000000
+ CT3 CC3162 1 0.338541512893 0.041840000000
+ CT3 CC3163 1 0.338541512893 0.041840000000
+ CT3 CC321 1 0.338541512893 0.041840000000
+ CT3 CC3261 1 0.338541512893 0.041840000000
+ CT3 CC3263 1 0.338541512893 0.041840000000
+ CT3 CC331 1 0.338541512893 0.041840000000
+ CT3 CC2O1 1 0.347450500075 0.138767581228
+ CT3 CC2O2 1 0.347450500075 0.110698234855
+ CT3 CC2O3 1 0.347450500075 0.125520000000
+ CT3 CC2O4 1 0.329632525712 0.102486650838
+ CT3 OC2D1 1 0.293996576986 0.144938011577
+ CT3 OC2D2 1 0.320723538531 0.144938011577
+ CT3 OC2D3 1 0.293996576986 0.144938011577
+ CT3 OC2D4 1 0.293996576986 0.144938011577
+ CT3 OC3C61 1 0.316269044940 0.132309697301
+ CT3 OC311 1 0.326514380198 0.183381431383
+ CT3 NC2D1 1 0.307360057758 0.187114168357
+ CT3 HCP1 1 0.189271432669 0.089736802707
+ CT3 HCA1 1 0.288651184677 0.088756043175
+ CT3 HCA2 1 0.288651184677 0.078275472531
+ CT3 HCA3 1 0.288651184677 0.064818249282
+ CT3 CC312 1 0.338541512893 0.041840000000
+ CT3 CC322 1 0.338541512893 0.041840000000
+ CT3 HCR1 1 0.240542653898 0.089736802707
+ CT3 HCA3M 1 0.288651184677 0.064818249282
+ CT3 CC321C 1 0.338541512893 0.041840000000
+ CT3 CC321D 1 0.338541512893 0.041840000000
+ CT3 CC311C 1 0.338541512893 0.041840000000
+ CT3 CC311D 1 0.338541512893 0.041840000000
+ CT3 OC301 1 0.316269044940 0.132309697301
+ CT3 OC302 1 0.316269044940 0.132309697301
+ CT3 HCP1M 1 0.189271432669 0.089736802707
+ CT3 OC311M 1 0.326514380198 0.183381431383
+ CT3 OC3C5M 1 0.316269044940 0.132309697301
+ CT3 CC322C 1 0.338541512893 0.041840000000
+ CT3 HCA2C2 1 0.285087589805 0.078275472531
+ CT3 CC312C 1 0.338541512893 0.041840000000
+ CT3 HCA1C2 1 0.288651184677 0.088756043175
+ CT3 OC3C51 1 0.316269044940 0.132309697301
+ CT3 CC3152 1 0.338541512893 0.041840000000
+ CT3 CC3051 1 0.338541512893 0.041840000000
+ CT3 CC3251 1 0.338541512893 0.041840000000
+ CT3 CC3151 1 0.338541512893 0.041840000000
+ CT3 CC3153 1 0.338541512893 0.041840000000
+ CT3 OC2DP 1 0.320723538531 0.144938011577
+ CT3 OC312 1 0.326959829558 0.163176000000
+ CT3 OC30P 1 0.326959829558 0.163176000000
+ CT3 PC 1 0.360813980847 0.320014464673
+ CT3 SC 1 0.356359487256 0.286840588481
+ CT3 CC312D 1 0.338541512893 0.041840000000
+ CT3 OC303 1 0.316269044940 0.132309697301
+ CT3 HN1 1 0.189271432669 0.089736802707
+ CT3 HN2 1 0.189271432669 0.089736802707
+ CT3 HN3 1 0.267269615442 0.089736802707
+ CT3 HN4 1 0.189271432669 0.089736802707
+ CT3 HN5 1 0.189271432669 0.089736802707
+ CT3 HN6 1 0.286869387241 0.062058748940
+ CT3 HN7 1 0.286869387241 0.062058748940
+ CT3 HN8 1 0.288651184677 0.070011711020
+ CT3 HN9 1 0.288651184677 0.064818249282
+ CT3 NN1 1 0.334087019303 0.187114168357
+ CT3 NN2 1 0.334087019303 0.187114168357
+ CT3 NN2B 1 0.334087019303 0.187114168357
+ CT3 NN2G 1 0.334087019303 0.187114168357
+ CT3 NN2U 1 0.334087019303 0.187114168357
+ CT3 NN3 1 0.334087019303 0.187114168357
+ CT3 NN3A 1 0.334087019303 0.187114168357
+ CT3 NN3G 1 0.334087019303 0.187114168357
+ CT3 NN4 1 0.334087019303 0.187114168357
+ CT3 NN6 1 0.334087019303 0.187114168357
+ CT3 ON1 1 0.320723538531 0.144938011577
+ CT3 ON1C 1 0.320723538531 0.144938011577
+ CT3 ON2 1 0.326959829558 0.163176000000
+ CT3 ON3 1 0.320723538531 0.144938011577
+ CT3 ON4 1 0.326959829558 0.163176000000
+ CT3 ON5 1 0.326959829558 0.163176000000
+ CT3 ON6 1 0.326959829558 0.163176000000
+ CT3 ON6B 1 0.326959829558 0.163176000000
+ CT3 CN1 1 0.338541512893 0.132309697301
+ CT3 CN1T 1 0.338541512893 0.132309697301
+ CT3 CN2 1 0.338541512893 0.132309697301
+ CT3 CN3 1 0.338541512893 0.125520000000
+ CT3 CN3T 1 0.338541512893 0.125520000000
+ CT3 CN4 1 0.338541512893 0.114583559030
+ CT3 CN5 1 0.338541512893 0.114583559030
+ CT3 CN5G 1 0.338541512893 0.114583559030
+ CT3 CN7 1 0.338541512893 0.041840000000
+ CT3 CN7B 1 0.338541512893 0.041840000000
+ CT3 CN8 1 0.338541512893 0.041840000000
+ CT3 CN8B 1 0.338541512893 0.041840000000
+ CT3 CN9 1 0.338541512893 0.041840000000
+ CT3 P 1 0.360813980847 0.320014464673
+ CT3 P2 1 0.360813980847 0.320014464673
+ CT3 HOL 1 0.189271432669 0.089736802707
+ CT3 HAL1 1 0.286869387241 0.062058748940
+ CT3 HAL2 1 0.288651184677 0.070011711020
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+ CT3 HBL 1 0.286869387241 0.062058748940
+ CT3 HCL 1 0.189271432669 0.089736802707
+ CT3 HL 1 0.231633666716 0.089736802707
+ CT3 HEL1 1 0.280633096214 0.073666921749
+ CT3 HEL2 1 0.281523994932 0.067464972838
+ CT3 CL 1 0.347450500075 0.110698234855
+ CT3 CCL 1 0.347450500075 0.110698234855
+ CT3 CTL1 1 0.338541512893 0.041840000000
+ CT3 CTL2 1 0.338541512893 0.041840000000
+ CT3 CTL3 1 0.338541512893 0.041840000000
+ CT3 CTL5 1 0.338541512893 0.041840000000
+ CT3 CEL1 1 0.355468588538 0.109105371453
+ CT3 CEL2 1 0.354577689820 0.105847757841
+ CT3 CRL1 1 0.338541512893 0.041840000000
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+ CT3 OBL 1 0.293996576986 0.144938011577
+ CT3 OCL 1 0.320723538531 0.144938011577
+ CT3 O2L 1 0.320723538531 0.144938011577
+ CT3 OHL 1 0.326959829558 0.163176000000
+ CT3 OSL 1 0.316269044940 0.132309697301
+ CT3 OSLP 1 0.316269044940 0.132309697301
+ CT3 NH3L 1 0.334087019303 0.187114168357
+ CT3 NTL 1 0.334087019303 0.187114168357
+ CT3 SL 1 0.356359487256 0.286840588481
+ CT3 PL 1 0.360813980847 0.320014464673
+ CT3 HCA1A 1 0.288651184677 0.088756043175
+ CT3 HCA2A 1 0.288651184677 0.078275472531
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+ CT3 CC30A 1 0.338541512893 0.041840000000
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+ CT3 OC305A 1 0.316269044940 0.132309697301
+ CT3 OC30A 1 0.316269044940 0.132309697301
+ CT3 CPA 1 0.329632525712 0.125520000000
+ CT3 CPB 1 0.329632525712 0.125520000000
+ CT3 CPM 1 0.329632525712 0.125520000000
+ CT3 CM 1 0.356359487256 0.138767581228
+ CT3 CST 1 0.308518226092 0.100764063435
+ CT3 NPH 1 0.334087019303 0.187114168357
+ CT3 OM 1 0.320723538531 0.144938011577
+ CT3 OST 1 0.320010819556 0.169954883425
+ CT3 FE 1 0.227179173126 0.000000000000
+ CT3 ON2B 1 0.326959829558 0.163176000000
+ CT3 SP 1 0.365268474438 0.280671252536
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+ HP CC 1 0.299181607526 0.191734967077
+ HP CD 1 0.299181607526 0.191734967077
+ HP CE1 1 0.307199695989 0.188976046736
+ HP CE2 1 0.306308797271 0.183333694448
+ HP CP1 1 0.290272620344 0.072469005789
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+ HP CS 1 0.316999581889 0.240352501131
+ HP CPT 1 0.286709025472 0.228018403468
+ HP CY 1 0.298290708808 0.195800471501
+ HP CAI 1 0.298290708808 0.195800471501
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+ HP H 1 0.141002540120 0.155428701597
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+ HP HP 1 0.242003727796 0.125520000000
+ HP HR1 1 0.201182748530 0.155428701597
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+ HP HR3 1 0.251785795721 0.064002892935
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+ HP N 1 0.285818126754 0.007246900579
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+ HP S 1 0.299181607526 0.486136869616
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+ N OG3C51 1 0.311814551349 0.013230969730
+ N OG3C61 1 0.311814551349 0.013230969730
+ N SG2D1 1 0.347450500075 0.031449656024
+ N SG2R50 1 0.342996006484 0.028067125254
+ N SG311 1 0.342996006484 0.028067125254
+ N SG301 1 0.340768759689 0.025791908188
+ N SG302 1 0.360813980847 0.028684058848
+ N SG3O1 1 0.351904993665 0.028684058848
+ N SG3O2 1 0.342996006484 0.024752877812
+ N SG3O3 1 0.342996006484 0.024752877812
+ N FGA1 1 0.310032753913 0.015372997626
+ N FGA2 1 0.310032753913 0.013557709541
+ N FGA3 1 0.307360057758 0.013030993945
+ N FGP1 1 0.307360057758 0.013030993945
+ N FGR1 1 0.316269044940 0.014493801158
+ N CLGA1 1 0.334977918021 0.024504098857
+ N CLGA3 1 0.334977918021 0.023295526094
+ N CLGR1 1 0.336759715457 0.023668278180
+ N BRGA1 1 0.340323310330 0.028987602315
+ N BRGA2 1 0.347450500075 0.030459979777
+ N BRGA3 1 0.342996006484 0.030745995251
+ N BRGR1 1 0.349232297511 0.027115419082
+ N IGR1 1 0.359923082129 0.031029374470
+ N PG0 1 0.356359487256 0.032001446467
+ N PG1 1 0.356359487256 0.032001446467
+ N PG2 1 0.356359487256 0.032001446467
+ N ALG1 1 0.342996006484 0.033732486419
+ N CC301 1 0.334087019303 0.004184000000
+ N CC3062 1 0.334087019303 0.004184000000
+ N CC311 1 0.334087019303 0.004184000000
+ N CC3161 1 0.334087019303 0.004184000000
+ N CC3162 1 0.334087019303 0.004184000000
+ N CC3163 1 0.334087019303 0.004184000000
+ N CC321 1 0.334087019303 0.004184000000
+ N CC3261 1 0.334087019303 0.004184000000
+ N CC3263 1 0.334087019303 0.004184000000
+ N CC331 1 0.334087019303 0.004184000000
+ N CC2O1 1 0.342996006484 0.013876758123
+ N CC2O2 1 0.342996006484 0.011069823485
+ N CC2O3 1 0.342996006484 0.012552000000
+ N CC2O4 1 0.325178032121 0.010248665084
+ N OC2D1 1 0.289542083396 0.014493801158
+ N OC2D2 1 0.316269044940 0.014493801158
+ N OC2D3 1 0.289542083396 0.014493801158
+ N OC2D4 1 0.289542083396 0.014493801158
+ N OC3C61 1 0.311814551349 0.013230969730
+ N OC311 1 0.322059886608 0.018338143138
+ N NC2D1 1 0.302905564168 0.018711416836
+ N HCP1 1 0.184816939078 0.008973680271
+ N HCA1 1 0.284196691087 0.008875604317
+ N HCA2 1 0.284196691087 0.007827547253
+ N HCA3 1 0.284196691087 0.006481824928
+ N CC312 1 0.334087019303 0.004184000000
+ N CC322 1 0.334087019303 0.004184000000
+ N HCR1 1 0.236088160307 0.008973680271
+ N HCA3M 1 0.284196691087 0.006481824928
+ N CC321C 1 0.334087019303 0.004184000000
+ N CC321D 1 0.334087019303 0.004184000000
+ N CC311C 1 0.334087019303 0.004184000000
+ N CC311D 1 0.334087019303 0.004184000000
+ N OC301 1 0.311814551349 0.013230969730
+ N OC302 1 0.311814551349 0.013230969730
+ N HCP1M 1 0.184816939078 0.008973680271
+ N OC311M 1 0.322059886608 0.018338143138
+ N OC3C5M 1 0.311814551349 0.013230969730
+ N CC322C 1 0.334087019303 0.004184000000
+ N HCA2C2 1 0.280633096214 0.007827547253
+ N CC312C 1 0.334087019303 0.004184000000
+ N HCA1C2 1 0.284196691087 0.008875604317
+ N OC3C51 1 0.311814551349 0.013230969730
+ N CC3152 1 0.334087019303 0.004184000000
+ N CC3051 1 0.334087019303 0.004184000000
+ N CC3251 1 0.334087019303 0.004184000000
+ N CC3151 1 0.334087019303 0.004184000000
+ N CC3153 1 0.334087019303 0.004184000000
+ N OC2DP 1 0.316269044940 0.014493801158
+ N OC312 1 0.322505335967 0.016317600000
+ N OC30P 1 0.322505335967 0.016317600000
+ N PC 1 0.356359487256 0.032001446467
+ N SC 1 0.351904993665 0.028684058848
+ N CC312D 1 0.334087019303 0.004184000000
+ N OC303 1 0.311814551349 0.013230969730
+ N HN1 1 0.184816939078 0.008973680271
+ N HN2 1 0.184816939078 0.008973680271
+ N HN3 1 0.262815121851 0.008973680271
+ N HN4 1 0.184816939078 0.008973680271
+ N HN5 1 0.184816939078 0.008973680271
+ N HN6 1 0.282414893650 0.006205874894
+ N HN7 1 0.282414893650 0.006205874894
+ N HN8 1 0.284196691087 0.007001171102
+ N HN9 1 0.284196691087 0.006481824928
+ N NN1 1 0.329632525712 0.018711416836
+ N NN2 1 0.329632525712 0.018711416836
+ N NN2B 1 0.329632525712 0.018711416836
+ N NN2G 1 0.329632525712 0.018711416836
+ N NN2U 1 0.329632525712 0.018711416836
+ N NN3 1 0.329632525712 0.018711416836
+ N NN3A 1 0.329632525712 0.018711416836
+ N NN3G 1 0.329632525712 0.018711416836
+ N NN4 1 0.329632525712 0.018711416836
+ N NN6 1 0.329632525712 0.018711416836
+ N ON1 1 0.316269044940 0.014493801158
+ N ON1C 1 0.316269044940 0.014493801158
+ N ON2 1 0.322505335967 0.016317600000
+ N ON3 1 0.316269044940 0.014493801158
+ N ON4 1 0.322505335967 0.016317600000
+ N ON5 1 0.322505335967 0.016317600000
+ N ON6 1 0.322505335967 0.016317600000
+ N ON6B 1 0.322505335967 0.016317600000
+ N CN1 1 0.334087019303 0.013230969730
+ N CN1T 1 0.334087019303 0.013230969730
+ N CN2 1 0.334087019303 0.013230969730
+ N CN3 1 0.334087019303 0.012552000000
+ N CN3T 1 0.334087019303 0.012552000000
+ N CN4 1 0.334087019303 0.011458355903
+ N CN5 1 0.334087019303 0.011458355903
+ N CN5G 1 0.334087019303 0.011458355903
+ N CN7 1 0.334087019303 0.004184000000
+ N CN7B 1 0.334087019303 0.004184000000
+ N CN8 1 0.334087019303 0.004184000000
+ N CN8B 1 0.334087019303 0.004184000000
+ N CN9 1 0.334087019303 0.004184000000
+ N P 1 0.356359487256 0.032001446467
+ N P2 1 0.356359487256 0.032001446467
+ N HOL 1 0.184816939078 0.008973680271
+ N HAL1 1 0.282414893650 0.006205874894
+ N HAL2 1 0.284196691087 0.007001171102
+ N HAL3 1 0.284196691087 0.006481824928
+ N HBL 1 0.282414893650 0.006205874894
+ N HCL 1 0.184816939078 0.008973680271
+ N HL 1 0.227179173126 0.008973680271
+ N HEL1 1 0.276178602624 0.007366692175
+ N HEL2 1 0.277069501342 0.006746497284
+ N CL 1 0.342996006484 0.011069823485
+ N CCL 1 0.342996006484 0.011069823485
+ N CTL1 1 0.334087019303 0.004184000000
+ N CTL2 1 0.334087019303 0.004184000000
+ N CTL3 1 0.334087019303 0.004184000000
+ N CTL5 1 0.334087019303 0.004184000000
+ N CEL1 1 0.351014094947 0.010910537145
+ N CEL2 1 0.350123196229 0.010584775784
+ N CRL1 1 0.334087019303 0.004184000000
+ N CRL2 1 0.334087019303 0.004184000000
+ N OBL 1 0.289542083396 0.014493801158
+ N OCL 1 0.316269044940 0.014493801158
+ N O2L 1 0.316269044940 0.014493801158
+ N OHL 1 0.322505335967 0.016317600000
+ N OSL 1 0.311814551349 0.013230969730
+ N OSLP 1 0.311814551349 0.013230969730
+ N NH3L 1 0.329632525712 0.018711416836
+ N NTL 1 0.329632525712 0.018711416836
+ N SL 1 0.351904993665 0.028684058848
+ N PL 1 0.356359487256 0.032001446467
+ N HCA1A 1 0.284196691087 0.008875604317
+ N HCA2A 1 0.284196691087 0.007827547253
+ N HCA3A 1 0.284196691087 0.006481824928
+ N CC30A 1 0.334087019303 0.004184000000
+ N CC31A 1 0.334087019303 0.004184000000
+ N CC32A 1 0.334087019303 0.004184000000
+ N CC33A 1 0.334087019303 0.004184000000
+ N CC326A 1 0.334087019303 0.004184000000
+ N HCA25A 1 0.280633096214 0.007827547253
+ N CC325A 1 0.334087019303 0.004184000000
+ N CC325B 1 0.334087019303 0.004184000000
+ N OC305A 1 0.311814551349 0.013230969730
+ N OC30A 1 0.311814551349 0.013230969730
+ N CPA 1 0.325178032121 0.012552000000
+ N CPB 1 0.325178032121 0.012552000000
+ N CPM 1 0.325178032121 0.012552000000
+ N CM 1 0.351904993665 0.013876758123
+ N CST 1 0.304063732501 0.010076406344
+ N NPH 1 0.329632525712 0.018711416836
+ N OM 1 0.316269044940 0.014493801158
+ N OST 1 0.315556325965 0.016995488342
+ N FE 1 0.222724679535 0.000000000000
+ N ON2B 1 0.322505335967 0.016317600000
+ N SP 1 0.360813980847 0.028067125254
+ NH1 C 1 0.316269044940 0.620587489400
+ NH1 CA 1 0.315591961914 0.495057556250
+ NH1 CC 1 0.316269044940 0.495057556250
+ NH1 CD 1 0.316269044940 0.495057556250
+ NH1 CE1 1 0.324287133403 0.487934054561
+ NH1 CE2 1 0.323396234685 0.473365563598
+ NH1 CP1 1 0.307360057758 0.187114168357
+ NH1 CP2 1 0.307360057758 0.187114168357
+ NH1 CP3 1 0.307360057758 0.187114168357
+ NH1 CPH1 1 0.298451070577 0.418400000000
+ NH1 CPH2 1 0.298451070577 0.418400000000
+ NH1 CS 1 0.334087019303 0.620587489400
+ NH1 CPT 1 0.303796462886 0.588740986173
+ NH1 CY 1 0.315378146222 0.505554643535
+ NH1 CAI 1 0.315378146222 0.505554643535
+ NH1 CT 1 0.307360057758 0.187114168357
+ NH1 CT1 1 0.307360057758 0.187114168357
+ NH1 CT2 1 0.307360057758 0.187114168357
+ NH1 CT2A 1 0.307360057758 0.187114168357
+ NH1 CT3 1 0.307360057758 0.187114168357
+ NH1 H 1 0.158089977534 0.401315181871
+ NH1 HA 1 0.255687932106 0.277535162457
+ NH1 HB1 1 0.255687932106 0.277535162457
+ NH1 HB2 1 0.257469729543 0.313101890125
+ NH1 HE1 1 0.249451641079 0.329448489449
+ NH1 HE2 1 0.250342539797 0.301712530731
+ NH1 HC 1 0.158089977534 0.401315181871
+ NH1 HP 1 0.259091165210 0.324091246411
+ NH1 HR1 1 0.218270185944 0.401315181871
+ NH1 HR2 1 0.200452211582 0.401315181871
+ NH1 HR3 1 0.268873233135 0.165254758963
+ NH1 HS 1 0.178179743628 0.591706954497
+ NH1 HA1 1 0.257469729543 0.396929091904
+ NH1 HA2 1 0.257469729543 0.345021478752
+ NH1 HA3 1 0.257469729543 0.289876023155
+ NH1 N 1 0.302905564168 0.018711416836
+ NH1 NC2 1 0.302905564168 0.836800000000
+ NH1 NH1 1 0.276178602624 0.836800000000
+ NH1 NH2 1 0.302905564168 0.836800000000
+ NH1 NH3 1 0.302905564168 0.836800000000
+ NH1 NP 1 0.302905564168 0.836800000000
+ NH1 NR1 1 0.302905564168 0.836800000000
+ NH1 NR2 1 0.302905564168 0.836800000000
+ NH1 NR3 1 0.302905564168 0.836800000000
+ NH1 NY 1 0.302905564168 0.836800000000
+ NH1 O 1 0.262815121851 0.648182492821
+ NH1 OB 1 0.262815121851 0.648182492821
+ NH1 OC 1 0.289542083396 0.648182492821
+ NH1 OH1 1 0.295778374423 0.729745256593
+ NH1 OS 1 0.295778374423 0.729745256593
+ NH1 S 1 0.316269044940 1.255200000000
+ NH1 SM 1 0.314041798144 1.153449199575
+ NH1 SS 1 0.334087019303 1.282790109098
+ NH1 HT 1 0.158089977534 0.401315181871
+ NH1 OT 1 0.295618012653 0.729745256593
+ NH1 OX 1 0.289542083396 0.648182492821
+ NH1 HX 1 0.158089977534 0.401315181871
+ NH1 LIT 1 0.253683409990 0.090320146678
+ NH1 SOD 1 0.263772837973 0.405222074029
+ NH1 MG 1 0.243660799411 0.229167118060
+ NH1 POT 1 0.295221562724 0.551907505294
+ NH1 CAL 1 0.259875156082 0.648182492821
+ NH1 RUB 1 0.307360057758 0.724690057887
+ NH1 CES 1 0.325178032121 0.815611750774
+ NH1 BAR 1 0.306469159040 0.724690057887
+ NH1 ZN 1 0.235197261589 0.935570841786
+ NH1 CAD 1 0.258984257363 0.648182492821
+ NH1 CLA 1 0.340323310330 0.724690057887
+ NH1 HGA1 1 0.257469729543 0.396929091904
+ NH1 HGA2 1 0.257469729543 0.350058555102
+ NH1 HGA3 1 0.257469729543 0.289876023155
+ NH1 HGA4 1 0.249451641079 0.329448489449
+ NH1 HGA5 1 0.250342539797 0.301712530731
+ NH1 HGA6 1 0.255687932106 0.313101890125
+ NH1 HGA7 1 0.253906134670 0.324091246411
+ NH1 HGAAM0 1 0.252124337234 0.313101890125
+ NH1 HGAAM1 1 0.252124337234 0.313101890125
+ NH1 HGAAM2 1 0.250342539797 0.374228336714
+ NH1 HGP1 1 0.158089977534 0.401315181871
+ NH1 HGP2 1 0.158089977534 0.401315181871
+ NH1 HGP3 1 0.178179743628 0.591706954497
+ NH1 HGP4 1 0.158089977534 0.401315181871
+ NH1 HGP5 1 0.200452211582 0.401315181871
+ NH1 HGPAM1 1 0.216042939149 0.177512086349
+ NH1 HGPAM2 1 0.216042939149 0.187114168357
+ NH1 HGPAM3 1 0.215597489790 0.204973301676
+ NH1 HGR51 1 0.259091165210 0.324091246411
+ NH1 HGR52 1 0.218270185944 0.401315181871
+ NH1 HGR53 1 0.200452211582 0.401315181871
+ NH1 HGR61 1 0.259091165210 0.324091246411
+ NH1 HGR62 1 0.236088160307 0.401315181871
+ NH1 HGR63 1 0.218270185944 0.401315181871
+ NH1 HGR71 1 0.259091165210 0.324091246411
+ NH1 CG1T1 1 0.302014665450 0.764653902364
+ NH1 CG1T2 1 0.315600870901 0.601099715388
+ NH1 CG1N1 1 0.304687361604 0.793858183809
+ NH1 CG2D1 1 0.324287133403 0.487934054561
+ NH1 CG2D2 1 0.323396234685 0.473365563598
+ NH1 CG2D1O 1 0.324287133403 0.487934054561
+ NH1 CG2D2O 1 0.324287133403 0.487934054561
+ NH1 CG2DC1 1 0.324287133403 0.487934054561
+ NH1 CG2DC2 1 0.324287133403 0.487934054561
+ NH1 CG2DC3 1 0.323396234685 0.473365563598
+ NH1 CG25C1 1 0.324287133403 0.487934054561
+ NH1 CG25C2 1 0.324287133403 0.487934054561
+ NH1 CG251O 1 0.324287133403 0.487934054561
+ NH1 CG252O 1 0.324287133403 0.487934054561
+ NH1 CG2N1 1 0.316269044940 0.620587489400
+ NH1 CG2N2 1 0.316269044940 0.620587489400
+ NH1 CG2O1 1 0.316269044940 0.620587489400
+ NH1 CG2O2 1 0.289542083396 0.585760000000
+ NH1 CG2O3 1 0.316269044940 0.495057556250
+ NH1 CG2O4 1 0.298451070577 0.458334236120
+ NH1 CG2O5 1 0.316269044940 0.561342505072
+ NH1 CG2O6 1 0.316269044940 0.495057556250
+ NH1 CG2O7 1 0.277336770957 0.450630591061
+ NH1 CG2R51 1 0.325178032121 0.418400000000
+ NH1 CG2R52 1 0.334087019303 0.264619394603
+ NH1 CG2R53 1 0.334087019303 0.264619394603
+ NH1 CG2R57 1 0.325178032121 0.418400000000
+ NH1 CG2R61 1 0.315591961914 0.495057556250
+ NH1 CG2R62 1 0.307360057758 0.561342505072
+ NH1 CG2R63 1 0.307360057758 0.591706954497
+ NH1 CG2R64 1 0.325178032121 0.374228336714
+ NH1 CG2R66 1 0.307360057758 0.495057556250
+ NH1 CG2R67 1 0.315591961914 0.495057556250
+ NH1 CG2RC0 1 0.303796462886 0.588740986173
+ NH1 CG2R71 1 0.315805777606 0.484333016013
+ NH1 CG2RC7 1 0.303796462886 0.588740986173
+ NH1 CG301 1 0.307360057758 0.187114168357
+ NH1 CG302 1 0.342996006484 0.264619394603
+ NH1 CG311 1 0.307360057758 0.187114168357
+ NH1 CG312 1 0.320723538531 0.383469934154
+ NH1 CG314 1 0.307360057758 0.187114168357
+ NH1 CG321 1 0.307360057758 0.187114168357
+ NH1 CG322 1 0.307360057758 0.458334236120
+ NH1 CG323 1 0.334087019303 0.620587489400
+ NH1 CG324 1 0.307360057758 0.187114168357
+ NH1 CG331 1 0.307360057758 0.187114168357
+ NH1 CG334 1 0.307360057758 0.187114168357
+ NH1 CG3C50 1 0.307360057758 0.187114168357
+ NH1 CG3C51 1 0.307360057758 0.187114168357
+ NH1 CG3C52 1 0.307360057758 0.187114168357
+ NH1 CG3C53 1 0.307360057758 0.187114168357
+ NH1 CG3C54 1 0.307360057758 0.187114168357
+ NH1 CG3C31 1 0.307360057758 0.187114168357
+ NH1 CG3C41 1 0.307360057758 0.187114168357
+ NH1 CG3RC1 1 0.307360057758 0.187114168357
+ NH1 CG3AM0 1 0.313596348785 0.495057556250
+ NH1 CG3AM1 1 0.314487247504 0.522581432506
+ NH1 CG3AM2 1 0.315378146222 0.529238789206
+ NH1 NG1T1 1 0.297560171859 0.793858183809
+ NH1 NG2D1 1 0.302905564168 0.836800000000
+ NH1 NG2S0 1 0.302905564168 0.018711416836
+ NH1 NG2S1 1 0.276178602624 0.836800000000
+ NH1 NG2S2 1 0.302905564168 0.836800000000
+ NH1 NG2S3 1 0.302905564168 0.836800000000
+ NH1 NG2O1 1 0.302905564168 0.836800000000
+ NH1 NG2P1 1 0.302905564168 0.836800000000
+ NH1 NG2R43 1 0.302905564168 0.836800000000
+ NH1 NG2R50 1 0.302905564168 0.836800000000
+ NH1 NG2R51 1 0.302905564168 0.836800000000
+ NH1 NG2R52 1 0.302905564168 0.836800000000
+ NH1 NG2R53 1 0.302905564168 0.836800000000
+ NH1 NG2R57 1 0.302905564168 0.836800000000
+ NH1 NG2R60 1 0.306469159040 0.458334236120
+ NH1 NG2R61 1 0.302905564168 0.836800000000
+ NH1 NG2R62 1 0.321614437249 0.418400000000
+ NH1 NG2R67 1 0.302905564168 0.836800000000
+ NH1 NG2RC0 1 0.302905564168 0.836800000000
+ NH1 NG301 1 0.316269044940 0.350058555102
+ NH1 NG311 1 0.316269044940 0.396929091904
+ NH1 NG321 1 0.315378146222 0.458334236120
+ NH1 NG331 1 0.314487247504 0.495057556250
+ NH1 NG3C51 1 0.302905564168 0.836800000000
+ NH1 NG3N1 1 0.320723538531 0.458334236120
+ NH1 NG3P0 1 0.302905564168 0.836800000000
+ NH1 NG3P1 1 0.302905564168 0.836800000000
+ NH1 NG3P2 1 0.302905564168 0.836800000000
+ NH1 NG3P3 1 0.302905564168 0.836800000000
+ NH1 OG2D1 1 0.262815121851 0.648182492821
+ NH1 OG2D2 1 0.289542083396 0.648182492821
+ NH1 OG2D3 1 0.262815121851 0.648182492821
+ NH1 OG2D4 1 0.289542083396 0.648182492821
+ NH1 OG2D5 1 0.288829364421 0.760061344893
+ NH1 OG2N1 1 0.289542083396 0.648182492821
+ NH1 OG2P1 1 0.289542083396 0.648182492821
+ NH1 OG2R50 1 0.289542083396 0.648182492821
+ NH1 OG3R60 1 0.285087589805 0.591706954497
+ NH1 OG301 1 0.285087589805 0.591706954497
+ NH1 OG302 1 0.285087589805 0.591706954497
+ NH1 OG303 1 0.285087589805 0.591706954497
+ NH1 OG304 1 0.285087589805 0.591706954497
+ NH1 OG311 1 0.295332925064 0.820106692766
+ NH1 OG312 1 0.293996576986 0.648182492821
+ NH1 OG3C31 1 0.285087589805 0.591706954497
+ NH1 OG3C51 1 0.285087589805 0.591706954497
+ NH1 OG3C61 1 0.285087589805 0.591706954497
+ NH1 SG2D1 1 0.320723538531 1.406471374753
+ NH1 SG2R50 1 0.316269044940 1.255200000000
+ NH1 SG311 1 0.316269044940 1.255200000000
+ NH1 SG301 1 0.314041798144 1.153449199575
+ NH1 SG302 1 0.334087019303 1.282790109098
+ NH1 SG3O1 1 0.325178032121 1.282790109098
+ NH1 SG3O2 1 0.316269044940 1.106982348549
+ NH1 SG3O3 1 0.316269044940 1.106982348549
+ NH1 FGA1 1 0.283305792369 0.687501354180
+ NH1 FGA2 1 0.283305792369 0.606319203061
+ NH1 FGA3 1 0.280633096214 0.582763765517
+ NH1 FGP1 1 0.280633096214 0.582763765517
+ NH1 FGR1 1 0.289542083396 0.648182492821
+ NH1 CLGA1 1 0.308250956477 1.095856615438
+ NH1 CLGA3 1 0.308250956477 1.041807598360
+ NH1 CLGR1 1 0.310032753913 1.058477578412
+ NH1 BRGA1 1 0.313596348785 1.296364985643
+ NH1 BRGA2 1 0.320723538531 1.362211707482
+ NH1 BRGA3 1 0.316269044940 1.375002708361
+ NH1 BRGR1 1 0.322505335967 1.212638406121
+ NH1 IGR1 1 0.333196120584 1.387675812285
+ NH1 PG0 1 0.329632525712 1.431148193584
+ NH1 PG1 1 0.329632525712 1.431148193584
+ NH1 PG2 1 0.329632525712 1.431148193584
+ NH1 ALG1 1 0.316269044940 1.508562653654
+ NH1 CC301 1 0.307360057758 0.187114168357
+ NH1 CC3062 1 0.307360057758 0.187114168357
+ NH1 CC311 1 0.307360057758 0.187114168357
+ NH1 CC3161 1 0.307360057758 0.187114168357
+ NH1 CC3162 1 0.307360057758 0.187114168357
+ NH1 CC3163 1 0.307360057758 0.187114168357
+ NH1 CC321 1 0.307360057758 0.187114168357
+ NH1 CC3261 1 0.307360057758 0.187114168357
+ NH1 CC3263 1 0.307360057758 0.187114168357
+ NH1 CC331 1 0.307360057758 0.187114168357
+ NH1 CC2O1 1 0.316269044940 0.620587489400
+ NH1 CC2O2 1 0.316269044940 0.495057556250
+ NH1 CC2O3 1 0.316269044940 0.561342505072
+ NH1 CC2O4 1 0.298451070577 0.458334236120
+ NH1 OC2D1 1 0.262815121851 0.648182492821
+ NH1 OC2D2 1 0.289542083396 0.648182492821
+ NH1 OC2D3 1 0.262815121851 0.648182492821
+ NH1 OC2D4 1 0.262815121851 0.648182492821
+ NH1 OC3C61 1 0.285087589805 0.591706954497
+ NH1 OC311 1 0.295332925064 0.820106692766
+ NH1 NC2D1 1 0.276178602624 0.836800000000
+ NH1 HCP1 1 0.158089977534 0.401315181871
+ NH1 HCA1 1 0.257469729543 0.396929091904
+ NH1 HCA2 1 0.257469729543 0.350058555102
+ NH1 HCA3 1 0.257469729543 0.289876023155
+ NH1 CC312 1 0.307360057758 0.187114168357
+ NH1 CC322 1 0.307360057758 0.187114168357
+ NH1 HCR1 1 0.209361198763 0.401315181871
+ NH1 HCA3M 1 0.257469729543 0.289876023155
+ NH1 CC321C 1 0.307360057758 0.187114168357
+ NH1 CC321D 1 0.307360057758 0.187114168357
+ NH1 CC311C 1 0.307360057758 0.187114168357
+ NH1 CC311D 1 0.307360057758 0.187114168357
+ NH1 OC301 1 0.285087589805 0.591706954497
+ NH1 OC302 1 0.285087589805 0.591706954497
+ NH1 HCP1M 1 0.158089977534 0.401315181871
+ NH1 OC311M 1 0.295332925064 0.820106692766
+ NH1 OC3C5M 1 0.285087589805 0.591706954497
+ NH1 CC322C 1 0.307360057758 0.187114168357
+ NH1 HCA2C2 1 0.253906134670 0.350058555102
+ NH1 CC312C 1 0.307360057758 0.187114168357
+ NH1 HCA1C2 1 0.257469729543 0.396929091904
+ NH1 OC3C51 1 0.285087589805 0.591706954497
+ NH1 CC3152 1 0.307360057758 0.187114168357
+ NH1 CC3051 1 0.307360057758 0.187114168357
+ NH1 CC3251 1 0.307360057758 0.187114168357
+ NH1 CC3151 1 0.307360057758 0.187114168357
+ NH1 CC3153 1 0.307360057758 0.187114168357
+ NH1 OC2DP 1 0.289542083396 0.648182492821
+ NH1 OC312 1 0.295778374423 0.729745256593
+ NH1 OC30P 1 0.295778374423 0.729745256593
+ NH1 PC 1 0.329632525712 1.431148193584
+ NH1 SC 1 0.325178032121 1.282790109098
+ NH1 CC312D 1 0.307360057758 0.187114168357
+ NH1 OC303 1 0.285087589805 0.591706954497
+ NH1 HN1 1 0.158089977534 0.401315181871
+ NH1 HN2 1 0.158089977534 0.401315181871
+ NH1 HN3 1 0.236088160307 0.401315181871
+ NH1 HN4 1 0.158089977534 0.401315181871
+ NH1 HN5 1 0.158089977534 0.401315181871
+ NH1 HN6 1 0.255687932106 0.277535162457
+ NH1 HN7 1 0.255687932106 0.277535162457
+ NH1 HN8 1 0.257469729543 0.313101890125
+ NH1 HN9 1 0.257469729543 0.289876023155
+ NH1 NN1 1 0.302905564168 0.836800000000
+ NH1 NN2 1 0.302905564168 0.836800000000
+ NH1 NN2B 1 0.302905564168 0.836800000000
+ NH1 NN2G 1 0.302905564168 0.836800000000
+ NH1 NN2U 1 0.302905564168 0.836800000000
+ NH1 NN3 1 0.302905564168 0.836800000000
+ NH1 NN3A 1 0.302905564168 0.836800000000
+ NH1 NN3G 1 0.302905564168 0.836800000000
+ NH1 NN4 1 0.302905564168 0.836800000000
+ NH1 NN6 1 0.302905564168 0.836800000000
+ NH1 ON1 1 0.289542083396 0.648182492821
+ NH1 ON1C 1 0.289542083396 0.648182492821
+ NH1 ON2 1 0.295778374423 0.729745256593
+ NH1 ON3 1 0.289542083396 0.648182492821
+ NH1 ON4 1 0.295778374423 0.729745256593
+ NH1 ON5 1 0.295778374423 0.729745256593
+ NH1 ON6 1 0.295778374423 0.729745256593
+ NH1 ON6B 1 0.295778374423 0.729745256593
+ NH1 CN1 1 0.307360057758 0.591706954497
+ NH1 CN1T 1 0.307360057758 0.591706954497
+ NH1 CN2 1 0.307360057758 0.591706954497
+ NH1 CN3 1 0.307360057758 0.561342505072
+ NH1 CN3T 1 0.307360057758 0.561342505072
+ NH1 CN4 1 0.307360057758 0.512433254190
+ NH1 CN5 1 0.307360057758 0.512433254190
+ NH1 CN5G 1 0.307360057758 0.512433254190
+ NH1 CN7 1 0.307360057758 0.187114168357
+ NH1 CN7B 1 0.307360057758 0.187114168357
+ NH1 CN8 1 0.307360057758 0.187114168357
+ NH1 CN8B 1 0.307360057758 0.187114168357
+ NH1 CN9 1 0.307360057758 0.187114168357
+ NH1 P 1 0.329632525712 1.431148193584
+ NH1 P2 1 0.329632525712 1.431148193584
+ NH1 HOL 1 0.158089977534 0.401315181871
+ NH1 HAL1 1 0.255687932106 0.277535162457
+ NH1 HAL2 1 0.257469729543 0.313101890125
+ NH1 HAL3 1 0.257469729543 0.289876023155
+ NH1 HBL 1 0.255687932106 0.277535162457
+ NH1 HCL 1 0.158089977534 0.401315181871
+ NH1 HL 1 0.200452211582 0.401315181871
+ NH1 HEL1 1 0.249451641079 0.329448489449
+ NH1 HEL2 1 0.250342539797 0.301712530731
+ NH1 CL 1 0.316269044940 0.495057556250
+ NH1 CCL 1 0.316269044940 0.495057556250
+ NH1 CTL1 1 0.307360057758 0.187114168357
+ NH1 CTL2 1 0.307360057758 0.187114168357
+ NH1 CTL3 1 0.307360057758 0.187114168357
+ NH1 CTL5 1 0.307360057758 0.187114168357
+ NH1 CEL1 1 0.324287133403 0.487934054561
+ NH1 CEL2 1 0.323396234685 0.473365563598
+ NH1 CRL1 1 0.307360057758 0.187114168357
+ NH1 CRL2 1 0.307360057758 0.187114168357
+ NH1 OBL 1 0.262815121851 0.648182492821
+ NH1 OCL 1 0.289542083396 0.648182492821
+ NH1 O2L 1 0.289542083396 0.648182492821
+ NH1 OHL 1 0.295778374423 0.729745256593
+ NH1 OSL 1 0.285087589805 0.591706954497
+ NH1 OSLP 1 0.285087589805 0.591706954497
+ NH1 NH3L 1 0.302905564168 0.836800000000
+ NH1 NTL 1 0.302905564168 0.836800000000
+ NH1 SL 1 0.325178032121 1.282790109098
+ NH1 PL 1 0.329632525712 1.431148193584
+ NH1 HCA1A 1 0.257469729543 0.396929091904
+ NH1 HCA2A 1 0.257469729543 0.350058555102
+ NH1 HCA3A 1 0.257469729543 0.289876023155
+ NH1 CC30A 1 0.307360057758 0.187114168357
+ NH1 CC31A 1 0.307360057758 0.187114168357
+ NH1 CC32A 1 0.307360057758 0.187114168357
+ NH1 CC33A 1 0.307360057758 0.187114168357
+ NH1 CC326A 1 0.307360057758 0.187114168357
+ NH1 HCA25A 1 0.253906134670 0.350058555102
+ NH1 CC325A 1 0.307360057758 0.187114168357
+ NH1 CC325B 1 0.307360057758 0.187114168357
+ NH1 OC305A 1 0.285087589805 0.591706954497
+ NH1 OC30A 1 0.285087589805 0.591706954497
+ NH1 CPA 1 0.298451070577 0.561342505072
+ NH1 CPB 1 0.298451070577 0.561342505072
+ NH1 CPM 1 0.298451070577 0.561342505072
+ NH1 CM 1 0.325178032121 0.620587489400
+ NH1 CST 1 0.277336770957 0.450630591061
+ NH1 NPH 1 0.302905564168 0.836800000000
+ NH1 OM 1 0.289542083396 0.648182492821
+ NH1 OST 1 0.288829364421 0.760061344893
+ NH1 FE 1 0.195997717991 0.000000000000
+ NH1 ON2B 1 0.295778374423 0.729745256593
+ NH1 SP 1 0.334087019303 1.255200000000
+ O C 1 0.302905564168 0.480705002262
+ O CA 1 0.302228481142 0.383469934154
+ O CC 1 0.302905564168 0.383469934154
+ O CD 1 0.302905564168 0.383469934154
+ O CE1 1 0.310923652631 0.377952093472
+ O CE2 1 0.310032753913 0.366667388896
+ O CP1 1 0.293996576986 0.144938011577
+ O CP2 1 0.293996576986 0.144938011577
+ O CP3 1 0.293996576986 0.144938011577
+ O CPH1 1 0.285087589805 0.324091246411
+ O CPH2 1 0.285087589805 0.324091246411
+ O CS 1 0.320723538531 0.480705002262
+ O CPT 1 0.290432982114 0.456036806936
+ O CY 1 0.302014665450 0.391600943002
+ O CAI 1 0.302014665450 0.391600943002
+ O CT 1 0.293996576986 0.144938011577
+ O CT1 1 0.293996576986 0.144938011577
+ O CT2 1 0.293996576986 0.144938011577
+ O CT2A 1 0.293996576986 0.144938011577
+ O CT3 1 0.293996576986 0.144938011577
+ O H 1 0.144726496762 0.310857403193
+ O HA 1 0.242324451334 0.214977812437
+ O HB1 1 0.242324451334 0.214977812437
+ O HB2 1 0.244106248770 0.242527681224
+ O HE1 1 0.236088160307 0.255189702614
+ O HE2 1 0.236979059025 0.233705521373
+ O HC 1 0.144726496762 0.310857403193
+ O HP 1 0.245727684437 0.251040000000
+ O HR1 1 0.204906705172 0.310857403193
+ O HR2 1 0.187088730809 0.310857403193
+ O HR3 1 0.255509752363 0.128005785869
+ O HS 1 0.164816262856 0.458334236120
+ O HA1 1 0.244106248770 0.307459952514
+ O HA2 1 0.244106248770 0.267252488258
+ O HA3 1 0.244106248770 0.224537002029
+ O N 1 0.289542083396 0.014493801158
+ O NC2 1 0.289542083396 0.648182492821
+ O NH1 1 0.262815121851 0.648182492821
+ O NH2 1 0.289542083396 0.648182492821
+ O NH3 1 0.289542083396 0.648182492821
+ O NP 1 0.289542083396 0.648182492821
+ O NR1 1 0.289542083396 0.648182492821
+ O NR2 1 0.289542083396 0.648182492821
+ O NR3 1 0.289542083396 0.648182492821
+ O NY 1 0.289542083396 0.648182492821
+ O O 1 0.249451641079 0.502080000000
+ O OB 1 0.249451641079 0.502080000000
+ O OC 1 0.276178602624 0.502080000000
+ O OH1 1 0.282414893650 0.565258245152
+ O OS 1 0.282414893650 0.565258245152
+ O S 1 0.302905564168 0.972273739232
+ O SM 1 0.300678317372 0.893457908130
+ O SS 1 0.320723538531 0.993644945843
+ O HT 1 0.144726496762 0.310857403193
+ O OT 1 0.282254531881 0.565258245152
+ O OX 1 0.276178602624 0.502080000000
+ O HX 1 0.144726496762 0.310857403193
+ O LIT 1 0.240319929218 0.069961684782
+ O SOD 1 0.250409357201 0.313883668846
+ O MG 1 0.230297318639 0.177512086349
+ O POT 1 0.281858081952 0.427505715330
+ O CAL 1 0.246511675309 0.502080000000
+ O RUB 1 0.293996576986 0.561342505072
+ O CES 1 0.311814551349 0.631770145543
+ O BAR 1 0.293105678268 0.561342505072
+ O ZN 1 0.221833780817 0.724690057887
+ O CAD 1 0.245620776591 0.502080000000
+ O CLA 1 0.326959829558 0.561342505072
+ O HGA1 1 0.244106248770 0.307459952514
+ O HGA2 1 0.244106248770 0.271154190821
+ O HGA3 1 0.244106248770 0.224537002029
+ O HGA4 1 0.236088160307 0.255189702614
+ O HGA5 1 0.236979059025 0.233705521373
+ O HGA6 1 0.242324451334 0.242527681224
+ O HGA7 1 0.240542653898 0.251040000000
+ O HGAAM0 1 0.238760856462 0.242527681224
+ O HGAAM1 1 0.238760856462 0.242527681224
+ O HGAAM2 1 0.236979059025 0.289876023155
+ O HGP1 1 0.144726496762 0.310857403193
+ O HGP2 1 0.144726496762 0.310857403193
+ O HGP3 1 0.164816262856 0.458334236120
+ O HGP4 1 0.144726496762 0.310857403193
+ O HGP5 1 0.187088730809 0.310857403193
+ O HGPAM1 1 0.202679458377 0.137500270836
+ O HGPAM2 1 0.202679458377 0.144938011577
+ O HGPAM3 1 0.202234009018 0.158771636762
+ O HGR51 1 0.245727684437 0.251040000000
+ O HGR52 1 0.204906705172 0.310857403193
+ O HGR53 1 0.187088730809 0.310857403193
+ O HGR61 1 0.245727684437 0.251040000000
+ O HGR62 1 0.222724679535 0.310857403193
+ O HGR63 1 0.204906705172 0.310857403193
+ O HGR71 1 0.245727684437 0.251040000000
+ O CG1T1 1 0.288651184677 0.592298365893
+ O CG1T2 1 0.302237390129 0.465609837422
+ O CG1N1 1 0.291323880832 0.614919905028
+ O CG2D1 1 0.310923652631 0.377952093472
+ O CG2D2 1 0.310032753913 0.366667388896
+ O CG2D1O 1 0.310923652631 0.377952093472
+ O CG2D2O 1 0.310923652631 0.377952093472
+ O CG2DC1 1 0.310923652631 0.377952093472
+ O CG2DC2 1 0.310923652631 0.377952093472
+ O CG2DC3 1 0.310032753913 0.366667388896
+ O CG25C1 1 0.310923652631 0.377952093472
+ O CG25C2 1 0.310923652631 0.377952093472
+ O CG251O 1 0.310923652631 0.377952093472
+ O CG252O 1 0.310923652631 0.377952093472
+ O CG2N1 1 0.302905564168 0.480705002262
+ O CG2N2 1 0.302905564168 0.480705002262
+ O CG2O1 1 0.302905564168 0.480705002262
+ O CG2O2 1 0.276178602624 0.453727744975
+ O CG2O3 1 0.302905564168 0.383469934154
+ O CG2O4 1 0.285087589805 0.355024172698
+ O CG2O5 1 0.302905564168 0.434814034732
+ O CG2O6 1 0.302905564168 0.383469934154
+ O CG2O7 1 0.263973290185 0.349056954894
+ O CG2R51 1 0.311814551349 0.324091246411
+ O CG2R52 1 0.320723538531 0.204973301676
+ O CG2R53 1 0.320723538531 0.204973301676
+ O CG2R57 1 0.311814551349 0.324091246411
+ O CG2R61 1 0.302228481142 0.383469934154
+ O CG2R62 1 0.293996576986 0.434814034732
+ O CG2R63 1 0.293996576986 0.458334236120
+ O CG2R64 1 0.311814551349 0.289876023155
+ O CG2R66 1 0.293996576986 0.383469934154
+ O CG2R67 1 0.302228481142 0.383469934154
+ O CG2RC0 1 0.290432982114 0.456036806936
+ O CG2R71 1 0.302442296834 0.375162741007
+ O CG2RC7 1 0.290432982114 0.456036806936
+ O CG301 1 0.293996576986 0.144938011577
+ O CG302 1 0.329632525712 0.204973301676
+ O CG311 1 0.293996576986 0.144938011577
+ O CG312 1 0.307360057758 0.297034533750
+ O CG314 1 0.293996576986 0.144938011577
+ O CG321 1 0.293996576986 0.144938011577
+ O CG322 1 0.293996576986 0.355024172698
+ O CG323 1 0.320723538531 0.480705002262
+ O CG324 1 0.293996576986 0.144938011577
+ O CG331 1 0.293996576986 0.144938011577
+ O CG334 1 0.293996576986 0.144938011577
+ O CG3C50 1 0.293996576986 0.144938011577
+ O CG3C51 1 0.293996576986 0.144938011577
+ O CG3C52 1 0.293996576986 0.144938011577
+ O CG3C53 1 0.293996576986 0.144938011577
+ O CG3C54 1 0.293996576986 0.144938011577
+ O CG3C31 1 0.293996576986 0.144938011577
+ O CG3C41 1 0.293996576986 0.144938011577
+ O CG3RC1 1 0.293996576986 0.144938011577
+ O CG3AM0 1 0.300232868013 0.383469934154
+ O CG3AM1 1 0.301123766731 0.404789837027
+ O CG3AM2 1 0.302014665450 0.409946603352
+ O NG1T1 1 0.284196691087 0.614919905028
+ O NG2D1 1 0.289542083396 0.648182492821
+ O NG2S0 1 0.289542083396 0.014493801158
+ O NG2S1 1 0.262815121851 0.648182492821
+ O NG2S2 1 0.289542083396 0.648182492821
+ O NG2S3 1 0.289542083396 0.648182492821
+ O NG2O1 1 0.289542083396 0.648182492821
+ O NG2P1 1 0.289542083396 0.648182492821
+ O NG2R43 1 0.289542083396 0.648182492821
+ O NG2R50 1 0.289542083396 0.648182492821
+ O NG2R51 1 0.289542083396 0.648182492821
+ O NG2R52 1 0.289542083396 0.648182492821
+ O NG2R53 1 0.289542083396 0.648182492821
+ O NG2R57 1 0.289542083396 0.648182492821
+ O NG2R60 1 0.293105678268 0.355024172698
+ O NG2R61 1 0.289542083396 0.648182492821
+ O NG2R62 1 0.308250956477 0.324091246411
+ O NG2R67 1 0.289542083396 0.648182492821
+ O NG2RC0 1 0.289542083396 0.648182492821
+ O NG301 1 0.302905564168 0.271154190821
+ O NG311 1 0.302905564168 0.307459952514
+ O NG321 1 0.302014665450 0.355024172698
+ O NG331 1 0.301123766731 0.383469934154
+ O NG3C51 1 0.289542083396 0.648182492821
+ O NG3N1 1 0.307360057758 0.355024172698
+ O NG3P0 1 0.289542083396 0.648182492821
+ O NG3P1 1 0.289542083396 0.648182492821
+ O NG3P2 1 0.289542083396 0.648182492821
+ O NG3P3 1 0.289542083396 0.648182492821
+ O OG2D1 1 0.249451641079 0.502080000000
+ O OG2D2 1 0.276178602624 0.502080000000
+ O OG2D3 1 0.249451641079 0.502080000000
+ O OG2D4 1 0.276178602624 0.502080000000
+ O OG2D5 1 0.275465883649 0.588740986173
+ O OG2N1 1 0.276178602624 0.502080000000
+ O OG2P1 1 0.276178602624 0.502080000000
+ O OG2R50 1 0.276178602624 0.502080000000
+ O OG3R60 1 0.271724109033 0.458334236120
+ O OG301 1 0.271724109033 0.458334236120
+ O OG302 1 0.271724109033 0.458334236120
+ O OG303 1 0.271724109033 0.458334236120
+ O OG304 1 0.271724109033 0.458334236120
+ O OG311 1 0.281969444291 0.635251912639
+ O OG312 1 0.280633096214 0.502080000000
+ O OG3C31 1 0.271724109033 0.458334236120
+ O OG3C51 1 0.271724109033 0.458334236120
+ O OG3C61 1 0.271724109033 0.458334236120
+ O SG2D1 1 0.307360057758 1.089448042267
+ O SG2R50 1 0.302905564168 0.972273739232
+ O SG311 1 0.302905564168 0.972273739232
+ O SG301 1 0.300678317372 0.893457908130
+ O SG302 1 0.320723538531 0.993644945843
+ O SG3O1 1 0.311814551349 0.993644945843
+ O SG3O2 1 0.302905564168 0.857464840095
+ O SG3O3 1 0.302905564168 0.857464840095
+ O FGA1 1 0.269942311597 0.532536259047
+ O FGA2 1 0.269942311597 0.469652835188
+ O FGA3 1 0.267269615442 0.451406871724
+ O FGP1 1 0.267269615442 0.451406871724
+ O FGR1 1 0.276178602624 0.502080000000
+ O CLGA1 1 0.294887475704 0.848846884285
+ O CLGA3 1 0.294887475704 0.806980695680
+ O CLGR1 1 0.296669273141 0.819893206704
+ O BRGA1 1 0.300232868013 1.004160000000
+ O BRGA2 1 0.307360057758 1.055164651417
+ O BRGA3 1 0.302905564168 1.065072518094
+ O BRGR1 1 0.309141855195 0.939305670376
+ O IGR1 1 0.319832639812 1.074889062183
+ O PG0 1 0.316269044940 1.108562623941
+ O PG1 1 0.316269044940 1.108562623941
+ O PG2 1 0.316269044940 1.108562623941
+ O ALG1 1 0.302905564168 1.168527606863
+ O CC301 1 0.293996576986 0.144938011577
+ O CC3062 1 0.293996576986 0.144938011577
+ O CC311 1 0.293996576986 0.144938011577
+ O CC3161 1 0.293996576986 0.144938011577
+ O CC3162 1 0.293996576986 0.144938011577
+ O CC3163 1 0.293996576986 0.144938011577
+ O CC321 1 0.293996576986 0.144938011577
+ O CC3261 1 0.293996576986 0.144938011577
+ O CC3263 1 0.293996576986 0.144938011577
+ O CC331 1 0.293996576986 0.144938011577
+ O CC2O1 1 0.302905564168 0.480705002262
+ O CC2O2 1 0.302905564168 0.383469934154
+ O CC2O3 1 0.302905564168 0.434814034732
+ O CC2O4 1 0.285087589805 0.355024172698
+ O OC2D1 1 0.249451641079 0.502080000000
+ O OC2D2 1 0.276178602624 0.502080000000
+ O OC2D3 1 0.249451641079 0.502080000000
+ O OC2D4 1 0.249451641079 0.502080000000
+ O OC3C61 1 0.271724109033 0.458334236120
+ O OC311 1 0.281969444291 0.635251912639
+ O NC2D1 1 0.262815121851 0.648182492821
+ O HCP1 1 0.144726496762 0.310857403193
+ O HCA1 1 0.244106248770 0.307459952514
+ O HCA2 1 0.244106248770 0.271154190821
+ O HCA3 1 0.244106248770 0.224537002029
+ O CC312 1 0.293996576986 0.144938011577
+ O CC322 1 0.293996576986 0.144938011577
+ O HCR1 1 0.195997717991 0.310857403193
+ O HCA3M 1 0.244106248770 0.224537002029
+ O CC321C 1 0.293996576986 0.144938011577
+ O CC321D 1 0.293996576986 0.144938011577
+ O CC311C 1 0.293996576986 0.144938011577
+ O CC311D 1 0.293996576986 0.144938011577
+ O OC301 1 0.271724109033 0.458334236120
+ O OC302 1 0.271724109033 0.458334236120
+ O HCP1M 1 0.144726496762 0.310857403193
+ O OC311M 1 0.281969444291 0.635251912639
+ O OC3C5M 1 0.271724109033 0.458334236120
+ O CC322C 1 0.293996576986 0.144938011577
+ O HCA2C2 1 0.240542653898 0.271154190821
+ O CC312C 1 0.293996576986 0.144938011577
+ O HCA1C2 1 0.244106248770 0.307459952514
+ O OC3C51 1 0.271724109033 0.458334236120
+ O CC3152 1 0.293996576986 0.144938011577
+ O CC3051 1 0.293996576986 0.144938011577
+ O CC3251 1 0.293996576986 0.144938011577
+ O CC3151 1 0.293996576986 0.144938011577
+ O CC3153 1 0.293996576986 0.144938011577
+ O OC2DP 1 0.276178602624 0.502080000000
+ O OC312 1 0.282414893650 0.565258245152
+ O OC30P 1 0.282414893650 0.565258245152
+ O PC 1 0.316269044940 1.108562623941
+ O SC 1 0.311814551349 0.993644945843
+ O CC312D 1 0.293996576986 0.144938011577
+ O OC303 1 0.271724109033 0.458334236120
+ O HN1 1 0.144726496762 0.310857403193
+ O HN2 1 0.144726496762 0.310857403193
+ O HN3 1 0.222724679535 0.310857403193
+ O HN4 1 0.144726496762 0.310857403193
+ O HN5 1 0.144726496762 0.310857403193
+ O HN6 1 0.242324451334 0.214977812437
+ O HN7 1 0.242324451334 0.214977812437
+ O HN8 1 0.244106248770 0.242527681224
+ O HN9 1 0.244106248770 0.224537002029
+ O NN1 1 0.289542083396 0.648182492821
+ O NN2 1 0.289542083396 0.648182492821
+ O NN2B 1 0.289542083396 0.648182492821
+ O NN2G 1 0.289542083396 0.648182492821
+ O NN2U 1 0.289542083396 0.648182492821
+ O NN3 1 0.289542083396 0.648182492821
+ O NN3A 1 0.289542083396 0.648182492821
+ O NN3G 1 0.289542083396 0.648182492821
+ O NN4 1 0.289542083396 0.648182492821
+ O NN6 1 0.289542083396 0.648182492821
+ O ON1 1 0.276178602624 0.502080000000
+ O ON1C 1 0.276178602624 0.502080000000
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+ O ON3 1 0.276178602624 0.502080000000
+ O ON4 1 0.282414893650 0.565258245152
+ O ON5 1 0.282414893650 0.565258245152
+ O ON6 1 0.282414893650 0.565258245152
+ O ON6B 1 0.282414893650 0.565258245152
+ O CN1 1 0.293996576986 0.458334236120
+ O CN1T 1 0.293996576986 0.458334236120
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+ O CN3 1 0.293996576986 0.434814034732
+ O CN3T 1 0.293996576986 0.434814034732
+ O CN4 1 0.293996576986 0.396929091904
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+ O CN5G 1 0.293996576986 0.396929091904
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+ O CN7B 1 0.293996576986 0.144938011577
+ O CN8 1 0.293996576986 0.144938011577
+ O CN8B 1 0.293996576986 0.144938011577
+ O CN9 1 0.293996576986 0.144938011577
+ O P 1 0.316269044940 1.108562623941
+ O P2 1 0.316269044940 1.108562623941
+ O HOL 1 0.144726496762 0.310857403193
+ O HAL1 1 0.242324451334 0.214977812437
+ O HAL2 1 0.244106248770 0.242527681224
+ O HAL3 1 0.244106248770 0.224537002029
+ O HBL 1 0.242324451334 0.214977812437
+ O HCL 1 0.144726496762 0.310857403193
+ O HL 1 0.187088730809 0.310857403193
+ O HEL1 1 0.236088160307 0.255189702614
+ O HEL2 1 0.236979059025 0.233705521373
+ O CL 1 0.302905564168 0.383469934154
+ O CCL 1 0.302905564168 0.383469934154
+ O CTL1 1 0.293996576986 0.144938011577
+ O CTL2 1 0.293996576986 0.144938011577
+ O CTL3 1 0.293996576986 0.144938011577
+ O CTL5 1 0.293996576986 0.144938011577
+ O CEL1 1 0.310923652631 0.377952093472
+ O CEL2 1 0.310032753913 0.366667388896
+ O CRL1 1 0.293996576986 0.144938011577
+ O CRL2 1 0.293996576986 0.144938011577
+ O OBL 1 0.249451641079 0.502080000000
+ O OCL 1 0.276178602624 0.502080000000
+ O O2L 1 0.276178602624 0.502080000000
+ O OHL 1 0.282414893650 0.565258245152
+ O OSL 1 0.271724109033 0.458334236120
+ O OSLP 1 0.271724109033 0.458334236120
+ O NH3L 1 0.289542083396 0.648182492821
+ O NTL 1 0.289542083396 0.648182492821
+ O SL 1 0.311814551349 0.993644945843
+ O PL 1 0.316269044940 1.108562623941
+ O HCA1A 1 0.244106248770 0.307459952514
+ O HCA2A 1 0.244106248770 0.271154190821
+ O HCA3A 1 0.244106248770 0.224537002029
+ O CC30A 1 0.293996576986 0.144938011577
+ O CC31A 1 0.293996576986 0.144938011577
+ O CC32A 1 0.293996576986 0.144938011577
+ O CC33A 1 0.293996576986 0.144938011577
+ O CC326A 1 0.293996576986 0.144938011577
+ O HCA25A 1 0.240542653898 0.271154190821
+ O CC325A 1 0.293996576986 0.144938011577
+ O CC325B 1 0.293996576986 0.144938011577
+ O OC305A 1 0.271724109033 0.458334236120
+ O OC30A 1 0.271724109033 0.458334236120
+ O CPA 1 0.285087589805 0.434814034732
+ O CPB 1 0.285087589805 0.434814034732
+ O CPM 1 0.285087589805 0.434814034732
+ O CM 1 0.311814551349 0.480705002262
+ O CST 1 0.263973290185 0.349056954894
+ O NPH 1 0.289542083396 0.648182492821
+ O OM 1 0.276178602624 0.502080000000
+ O OST 1 0.275465883649 0.588740986173
+ O FE 1 0.182634237219 0.000000000000
+ O ON2B 1 0.282414893650 0.565258245152
+ O SP 1 0.320723538531 0.972273739232
+ OB C 1 0.302905564168 0.480705002262
+ OB CA 1 0.302228481142 0.383469934154
+ OB CC 1 0.302905564168 0.383469934154
+ OB CD 1 0.302905564168 0.383469934154
+ OB CE1 1 0.310923652631 0.377952093472
+ OB CE2 1 0.310032753913 0.366667388896
+ OB CP1 1 0.293996576986 0.144938011577
+ OB CP2 1 0.293996576986 0.144938011577
+ OB CP3 1 0.293996576986 0.144938011577
+ OB CPH1 1 0.285087589805 0.324091246411
+ OB CPH2 1 0.285087589805 0.324091246411
+ OB CS 1 0.320723538531 0.480705002262
+ OB CPT 1 0.290432982114 0.456036806936
+ OB CY 1 0.302014665450 0.391600943002
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+ OB CT2 1 0.293996576986 0.144938011577
+ OB CT2A 1 0.293996576986 0.144938011577
+ OB CT3 1 0.293996576986 0.144938011577
+ OB H 1 0.144726496762 0.310857403193
+ OB HA 1 0.242324451334 0.214977812437
+ OB HB1 1 0.242324451334 0.214977812437
+ OB HB2 1 0.244106248770 0.242527681224
+ OB HE1 1 0.236088160307 0.255189702614
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+ OB HP 1 0.245727684437 0.251040000000
+ OB HR1 1 0.204906705172 0.310857403193
+ OB HR2 1 0.187088730809 0.310857403193
+ OB HR3 1 0.255509752363 0.128005785869
+ OB HS 1 0.164816262856 0.458334236120
+ OB HA1 1 0.244106248770 0.307459952514
+ OB HA2 1 0.244106248770 0.267252488258
+ OB HA3 1 0.244106248770 0.224537002029
+ OB N 1 0.289542083396 0.014493801158
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+ OB NH1 1 0.262815121851 0.648182492821
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+ OB NH3 1 0.289542083396 0.648182492821
+ OB NP 1 0.289542083396 0.648182492821
+ OB NR1 1 0.289542083396 0.648182492821
+ OB NR2 1 0.289542083396 0.648182492821
+ OB NR3 1 0.289542083396 0.648182492821
+ OB NY 1 0.289542083396 0.648182492821
+ OB O 1 0.249451641079 0.502080000000
+ OB OB 1 0.249451641079 0.502080000000
+ OB OC 1 0.276178602624 0.502080000000
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+ OB OS 1 0.282414893650 0.565258245152
+ OB S 1 0.302905564168 0.972273739232
+ OB SM 1 0.300678317372 0.893457908130
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+ OB OT 1 0.282254531881 0.565258245152
+ OB OX 1 0.276178602624 0.502080000000
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+ OB LIT 1 0.240319929218 0.069961684782
+ OB SOD 1 0.250409357201 0.313883668846
+ OB MG 1 0.230297318639 0.177512086349
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+ OB CAL 1 0.246511675309 0.502080000000
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+ OB CES 1 0.311814551349 0.631770145543
+ OB BAR 1 0.293105678268 0.561342505072
+ OB ZN 1 0.221833780817 0.724690057887
+ OB CAD 1 0.245620776591 0.502080000000
+ OB CLA 1 0.326959829558 0.561342505072
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+ OB HGA2 1 0.244106248770 0.271154190821
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+ OB HGA4 1 0.236088160307 0.255189702614
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+ OB HGP5 1 0.187088730809 0.310857403193
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+ OB CG1T1 1 0.288651184677 0.592298365893
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+ OB CG2D1O 1 0.310923652631 0.377952093472
+ OB CG2D2O 1 0.310923652631 0.377952093472
+ OB CG2DC1 1 0.310923652631 0.377952093472
+ OB CG2DC2 1 0.310923652631 0.377952093472
+ OB CG2DC3 1 0.310032753913 0.366667388896
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+ OB CG251O 1 0.310923652631 0.377952093472
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+ OB CG2N2 1 0.302905564168 0.480705002262
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+ OB CG2O3 1 0.302905564168 0.383469934154
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+ OB CG302 1 0.329632525712 0.204973301676
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+ OB CG312 1 0.307360057758 0.297034533750
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+ OB CG321 1 0.293996576986 0.144938011577
+ OB CG322 1 0.293996576986 0.355024172698
+ OB CG323 1 0.320723538531 0.480705002262
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+ OB CG331 1 0.293996576986 0.144938011577
+ OB CG334 1 0.293996576986 0.144938011577
+ OB CG3C50 1 0.293996576986 0.144938011577
+ OB CG3C51 1 0.293996576986 0.144938011577
+ OB CG3C52 1 0.293996576986 0.144938011577
+ OB CG3C53 1 0.293996576986 0.144938011577
+ OB CG3C54 1 0.293996576986 0.144938011577
+ OB CG3C31 1 0.293996576986 0.144938011577
+ OB CG3C41 1 0.293996576986 0.144938011577
+ OB CG3RC1 1 0.293996576986 0.144938011577
+ OB CG3AM0 1 0.300232868013 0.383469934154
+ OB CG3AM1 1 0.301123766731 0.404789837027
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+ OB NG1T1 1 0.284196691087 0.614919905028
+ OB NG2D1 1 0.289542083396 0.648182492821
+ OB NG2S0 1 0.289542083396 0.014493801158
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+ OB NG2S2 1 0.289542083396 0.648182492821
+ OB NG2S3 1 0.289542083396 0.648182492821
+ OB NG2O1 1 0.289542083396 0.648182492821
+ OB NG2P1 1 0.289542083396 0.648182492821
+ OB NG2R43 1 0.289542083396 0.648182492821
+ OB NG2R50 1 0.289542083396 0.648182492821
+ OB NG2R51 1 0.289542083396 0.648182492821
+ OB NG2R52 1 0.289542083396 0.648182492821
+ OB NG2R53 1 0.289542083396 0.648182492821
+ OB NG2R57 1 0.289542083396 0.648182492821
+ OB NG2R60 1 0.293105678268 0.355024172698
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+ OB NG2R62 1 0.308250956477 0.324091246411
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+ OB NG2RC0 1 0.289542083396 0.648182492821
+ OB NG301 1 0.302905564168 0.271154190821
+ OB NG311 1 0.302905564168 0.307459952514
+ OB NG321 1 0.302014665450 0.355024172698
+ OB NG331 1 0.301123766731 0.383469934154
+ OB NG3C51 1 0.289542083396 0.648182492821
+ OB NG3N1 1 0.307360057758 0.355024172698
+ OB NG3P0 1 0.289542083396 0.648182492821
+ OB NG3P1 1 0.289542083396 0.648182492821
+ OB NG3P2 1 0.289542083396 0.648182492821
+ OB NG3P3 1 0.289542083396 0.648182492821
+ OB OG2D1 1 0.249451641079 0.502080000000
+ OB OG2D2 1 0.276178602624 0.502080000000
+ OB OG2D3 1 0.249451641079 0.502080000000
+ OB OG2D4 1 0.276178602624 0.502080000000
+ OB OG2D5 1 0.275465883649 0.588740986173
+ OB OG2N1 1 0.276178602624 0.502080000000
+ OB OG2P1 1 0.276178602624 0.502080000000
+ OB OG2R50 1 0.276178602624 0.502080000000
+ OB OG3R60 1 0.271724109033 0.458334236120
+ OB OG301 1 0.271724109033 0.458334236120
+ OB OG302 1 0.271724109033 0.458334236120
+ OB OG303 1 0.271724109033 0.458334236120
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+CG301 OG311 1 0.326514380198 0.183381431383
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+CG301 OG3C61 1 0.316269044940 0.132309697301
+CG301 SG2D1 1 0.351904993665 0.314496560236
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+CG301 SG301 1 0.345223253279 0.257919081884
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+CG301 CLGA1 1 0.339432411611 0.245040988571
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+CG301 CLGR1 1 0.341214209048 0.236682781799
+CG301 BRGA1 1 0.344777803920 0.289876023155
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+CG301 HN1 1 0.189271432669 0.089736802707
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+CG301 HN8 1 0.288651184677 0.070011711020
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+CG301 NN1 1 0.334087019303 0.187114168357
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+CG301 HL 1 0.231633666716 0.089736802707
+CG301 HEL1 1 0.280633096214 0.073666921749
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+CG301 CL 1 0.347450500075 0.110698234855
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+CG311 NG3P2 1 0.334087019303 0.187114168357
+CG311 NG3P3 1 0.334087019303 0.187114168357
+CG311 OG2D1 1 0.293996576986 0.144938011577
+CG311 OG2D2 1 0.320723538531 0.144938011577
+CG311 OG2D3 1 0.293996576986 0.144938011577
+CG311 OG2D4 1 0.320723538531 0.144938011577
+CG311 OG2D5 1 0.320010819556 0.169954883425
+CG311 OG2N1 1 0.320723538531 0.144938011577
+CG311 OG2P1 1 0.320723538531 0.144938011577
+CG311 OG2R50 1 0.320723538531 0.144938011577
+CG311 OG3R60 1 0.316269044940 0.132309697301
+CG311 OG301 1 0.316269044940 0.132309697301
+CG311 OG302 1 0.316269044940 0.132309697301
+CG311 OG303 1 0.316269044940 0.132309697301
+CG311 OG304 1 0.316269044940 0.132309697301
+CG311 OG311 1 0.326514380198 0.183381431383
+CG311 OG312 1 0.325178032121 0.144938011577
+CG311 OG3C31 1 0.316269044940 0.132309697301
+CG311 OG3C51 1 0.316269044940 0.132309697301
+CG311 OG3C61 1 0.316269044940 0.132309697301
+CG311 SG2D1 1 0.351904993665 0.314496560236
+CG311 SG2R50 1 0.347450500075 0.280671252536
+CG311 SG311 1 0.347450500075 0.280671252536
+CG311 SG301 1 0.345223253279 0.257919081884
+CG311 SG302 1 0.365268474438 0.286840588481
+CG311 SG3O1 1 0.356359487256 0.286840588481
+CG311 SG3O2 1 0.347450500075 0.247528778125
+CG311 SG3O3 1 0.347450500075 0.247528778125
+CG311 FGA1 1 0.314487247504 0.153729976257
+CG311 FGA2 1 0.314487247504 0.135577095411
+CG311 FGA3 1 0.311814551349 0.130309939452
+CG311 FGP1 1 0.311814551349 0.130309939452
+CG311 FGR1 1 0.320723538531 0.144938011577
+CG311 CLGA1 1 0.339432411611 0.245040988571
+CG311 CLGA3 1 0.339432411611 0.232955260941
+CG311 CLGR1 1 0.341214209048 0.236682781799
+CG311 BRGA1 1 0.344777803920 0.289876023155
+CG311 BRGA2 1 0.351904993665 0.304599797767
+CG311 BRGA3 1 0.347450500075 0.307459952514
+CG311 BRGR1 1 0.353686791102 0.271154190821
+CG311 IGR1 1 0.364377575719 0.310293744700
+CG311 PG0 1 0.360813980847 0.320014464673
+CG311 PG1 1 0.360813980847 0.320014464673
+CG311 PG2 1 0.360813980847 0.320014464673
+CG311 ALG1 1 0.347450500075 0.337324864189
+CG311 CC301 1 0.338541512893 0.041840000000
+CG311 CC3062 1 0.338541512893 0.041840000000
+CG311 CC311 1 0.338541512893 0.041840000000
+CG311 CC3161 1 0.338541512893 0.041840000000
+CG311 CC3162 1 0.338541512893 0.041840000000
+CG311 CC3163 1 0.338541512893 0.041840000000
+CG311 CC321 1 0.338541512893 0.041840000000
+CG311 CC3261 1 0.338541512893 0.041840000000
+CG311 CC3263 1 0.338541512893 0.041840000000
+CG311 CC331 1 0.338541512893 0.041840000000
+CG311 CC2O1 1 0.347450500075 0.138767581228
+CG311 CC2O2 1 0.347450500075 0.110698234855
+CG311 CC2O3 1 0.347450500075 0.125520000000
+CG311 CC2O4 1 0.329632525712 0.102486650838
+CG311 OC2D1 1 0.293996576986 0.144938011577
+CG311 OC2D2 1 0.320723538531 0.144938011577
+CG311 OC2D3 1 0.293996576986 0.144938011577
+CG311 OC2D4 1 0.293996576986 0.144938011577
+CG311 OC3C61 1 0.316269044940 0.132309697301
+CG311 OC311 1 0.326514380198 0.183381431383
+CG311 NC2D1 1 0.307360057758 0.187114168357
+CG311 HCP1 1 0.189271432669 0.089736802707
+CG311 HCA1 1 0.288651184677 0.088756043175
+CG311 HCA2 1 0.288651184677 0.078275472531
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+CG311 CC312 1 0.338541512893 0.041840000000
+CG311 CC322 1 0.338541512893 0.041840000000
+CG311 HCR1 1 0.240542653898 0.089736802707
+CG311 HCA3M 1 0.288651184677 0.064818249282
+CG311 CC321C 1 0.338541512893 0.041840000000
+CG311 CC321D 1 0.338541512893 0.041840000000
+CG311 CC311C 1 0.338541512893 0.041840000000
+CG311 CC311D 1 0.338541512893 0.041840000000
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+CG311 OC302 1 0.316269044940 0.132309697301
+CG311 HCP1M 1 0.189271432669 0.089736802707
+CG311 OC311M 1 0.326514380198 0.183381431383
+CG311 OC3C5M 1 0.316269044940 0.132309697301
+CG311 CC322C 1 0.338541512893 0.041840000000
+CG311 HCA2C2 1 0.285087589805 0.078275472531
+CG311 CC312C 1 0.338541512893 0.041840000000
+CG311 HCA1C2 1 0.288651184677 0.088756043175
+CG311 OC3C51 1 0.316269044940 0.132309697301
+CG311 CC3152 1 0.338541512893 0.041840000000
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+CG311 CC3251 1 0.338541512893 0.041840000000
+CG311 CC3151 1 0.338541512893 0.041840000000
+CG311 CC3153 1 0.338541512893 0.041840000000
+CG311 OC2DP 1 0.320723538531 0.144938011577
+CG311 OC312 1 0.326959829558 0.163176000000
+CG311 OC30P 1 0.326959829558 0.163176000000
+CG311 PC 1 0.360813980847 0.320014464673
+CG311 SC 1 0.356359487256 0.286840588481
+CG311 CC312D 1 0.338541512893 0.041840000000
+CG311 OC303 1 0.316269044940 0.132309697301
+CG311 HN1 1 0.189271432669 0.089736802707
+CG311 HN2 1 0.189271432669 0.089736802707
+CG311 HN3 1 0.267269615442 0.089736802707
+CG311 HN4 1 0.189271432669 0.089736802707
+CG311 HN5 1 0.189271432669 0.089736802707
+CG311 HN6 1 0.286869387241 0.062058748940
+CG311 HN7 1 0.286869387241 0.062058748940
+CG311 HN8 1 0.288651184677 0.070011711020
+CG311 HN9 1 0.288651184677 0.064818249282
+CG311 NN1 1 0.334087019303 0.187114168357
+CG311 NN2 1 0.334087019303 0.187114168357
+CG311 NN2B 1 0.334087019303 0.187114168357
+CG311 NN2G 1 0.334087019303 0.187114168357
+CG311 NN2U 1 0.334087019303 0.187114168357
+CG311 NN3 1 0.334087019303 0.187114168357
+CG311 NN3A 1 0.334087019303 0.187114168357
+CG311 NN3G 1 0.334087019303 0.187114168357
+CG311 NN4 1 0.334087019303 0.187114168357
+CG311 NN6 1 0.334087019303 0.187114168357
+CG311 ON1 1 0.320723538531 0.144938011577
+CG311 ON1C 1 0.320723538531 0.144938011577
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+CG311 ON4 1 0.326959829558 0.163176000000
+CG311 ON5 1 0.326959829558 0.163176000000
+CG311 ON6 1 0.326959829558 0.163176000000
+CG311 ON6B 1 0.326959829558 0.163176000000
+CG311 CN1 1 0.338541512893 0.132309697301
+CG311 CN1T 1 0.338541512893 0.132309697301
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+CG311 CN3T 1 0.338541512893 0.125520000000
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+CG311 CN5G 1 0.338541512893 0.114583559030
+CG311 CN7 1 0.338541512893 0.041840000000
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+CG311 CN8 1 0.338541512893 0.041840000000
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+CG311 P 1 0.360813980847 0.320014464673
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+CG311 HAL1 1 0.286869387241 0.062058748940
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+CG311 HBL 1 0.286869387241 0.062058748940
+CG311 HCL 1 0.189271432669 0.089736802707
+CG311 HL 1 0.231633666716 0.089736802707
+CG311 HEL1 1 0.280633096214 0.073666921749
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+CG311 CL 1 0.347450500075 0.110698234855
+CG311 CCL 1 0.347450500075 0.110698234855
+CG311 CTL1 1 0.338541512893 0.041840000000
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+CG311 CEL1 1 0.355468588538 0.109105371453
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+CG311 CRL1 1 0.338541512893 0.041840000000
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+CG311 OBL 1 0.293996576986 0.144938011577
+CG311 OCL 1 0.320723538531 0.144938011577
+CG311 O2L 1 0.320723538531 0.144938011577
+CG311 OHL 1 0.326959829558 0.163176000000
+CG311 OSL 1 0.316269044940 0.132309697301
+CG311 OSLP 1 0.316269044940 0.132309697301
+CG311 NH3L 1 0.334087019303 0.187114168357
+CG311 NTL 1 0.334087019303 0.187114168357
+CG311 SL 1 0.356359487256 0.286840588481
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+CG311 CC30A 1 0.338541512893 0.041840000000
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+CG311 HCA25A 1 0.285087589805 0.078275472531
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+CG311 CPM 1 0.329632525712 0.125520000000
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+CG311 OST 1 0.320010819556 0.169954883425
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+CG311 SP 1 0.365268474438 0.280671252536
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+CG314 CS 1 0.365268474438 0.138767581228
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+CG314 H 1 0.189271432669 0.089736802707
+CG314 HA 1 0.286869387241 0.062058748940
+CG314 HB1 1 0.286869387241 0.062058748940
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+CG314 HR1 1 0.249451641079 0.089736802707
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+CG314 HA1 1 0.288651184677 0.088756043175
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+CG314 N 1 0.334087019303 0.004184000000
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+CG314 NH1 1 0.307360057758 0.187114168357
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+CG314 NP 1 0.334087019303 0.187114168357
+CG314 NR1 1 0.334087019303 0.187114168357
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+CG314 S 1 0.347450500075 0.280671252536
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+CG314 HGR71 1 0.290272620344 0.072469005789
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+CG314 CG25C1 1 0.355468588538 0.109105371453
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+CG314 CG251O 1 0.355468588538 0.109105371453
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+CG314 CG2R66 1 0.338541512893 0.110698234855
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+CG314 CG312 1 0.351904993665 0.085746484010
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+CG314 CG334 1 0.338541512893 0.041840000000
+CG314 CG3C50 1 0.338541512893 0.041840000000
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+CG314 CG3C52 1 0.338541512893 0.041840000000
+CG314 CG3C53 1 0.338541512893 0.041840000000
+CG314 CG3C54 1 0.338541512893 0.041840000000
+CG314 CG3C31 1 0.338541512893 0.041840000000
+CG314 CG3C41 1 0.338541512893 0.041840000000
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+CG314 CG3AM0 1 0.344777803920 0.110698234855
+CG314 CG3AM1 1 0.345668702638 0.116852760686
+CG314 CG3AM2 1 0.346559601357 0.118341390899
+CG314 NG1T1 1 0.328741626994 0.177512086349
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+CG314 NG2S0 1 0.334087019303 0.004184000000
+CG314 NG2S1 1 0.307360057758 0.187114168357
+CG314 NG2S2 1 0.334087019303 0.187114168357
+CG314 NG2S3 1 0.334087019303 0.187114168357
+CG314 NG2O1 1 0.334087019303 0.187114168357
+CG314 NG2P1 1 0.334087019303 0.187114168357
+CG314 NG2R43 1 0.334087019303 0.187114168357
+CG314 NG2R50 1 0.334087019303 0.187114168357
+CG314 NG2R51 1 0.334087019303 0.187114168357
+CG314 NG2R52 1 0.334087019303 0.187114168357
+CG314 NG2R53 1 0.334087019303 0.187114168357
+CG314 NG2R57 1 0.334087019303 0.187114168357
+CG314 NG2R60 1 0.337650614175 0.102486650838
+CG314 NG2R61 1 0.334087019303 0.187114168357
+CG314 NG2R62 1 0.352795892384 0.093557084179
+CG314 NG2R67 1 0.334087019303 0.187114168357
+CG314 NG2RC0 1 0.334087019303 0.187114168357
+CG314 NG301 1 0.347450500075 0.078275472531
+CG314 NG311 1 0.347450500075 0.088756043175
+CG314 NG321 1 0.346559601357 0.102486650838
+CG314 NG331 1 0.345668702638 0.110698234855
+CG314 NG3C51 1 0.334087019303 0.187114168357
+CG314 NG3N1 1 0.351904993665 0.102486650838
+CG314 NG3P0 1 0.334087019303 0.187114168357
+CG314 NG3P1 1 0.334087019303 0.187114168357
+CG314 NG3P2 1 0.334087019303 0.187114168357
+CG314 NG3P3 1 0.334087019303 0.187114168357
+CG314 OG2D1 1 0.293996576986 0.144938011577
+CG314 OG2D2 1 0.320723538531 0.144938011577
+CG314 OG2D3 1 0.293996576986 0.144938011577
+CG314 OG2D4 1 0.320723538531 0.144938011577
+CG314 OG2D5 1 0.320010819556 0.169954883425
+CG314 OG2N1 1 0.320723538531 0.144938011577
+CG314 OG2P1 1 0.320723538531 0.144938011577
+CG314 OG2R50 1 0.320723538531 0.144938011577
+CG314 OG3R60 1 0.316269044940 0.132309697301
+CG314 OG301 1 0.316269044940 0.132309697301
+CG314 OG302 1 0.316269044940 0.132309697301
+CG314 OG303 1 0.316269044940 0.132309697301
+CG314 OG304 1 0.316269044940 0.132309697301
+CG314 OG311 1 0.326514380198 0.183381431383
+CG314 OG312 1 0.325178032121 0.144938011577
+CG314 OG3C31 1 0.316269044940 0.132309697301
+CG314 OG3C51 1 0.316269044940 0.132309697301
+CG314 OG3C61 1 0.316269044940 0.132309697301
+CG314 SG2D1 1 0.351904993665 0.314496560236
+CG314 SG2R50 1 0.347450500075 0.280671252536
+CG314 SG311 1 0.347450500075 0.280671252536
+CG314 SG301 1 0.345223253279 0.257919081884
+CG314 SG302 1 0.365268474438 0.286840588481
+CG314 SG3O1 1 0.356359487256 0.286840588481
+CG314 SG3O2 1 0.347450500075 0.247528778125
+CG314 SG3O3 1 0.347450500075 0.247528778125
+CG314 FGA1 1 0.314487247504 0.153729976257
+CG314 FGA2 1 0.314487247504 0.135577095411
+CG314 FGA3 1 0.311814551349 0.130309939452
+CG314 FGP1 1 0.311814551349 0.130309939452
+CG314 FGR1 1 0.320723538531 0.144938011577
+CG314 CLGA1 1 0.339432411611 0.245040988571
+CG314 CLGA3 1 0.339432411611 0.232955260941
+CG314 CLGR1 1 0.341214209048 0.236682781799
+CG314 BRGA1 1 0.344777803920 0.289876023155
+CG314 BRGA2 1 0.351904993665 0.304599797767
+CG314 BRGA3 1 0.347450500075 0.307459952514
+CG314 BRGR1 1 0.353686791102 0.271154190821
+CG314 IGR1 1 0.364377575719 0.310293744700
+CG314 PG0 1 0.360813980847 0.320014464673
+CG314 PG1 1 0.360813980847 0.320014464673
+CG314 PG2 1 0.360813980847 0.320014464673
+CG314 ALG1 1 0.347450500075 0.337324864189
+CG314 CC301 1 0.338541512893 0.041840000000
+CG314 CC3062 1 0.338541512893 0.041840000000
+CG314 CC311 1 0.338541512893 0.041840000000
+CG314 CC3161 1 0.338541512893 0.041840000000
+CG314 CC3162 1 0.338541512893 0.041840000000
+CG314 CC3163 1 0.338541512893 0.041840000000
+CG314 CC321 1 0.338541512893 0.041840000000
+CG314 CC3261 1 0.338541512893 0.041840000000
+CG314 CC3263 1 0.338541512893 0.041840000000
+CG314 CC331 1 0.338541512893 0.041840000000
+CG314 CC2O1 1 0.347450500075 0.138767581228
+CG314 CC2O2 1 0.347450500075 0.110698234855
+CG314 CC2O3 1 0.347450500075 0.125520000000
+CG314 CC2O4 1 0.329632525712 0.102486650838
+CG314 OC2D1 1 0.293996576986 0.144938011577
+CG314 OC2D2 1 0.320723538531 0.144938011577
+CG314 OC2D3 1 0.293996576986 0.144938011577
+CG314 OC2D4 1 0.293996576986 0.144938011577
+CG314 OC3C61 1 0.316269044940 0.132309697301
+CG314 OC311 1 0.326514380198 0.183381431383
+CG314 NC2D1 1 0.307360057758 0.187114168357
+CG314 HCP1 1 0.189271432669 0.089736802707
+CG314 HCA1 1 0.288651184677 0.088756043175
+CG314 HCA2 1 0.288651184677 0.078275472531
+CG314 HCA3 1 0.288651184677 0.064818249282
+CG314 CC312 1 0.338541512893 0.041840000000
+CG314 CC322 1 0.338541512893 0.041840000000
+CG314 HCR1 1 0.240542653898 0.089736802707
+CG314 HCA3M 1 0.288651184677 0.064818249282
+CG314 CC321C 1 0.338541512893 0.041840000000
+CG314 CC321D 1 0.338541512893 0.041840000000
+CG314 CC311C 1 0.338541512893 0.041840000000
+CG314 CC311D 1 0.338541512893 0.041840000000
+CG314 OC301 1 0.316269044940 0.132309697301
+CG314 OC302 1 0.316269044940 0.132309697301
+CG314 HCP1M 1 0.189271432669 0.089736802707
+CG314 OC311M 1 0.326514380198 0.183381431383
+CG314 OC3C5M 1 0.316269044940 0.132309697301
+CG314 CC322C 1 0.338541512893 0.041840000000
+CG314 HCA2C2 1 0.285087589805 0.078275472531
+CG314 CC312C 1 0.338541512893 0.041840000000
+CG314 HCA1C2 1 0.288651184677 0.088756043175
+CG314 OC3C51 1 0.316269044940 0.132309697301
+CG314 CC3152 1 0.338541512893 0.041840000000
+CG314 CC3051 1 0.338541512893 0.041840000000
+CG314 CC3251 1 0.338541512893 0.041840000000
+CG314 CC3151 1 0.338541512893 0.041840000000
+CG314 CC3153 1 0.338541512893 0.041840000000
+CG314 OC2DP 1 0.320723538531 0.144938011577
+CG314 OC312 1 0.326959829558 0.163176000000
+CG314 OC30P 1 0.326959829558 0.163176000000
+CG314 PC 1 0.360813980847 0.320014464673
+CG314 SC 1 0.356359487256 0.286840588481
+CG314 CC312D 1 0.338541512893 0.041840000000
+CG314 OC303 1 0.316269044940 0.132309697301
+CG314 HN1 1 0.189271432669 0.089736802707
+CG314 HN2 1 0.189271432669 0.089736802707
+CG314 HN3 1 0.267269615442 0.089736802707
+CG314 HN4 1 0.189271432669 0.089736802707
+CG314 HN5 1 0.189271432669 0.089736802707
+CG314 HN6 1 0.286869387241 0.062058748940
+CG314 HN7 1 0.286869387241 0.062058748940
+CG314 HN8 1 0.288651184677 0.070011711020
+CG314 HN9 1 0.288651184677 0.064818249282
+CG314 NN1 1 0.334087019303 0.187114168357
+CG314 NN2 1 0.334087019303 0.187114168357
+CG314 NN2B 1 0.334087019303 0.187114168357
+CG314 NN2G 1 0.334087019303 0.187114168357
+CG314 NN2U 1 0.334087019303 0.187114168357
+CG314 NN3 1 0.334087019303 0.187114168357
+CG314 NN3A 1 0.334087019303 0.187114168357
+CG314 NN3G 1 0.334087019303 0.187114168357
+CG314 NN4 1 0.334087019303 0.187114168357
+CG314 NN6 1 0.334087019303 0.187114168357
+CG314 ON1 1 0.320723538531 0.144938011577
+CG314 ON1C 1 0.320723538531 0.144938011577
+CG314 ON2 1 0.326959829558 0.163176000000
+CG314 ON3 1 0.320723538531 0.144938011577
+CG314 ON4 1 0.326959829558 0.163176000000
+CG314 ON5 1 0.326959829558 0.163176000000
+CG314 ON6 1 0.326959829558 0.163176000000
+CG314 ON6B 1 0.326959829558 0.163176000000
+CG314 CN1 1 0.338541512893 0.132309697301
+CG314 CN1T 1 0.338541512893 0.132309697301
+CG314 CN2 1 0.338541512893 0.132309697301
+CG314 CN3 1 0.338541512893 0.125520000000
+CG314 CN3T 1 0.338541512893 0.125520000000
+CG314 CN4 1 0.338541512893 0.114583559030
+CG314 CN5 1 0.338541512893 0.114583559030
+CG314 CN5G 1 0.338541512893 0.114583559030
+CG314 CN7 1 0.338541512893 0.041840000000
+CG314 CN7B 1 0.338541512893 0.041840000000
+CG314 CN8 1 0.338541512893 0.041840000000
+CG314 CN8B 1 0.338541512893 0.041840000000
+CG314 CN9 1 0.338541512893 0.041840000000
+CG314 P 1 0.360813980847 0.320014464673
+CG314 P2 1 0.360813980847 0.320014464673
+CG314 HOL 1 0.189271432669 0.089736802707
+CG314 HAL1 1 0.286869387241 0.062058748940
+CG314 HAL2 1 0.288651184677 0.070011711020
+CG314 HAL3 1 0.288651184677 0.064818249282
+CG314 HBL 1 0.286869387241 0.062058748940
+CG314 HCL 1 0.189271432669 0.089736802707
+CG314 HL 1 0.231633666716 0.089736802707
+CG314 HEL1 1 0.280633096214 0.073666921749
+CG314 HEL2 1 0.281523994932 0.067464972838
+CG314 CL 1 0.347450500075 0.110698234855
+CG314 CCL 1 0.347450500075 0.110698234855
+CG314 CTL1 1 0.338541512893 0.041840000000
+CG314 CTL2 1 0.338541512893 0.041840000000
+CG314 CTL3 1 0.338541512893 0.041840000000
+CG314 CTL5 1 0.338541512893 0.041840000000
+CG314 CEL1 1 0.355468588538 0.109105371453
+CG314 CEL2 1 0.354577689820 0.105847757841
+CG314 CRL1 1 0.338541512893 0.041840000000
+CG314 CRL2 1 0.338541512893 0.041840000000
+CG314 OBL 1 0.293996576986 0.144938011577
+CG314 OCL 1 0.320723538531 0.144938011577
+CG314 O2L 1 0.320723538531 0.144938011577
+CG314 OHL 1 0.326959829558 0.163176000000
+CG314 OSL 1 0.316269044940 0.132309697301
+CG314 OSLP 1 0.316269044940 0.132309697301
+CG314 NH3L 1 0.334087019303 0.187114168357
+CG314 NTL 1 0.334087019303 0.187114168357
+CG314 SL 1 0.356359487256 0.286840588481
+CG314 PL 1 0.360813980847 0.320014464673
+CG314 HCA1A 1 0.288651184677 0.088756043175
+CG314 HCA2A 1 0.288651184677 0.078275472531
+CG314 HCA3A 1 0.288651184677 0.064818249282
+CG314 CC30A 1 0.338541512893 0.041840000000
+CG314 CC31A 1 0.338541512893 0.041840000000
+CG314 CC32A 1 0.338541512893 0.041840000000
+CG314 CC33A 1 0.338541512893 0.041840000000
+CG314 CC326A 1 0.338541512893 0.041840000000
+CG314 HCA25A 1 0.285087589805 0.078275472531
+CG314 CC325A 1 0.338541512893 0.041840000000
+CG314 CC325B 1 0.338541512893 0.041840000000
+CG314 OC305A 1 0.316269044940 0.132309697301
+CG314 OC30A 1 0.316269044940 0.132309697301
+CG314 CPA 1 0.329632525712 0.125520000000
+CG314 CPB 1 0.329632525712 0.125520000000
+CG314 CPM 1 0.329632525712 0.125520000000
+CG314 CM 1 0.356359487256 0.138767581228
+CG314 CST 1 0.308518226092 0.100764063435
+CG314 NPH 1 0.334087019303 0.187114168357
+CG314 OM 1 0.320723538531 0.144938011577
+CG314 OST 1 0.320010819556 0.169954883425
+CG314 FE 1 0.227179173126 0.000000000000
+CG314 ON2B 1 0.326959829558 0.163176000000
+CG314 SP 1 0.365268474438 0.280671252536
+CG321 C 1 0.347450500075 0.138767581228
+CG321 CA 1 0.346773417049 0.110698234855
+CG321 CC 1 0.347450500075 0.110698234855
+CG321 CD 1 0.347450500075 0.110698234855
+CG321 CE1 1 0.355468588538 0.109105371453
+CG321 CE2 1 0.354577689820 0.105847757841
+CG321 CP1 1 0.338541512893 0.041840000000
+CG321 CP2 1 0.338541512893 0.041840000000
+CG321 CP3 1 0.338541512893 0.041840000000
+CG321 CPH1 1 0.329632525712 0.093557084179
+CG321 CPH2 1 0.329632525712 0.093557084179
+CG321 CS 1 0.365268474438 0.138767581228
+CG321 CPT 1 0.334977918021 0.131646486622
+CG321 CY 1 0.346559601357 0.113045454929
+CG321 CAI 1 0.346559601357 0.113045454929
+CG321 CT 1 0.338541512893 0.041840000000
+CG321 CT1 1 0.338541512893 0.041840000000
+CG321 CT2 1 0.338541512893 0.041840000000
+CG321 CT2A 1 0.338541512893 0.041840000000
+CG321 CT3 1 0.338541512893 0.041840000000
+CG321 H 1 0.189271432669 0.089736802707
+CG321 HA 1 0.286869387241 0.062058748940
+CG321 HB1 1 0.286869387241 0.062058748940
+CG321 HB2 1 0.288651184677 0.070011711020
+CG321 HE1 1 0.280633096214 0.073666921749
+CG321 HE2 1 0.281523994932 0.067464972838
+CG321 HC 1 0.189271432669 0.089736802707
+CG321 HP 1 0.290272620344 0.072469005789
+CG321 HR1 1 0.249451641079 0.089736802707
+CG321 HR2 1 0.231633666716 0.089736802707
+CG321 HR3 1 0.300054688270 0.036952087465
+CG321 HS 1 0.209361198763 0.132309697301
+CG321 HA1 1 0.288651184677 0.088756043175
+CG321 HA2 1 0.288651184677 0.077149148019
+CG321 HA3 1 0.288651184677 0.064818249282
+CG321 N 1 0.334087019303 0.004184000000
+CG321 NC2 1 0.334087019303 0.187114168357
+CG321 NH1 1 0.307360057758 0.187114168357
+CG321 NH2 1 0.334087019303 0.187114168357
+CG321 NH3 1 0.334087019303 0.187114168357
+CG321 NP 1 0.334087019303 0.187114168357
+CG321 NR1 1 0.334087019303 0.187114168357
+CG321 NR2 1 0.334087019303 0.187114168357
+CG321 NR3 1 0.334087019303 0.187114168357
+CG321 NY 1 0.334087019303 0.187114168357
+CG321 O 1 0.293996576986 0.144938011577
+CG321 OB 1 0.293996576986 0.144938011577
+CG321 OC 1 0.320723538531 0.144938011577
+CG321 OH1 1 0.326959829558 0.163176000000
+CG321 OS 1 0.326959829558 0.163176000000
+CG321 S 1 0.347450500075 0.280671252536
+CG321 SM 1 0.345223253279 0.257919081884
+CG321 SS 1 0.365268474438 0.286840588481
+CG321 HT 1 0.189271432669 0.089736802707
+CG321 OT 1 0.326799467788 0.163176000000
+CG321 OX 1 0.320723538531 0.144938011577
+CG321 HX 1 0.189271432669 0.089736802707
+CG321 LIT 1 0.284864865125 0.020196198771
+CG321 SOD 1 0.294954293108 0.090610410351
+CG321 MG 1 0.274842254546 0.051243325419
+CG321 POT 1 0.326403017859 0.123410269913
+CG321 CAL 1 0.291056611216 0.144938011577
+CG321 RUB 1 0.338541512893 0.162045623205
+CG321 CES 1 0.356359487256 0.182376331798
+CG321 BAR 1 0.337650614175 0.162045623205
+CG321 ZN 1 0.266378716724 0.209200000000
+CG321 CAD 1 0.290165712498 0.144938011577
+CG321 CLA 1 0.371504765465 0.162045623205
+CG321 HGA1 1 0.288651184677 0.088756043175
+CG321 HGA2 1 0.288651184677 0.078275472531
+CG321 HGA3 1 0.288651184677 0.064818249282
+CG321 HGA4 1 0.280633096214 0.073666921749
+CG321 HGA5 1 0.281523994932 0.067464972838
+CG321 HGA6 1 0.286869387241 0.070011711020
+CG321 HGA7 1 0.285087589805 0.072469005789
+CG321 HGAAM0 1 0.283305792369 0.070011711020
+CG321 HGAAM1 1 0.283305792369 0.070011711020
+CG321 HGAAM2 1 0.281523994932 0.083680000000
+CG321 HGP1 1 0.189271432669 0.089736802707
+CG321 HGP2 1 0.189271432669 0.089736802707
+CG321 HGP3 1 0.209361198763 0.132309697301
+CG321 HGP4 1 0.189271432669 0.089736802707
+CG321 HGP5 1 0.231633666716 0.089736802707
+CG321 HGPAM1 1 0.247224394284 0.039692909190
+CG321 HGPAM2 1 0.247224394284 0.041840000000
+CG321 HGPAM3 1 0.246778944925 0.045833423612
+CG321 HGR51 1 0.290272620344 0.072469005789
+CG321 HGR52 1 0.249451641079 0.089736802707
+CG321 HGR53 1 0.231633666716 0.089736802707
+CG321 HGR61 1 0.290272620344 0.072469005789
+CG321 HGR62 1 0.267269615442 0.089736802707
+CG321 HGR63 1 0.249451641079 0.089736802707
+CG321 HGR71 1 0.290272620344 0.072469005789
+CG321 CG1T1 1 0.333196120584 0.170981810495
+CG321 CG1T2 1 0.346782326036 0.134409982486
+CG321 CG1N1 1 0.335868816739 0.177512086349
+CG321 CG2D1 1 0.355468588538 0.109105371453
+CG321 CG2D2 1 0.354577689820 0.105847757841
+CG321 CG2D1O 1 0.355468588538 0.109105371453
+CG321 CG2D2O 1 0.355468588538 0.109105371453
+CG321 CG2DC1 1 0.355468588538 0.109105371453
+CG321 CG2DC2 1 0.355468588538 0.109105371453
+CG321 CG2DC3 1 0.354577689820 0.105847757841
+CG321 CG25C1 1 0.355468588538 0.109105371453
+CG321 CG25C2 1 0.355468588538 0.109105371453
+CG321 CG251O 1 0.355468588538 0.109105371453
+CG321 CG252O 1 0.355468588538 0.109105371453
+CG321 CG2N1 1 0.347450500075 0.138767581228
+CG321 CG2N2 1 0.347450500075 0.138767581228
+CG321 CG2O1 1 0.347450500075 0.138767581228
+CG321 CG2O2 1 0.320723538531 0.130979917850
+CG321 CG2O3 1 0.347450500075 0.110698234855
+CG321 CG2O4 1 0.329632525712 0.102486650838
+CG321 CG2O5 1 0.347450500075 0.125520000000
+CG321 CG2O6 1 0.347450500075 0.110698234855
+CG321 CG2O7 1 0.308518226092 0.100764063435
+CG321 CG2R51 1 0.356359487256 0.093557084179
+CG321 CG2R52 1 0.365268474438 0.059170695450
+CG321 CG2R53 1 0.365268474438 0.059170695450
+CG321 CG2R57 1 0.356359487256 0.093557084179
+CG321 CG2R61 1 0.346773417049 0.110698234855
+CG321 CG2R62 1 0.338541512893 0.125520000000
+CG321 CG2R63 1 0.338541512893 0.132309697301
+CG321 CG2R64 1 0.356359487256 0.083680000000
+CG321 CG2R66 1 0.338541512893 0.110698234855
+CG321 CG2R67 1 0.346773417049 0.110698234855
+CG321 CG2RC0 1 0.334977918021 0.131646486622
+CG321 CG2R71 1 0.346987232741 0.108300154755
+CG321 CG2RC7 1 0.334977918021 0.131646486622
+CG321 CG301 1 0.338541512893 0.041840000000
+CG321 CG302 1 0.374177461619 0.059170695450
+CG321 CG311 1 0.338541512893 0.041840000000
+CG321 CG312 1 0.351904993665 0.085746484010
+CG321 CG314 1 0.338541512893 0.041840000000
+CG321 CG321 1 0.338541512893 0.041840000000
+CG321 CG322 1 0.338541512893 0.102486650838
+CG321 CG323 1 0.365268474438 0.138767581228
+CG321 CG324 1 0.338541512893 0.041840000000
+CG321 CG331 1 0.338541512893 0.041840000000
+CG321 CG334 1 0.338541512893 0.041840000000
+CG321 CG3C50 1 0.338541512893 0.041840000000
+CG321 CG3C51 1 0.338541512893 0.041840000000
+CG321 CG3C52 1 0.338541512893 0.041840000000
+CG321 CG3C53 1 0.338541512893 0.041840000000
+CG321 CG3C54 1 0.338541512893 0.041840000000
+CG321 CG3C31 1 0.338541512893 0.041840000000
+CG321 CG3C41 1 0.338541512893 0.041840000000
+CG321 CG3RC1 1 0.338541512893 0.041840000000
+CG321 CG3AM0 1 0.344777803920 0.110698234855
+CG321 CG3AM1 1 0.345668702638 0.116852760686
+CG321 CG3AM2 1 0.346559601357 0.118341390899
+CG321 NG1T1 1 0.328741626994 0.177512086349
+CG321 NG2D1 1 0.334087019303 0.187114168357
+CG321 NG2S0 1 0.334087019303 0.004184000000
+CG321 NG2S1 1 0.307360057758 0.187114168357
+CG321 NG2S2 1 0.334087019303 0.187114168357
+CG321 NG2S3 1 0.334087019303 0.187114168357
+CG321 NG2O1 1 0.334087019303 0.187114168357
+CG321 NG2P1 1 0.334087019303 0.187114168357
+CG321 NG2R43 1 0.334087019303 0.187114168357
+CG321 NG2R50 1 0.334087019303 0.187114168357
+CG321 NG2R51 1 0.334087019303 0.187114168357
+CG321 NG2R52 1 0.334087019303 0.187114168357
+CG321 NG2R53 1 0.334087019303 0.187114168357
+CG321 NG2R57 1 0.334087019303 0.187114168357
+CG321 NG2R60 1 0.337650614175 0.102486650838
+CG321 NG2R61 1 0.334087019303 0.187114168357
+CG321 NG2R62 1 0.352795892384 0.093557084179
+CG321 NG2R67 1 0.334087019303 0.187114168357
+CG321 NG2RC0 1 0.334087019303 0.187114168357
+CG321 NG301 1 0.347450500075 0.078275472531
+CG321 NG311 1 0.347450500075 0.088756043175
+CG321 NG321 1 0.346559601357 0.102486650838
+CG321 NG331 1 0.345668702638 0.110698234855
+CG321 NG3C51 1 0.334087019303 0.187114168357
+CG321 NG3N1 1 0.351904993665 0.102486650838
+CG321 NG3P0 1 0.334087019303 0.187114168357
+CG321 NG3P1 1 0.334087019303 0.187114168357
+CG321 NG3P2 1 0.334087019303 0.187114168357
+CG321 NG3P3 1 0.334087019303 0.187114168357
+CG321 OG2D1 1 0.293996576986 0.144938011577
+CG321 OG2D2 1 0.320723538531 0.144938011577
+CG321 OG2D3 1 0.293996576986 0.144938011577
+CG321 OG2D4 1 0.320723538531 0.144938011577
+CG321 OG2D5 1 0.320010819556 0.169954883425
+CG321 OG2N1 1 0.320723538531 0.144938011577
+CG321 OG2P1 1 0.320723538531 0.144938011577
+CG321 OG2R50 1 0.320723538531 0.144938011577
+CG321 OG3R60 1 0.316269044940 0.132309697301
+CG321 OG301 1 0.316269044940 0.132309697301
+CG321 OG302 1 0.316269044940 0.132309697301
+CG321 OG303 1 0.316269044940 0.132309697301
+CG321 OG304 1 0.316269044940 0.132309697301
+CG321 OG311 1 0.326514380198 0.183381431383
+CG321 OG312 1 0.325178032121 0.144938011577
+CG321 OG3C31 1 0.316269044940 0.132309697301
+CG321 OG3C51 1 0.316269044940 0.132309697301
+CG321 OG3C61 1 0.316269044940 0.132309697301
+CG321 SG2D1 1 0.351904993665 0.314496560236
+CG321 SG2R50 1 0.347450500075 0.280671252536
+CG321 SG311 1 0.347450500075 0.280671252536
+CG321 SG301 1 0.345223253279 0.257919081884
+CG321 SG302 1 0.365268474438 0.286840588481
+CG321 SG3O1 1 0.356359487256 0.286840588481
+CG321 SG3O2 1 0.347450500075 0.247528778125
+CG321 SG3O3 1 0.347450500075 0.247528778125
+CG321 FGA1 1 0.314487247504 0.153729976257
+CG321 FGA2 1 0.314487247504 0.135577095411
+CG321 FGA3 1 0.311814551349 0.130309939452
+CG321 FGP1 1 0.311814551349 0.130309939452
+CG321 FGR1 1 0.320723538531 0.144938011577
+CG321 CLGA1 1 0.339432411611 0.245040988571
+CG321 CLGA3 1 0.339432411611 0.232955260941
+CG321 CLGR1 1 0.341214209048 0.236682781799
+CG321 BRGA1 1 0.344777803920 0.289876023155
+CG321 BRGA2 1 0.351904993665 0.304599797767
+CG321 BRGA3 1 0.347450500075 0.307459952514
+CG321 BRGR1 1 0.353686791102 0.271154190821
+CG321 IGR1 1 0.364377575719 0.310293744700
+CG321 PG0 1 0.360813980847 0.320014464673
+CG321 PG1 1 0.360813980847 0.320014464673
+CG321 PG2 1 0.360813980847 0.320014464673
+CG321 ALG1 1 0.347450500075 0.337324864189
+CG321 CC301 1 0.338541512893 0.041840000000
+CG321 CC3062 1 0.338541512893 0.041840000000
+CG321 CC311 1 0.338541512893 0.041840000000
+CG321 CC3161 1 0.338541512893 0.041840000000
+CG321 CC3162 1 0.338541512893 0.041840000000
+CG321 CC3163 1 0.338541512893 0.041840000000
+CG321 CC321 1 0.338541512893 0.041840000000
+CG321 CC3261 1 0.338541512893 0.041840000000
+CG321 CC3263 1 0.338541512893 0.041840000000
+CG321 CC331 1 0.338541512893 0.041840000000
+CG321 CC2O1 1 0.347450500075 0.138767581228
+CG321 CC2O2 1 0.347450500075 0.110698234855
+CG321 CC2O3 1 0.347450500075 0.125520000000
+CG321 CC2O4 1 0.329632525712 0.102486650838
+CG321 OC2D1 1 0.293996576986 0.144938011577
+CG321 OC2D2 1 0.320723538531 0.144938011577
+CG321 OC2D3 1 0.293996576986 0.144938011577
+CG321 OC2D4 1 0.293996576986 0.144938011577
+CG321 OC3C61 1 0.316269044940 0.132309697301
+CG321 OC311 1 0.326514380198 0.183381431383
+CG321 NC2D1 1 0.307360057758 0.187114168357
+CG321 HCP1 1 0.189271432669 0.089736802707
+CG321 HCA1 1 0.288651184677 0.088756043175
+CG321 HCA2 1 0.288651184677 0.078275472531
+CG321 HCA3 1 0.288651184677 0.064818249282
+CG321 CC312 1 0.338541512893 0.041840000000
+CG321 CC322 1 0.338541512893 0.041840000000
+CG321 HCR1 1 0.240542653898 0.089736802707
+CG321 HCA3M 1 0.288651184677 0.064818249282
+CG321 CC321C 1 0.338541512893 0.041840000000
+CG321 CC321D 1 0.338541512893 0.041840000000
+CG321 CC311C 1 0.338541512893 0.041840000000
+CG321 CC311D 1 0.338541512893 0.041840000000
+CG321 OC301 1 0.316269044940 0.132309697301
+CG321 OC302 1 0.316269044940 0.132309697301
+CG321 HCP1M 1 0.189271432669 0.089736802707
+CG321 OC311M 1 0.326514380198 0.183381431383
+CG321 OC3C5M 1 0.316269044940 0.132309697301
+CG321 CC322C 1 0.338541512893 0.041840000000
+CG321 HCA2C2 1 0.285087589805 0.078275472531
+CG321 CC312C 1 0.338541512893 0.041840000000
+CG321 HCA1C2 1 0.288651184677 0.088756043175
+CG321 OC3C51 1 0.316269044940 0.132309697301
+CG321 CC3152 1 0.338541512893 0.041840000000
+CG321 CC3051 1 0.338541512893 0.041840000000
+CG321 CC3251 1 0.338541512893 0.041840000000
+CG321 CC3151 1 0.338541512893 0.041840000000
+CG321 CC3153 1 0.338541512893 0.041840000000
+CG321 OC2DP 1 0.320723538531 0.144938011577
+CG321 OC312 1 0.326959829558 0.163176000000
+CG321 OC30P 1 0.326959829558 0.163176000000
+CG321 PC 1 0.360813980847 0.320014464673
+CG321 SC 1 0.356359487256 0.286840588481
+CG321 CC312D 1 0.338541512893 0.041840000000
+CG321 OC303 1 0.316269044940 0.132309697301
+CG321 HN1 1 0.189271432669 0.089736802707
+CG321 HN2 1 0.189271432669 0.089736802707
+CG321 HN3 1 0.267269615442 0.089736802707
+CG321 HN4 1 0.189271432669 0.089736802707
+CG321 HN5 1 0.189271432669 0.089736802707
+CG321 HN6 1 0.286869387241 0.062058748940
+CG321 HN7 1 0.286869387241 0.062058748940
+CG321 HN8 1 0.288651184677 0.070011711020
+CG321 HN9 1 0.288651184677 0.064818249282
+CG321 NN1 1 0.334087019303 0.187114168357
+CG321 NN2 1 0.334087019303 0.187114168357
+CG321 NN2B 1 0.334087019303 0.187114168357
+CG321 NN2G 1 0.334087019303 0.187114168357
+CG321 NN2U 1 0.334087019303 0.187114168357
+CG321 NN3 1 0.334087019303 0.187114168357
+CG321 NN3A 1 0.334087019303 0.187114168357
+CG321 NN3G 1 0.334087019303 0.187114168357
+CG321 NN4 1 0.334087019303 0.187114168357
+CG321 NN6 1 0.334087019303 0.187114168357
+CG321 ON1 1 0.320723538531 0.144938011577
+CG321 ON1C 1 0.320723538531 0.144938011577
+CG321 ON2 1 0.326959829558 0.163176000000
+CG321 ON3 1 0.320723538531 0.144938011577
+CG321 ON4 1 0.326959829558 0.163176000000
+CG321 ON5 1 0.326959829558 0.163176000000
+CG321 ON6 1 0.326959829558 0.163176000000
+CG321 ON6B 1 0.326959829558 0.163176000000
+CG321 CN1 1 0.338541512893 0.132309697301
+CG321 CN1T 1 0.338541512893 0.132309697301
+CG321 CN2 1 0.338541512893 0.132309697301
+CG321 CN3 1 0.338541512893 0.125520000000
+CG321 CN3T 1 0.338541512893 0.125520000000
+CG321 CN4 1 0.338541512893 0.114583559030
+CG321 CN5 1 0.338541512893 0.114583559030
+CG321 CN5G 1 0.338541512893 0.114583559030
+CG321 CN7 1 0.338541512893 0.041840000000
+CG321 CN7B 1 0.338541512893 0.041840000000
+CG321 CN8 1 0.338541512893 0.041840000000
+CG321 CN8B 1 0.338541512893 0.041840000000
+CG321 CN9 1 0.338541512893 0.041840000000
+CG321 P 1 0.360813980847 0.320014464673
+CG321 P2 1 0.360813980847 0.320014464673
+CG321 HOL 1 0.189271432669 0.089736802707
+CG321 HAL1 1 0.286869387241 0.062058748940
+CG321 HAL2 1 0.288651184677 0.070011711020
+CG321 HAL3 1 0.288651184677 0.064818249282
+CG321 HBL 1 0.286869387241 0.062058748940
+CG321 HCL 1 0.189271432669 0.089736802707
+CG321 HL 1 0.231633666716 0.089736802707
+CG321 HEL1 1 0.280633096214 0.073666921749
+CG321 HEL2 1 0.281523994932 0.067464972838
+CG321 CL 1 0.347450500075 0.110698234855
+CG321 CCL 1 0.347450500075 0.110698234855
+CG321 CTL1 1 0.338541512893 0.041840000000
+CG321 CTL2 1 0.338541512893 0.041840000000
+CG321 CTL3 1 0.338541512893 0.041840000000
+CG321 CTL5 1 0.338541512893 0.041840000000
+CG321 CEL1 1 0.355468588538 0.109105371453
+CG321 CEL2 1 0.354577689820 0.105847757841
+CG321 CRL1 1 0.338541512893 0.041840000000
+CG321 CRL2 1 0.338541512893 0.041840000000
+CG321 OBL 1 0.293996576986 0.144938011577
+CG321 OCL 1 0.320723538531 0.144938011577
+CG321 O2L 1 0.320723538531 0.144938011577
+CG321 OHL 1 0.326959829558 0.163176000000
+CG321 OSL 1 0.316269044940 0.132309697301
+CG321 OSLP 1 0.316269044940 0.132309697301
+CG321 NH3L 1 0.334087019303 0.187114168357
+CG321 NTL 1 0.334087019303 0.187114168357
+CG321 SL 1 0.356359487256 0.286840588481
+CG321 PL 1 0.360813980847 0.320014464673
+CG321 HCA1A 1 0.288651184677 0.088756043175
+CG321 HCA2A 1 0.288651184677 0.078275472531
+CG321 HCA3A 1 0.288651184677 0.064818249282
+CG321 CC30A 1 0.338541512893 0.041840000000
+CG321 CC31A 1 0.338541512893 0.041840000000
+CG321 CC32A 1 0.338541512893 0.041840000000
+CG321 CC33A 1 0.338541512893 0.041840000000
+CG321 CC326A 1 0.338541512893 0.041840000000
+CG321 HCA25A 1 0.285087589805 0.078275472531
+CG321 CC325A 1 0.338541512893 0.041840000000
+CG321 CC325B 1 0.338541512893 0.041840000000
+CG321 OC305A 1 0.316269044940 0.132309697301
+CG321 OC30A 1 0.316269044940 0.132309697301
+CG321 CPA 1 0.329632525712 0.125520000000
+CG321 CPB 1 0.329632525712 0.125520000000
+CG321 CPM 1 0.329632525712 0.125520000000
+CG321 CM 1 0.356359487256 0.138767581228
+CG321 CST 1 0.308518226092 0.100764063435
+CG321 NPH 1 0.334087019303 0.187114168357
+CG321 OM 1 0.320723538531 0.144938011577
+CG321 OST 1 0.320010819556 0.169954883425
+CG321 FE 1 0.227179173126 0.000000000000
+CG321 ON2B 1 0.326959829558 0.163176000000
+CG321 SP 1 0.365268474438 0.280671252536
+CG324 C 1 0.347450500075 0.138767581228
+CG324 CA 1 0.346773417049 0.110698234855
+CG324 CC 1 0.347450500075 0.110698234855
+CG324 CD 1 0.347450500075 0.110698234855
+CG324 CE1 1 0.355468588538 0.109105371453
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+CG324 CP1 1 0.338541512893 0.041840000000
+CG324 CP2 1 0.338541512893 0.041840000000
+CG324 CP3 1 0.338541512893 0.041840000000
+CG324 CPH1 1 0.329632525712 0.093557084179
+CG324 CPH2 1 0.329632525712 0.093557084179
+CG324 CS 1 0.365268474438 0.138767581228
+CG324 CPT 1 0.334977918021 0.131646486622
+CG324 CY 1 0.346559601357 0.113045454929
+CG324 CAI 1 0.346559601357 0.113045454929
+CG324 CT 1 0.338541512893 0.041840000000
+CG324 CT1 1 0.338541512893 0.041840000000
+CG324 CT2 1 0.338541512893 0.041840000000
+CG324 CT2A 1 0.338541512893 0.041840000000
+CG324 CT3 1 0.338541512893 0.041840000000
+CG324 H 1 0.189271432669 0.089736802707
+CG324 HA 1 0.286869387241 0.062058748940
+CG324 HB1 1 0.286869387241 0.062058748940
+CG324 HB2 1 0.288651184677 0.070011711020
+CG324 HE1 1 0.280633096214 0.073666921749
+CG324 HE2 1 0.281523994932 0.067464972838
+CG324 HC 1 0.189271432669 0.089736802707
+CG324 HP 1 0.290272620344 0.072469005789
+CG324 HR1 1 0.249451641079 0.089736802707
+CG324 HR2 1 0.231633666716 0.089736802707
+CG324 HR3 1 0.300054688270 0.036952087465
+CG324 HS 1 0.209361198763 0.132309697301
+CG324 HA1 1 0.288651184677 0.088756043175
+CG324 HA2 1 0.288651184677 0.077149148019
+CG324 HA3 1 0.288651184677 0.064818249282
+CG324 N 1 0.334087019303 0.004184000000
+CG324 NC2 1 0.334087019303 0.187114168357
+CG324 NH1 1 0.307360057758 0.187114168357
+CG324 NH2 1 0.334087019303 0.187114168357
+CG324 NH3 1 0.334087019303 0.187114168357
+CG324 NP 1 0.334087019303 0.187114168357
+CG324 NR1 1 0.334087019303 0.187114168357
+CG324 NR2 1 0.334087019303 0.187114168357
+CG324 NR3 1 0.334087019303 0.187114168357
+CG324 NY 1 0.334087019303 0.187114168357
+CG324 O 1 0.293996576986 0.144938011577
+CG324 OB 1 0.293996576986 0.144938011577
+CG324 OC 1 0.320723538531 0.144938011577
+CG324 OH1 1 0.326959829558 0.163176000000
+CG324 OS 1 0.326959829558 0.163176000000
+CG324 S 1 0.347450500075 0.280671252536
+CG324 SM 1 0.345223253279 0.257919081884
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+CG324 HT 1 0.189271432669 0.089736802707
+CG324 OT 1 0.326799467788 0.163176000000
+CG324 OX 1 0.320723538531 0.144938011577
+CG324 HX 1 0.189271432669 0.089736802707
+CG324 LIT 1 0.284864865125 0.020196198771
+CG324 SOD 1 0.294954293108 0.090610410351
+CG324 MG 1 0.274842254546 0.051243325419
+CG324 POT 1 0.326403017859 0.123410269913
+CG324 CAL 1 0.291056611216 0.144938011577
+CG324 RUB 1 0.338541512893 0.162045623205
+CG324 CES 1 0.356359487256 0.182376331798
+CG324 BAR 1 0.337650614175 0.162045623205
+CG324 ZN 1 0.266378716724 0.209200000000
+CG324 CAD 1 0.290165712498 0.144938011577
+CG324 CLA 1 0.371504765465 0.162045623205
+CG324 HGA1 1 0.288651184677 0.088756043175
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+CG324 HGA4 1 0.280633096214 0.073666921749
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+CG324 HGA6 1 0.286869387241 0.070011711020
+CG324 HGA7 1 0.285087589805 0.072469005789
+CG324 HGAAM0 1 0.283305792369 0.070011711020
+CG324 HGAAM1 1 0.283305792369 0.070011711020
+CG324 HGAAM2 1 0.281523994932 0.083680000000
+CG324 HGP1 1 0.189271432669 0.089736802707
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+CG324 HGP3 1 0.209361198763 0.132309697301
+CG324 HGP4 1 0.189271432669 0.089736802707
+CG324 HGP5 1 0.231633666716 0.089736802707
+CG324 HGPAM1 1 0.247224394284 0.039692909190
+CG324 HGPAM2 1 0.247224394284 0.041840000000
+CG324 HGPAM3 1 0.246778944925 0.045833423612
+CG324 HGR51 1 0.290272620344 0.072469005789
+CG324 HGR52 1 0.249451641079 0.089736802707
+CG324 HGR53 1 0.231633666716 0.089736802707
+CG324 HGR61 1 0.290272620344 0.072469005789
+CG324 HGR62 1 0.267269615442 0.089736802707
+CG324 HGR63 1 0.249451641079 0.089736802707
+CG324 HGR71 1 0.290272620344 0.072469005789
+CG324 CG1T1 1 0.333196120584 0.170981810495
+CG324 CG1T2 1 0.346782326036 0.134409982486
+CG324 CG1N1 1 0.335868816739 0.177512086349
+CG324 CG2D1 1 0.355468588538 0.109105371453
+CG324 CG2D2 1 0.354577689820 0.105847757841
+CG324 CG2D1O 1 0.355468588538 0.109105371453
+CG324 CG2D2O 1 0.355468588538 0.109105371453
+CG324 CG2DC1 1 0.355468588538 0.109105371453
+CG324 CG2DC2 1 0.355468588538 0.109105371453
+CG324 CG2DC3 1 0.354577689820 0.105847757841
+CG324 CG25C1 1 0.355468588538 0.109105371453
+CG324 CG25C2 1 0.355468588538 0.109105371453
+CG324 CG251O 1 0.355468588538 0.109105371453
+CG324 CG252O 1 0.355468588538 0.109105371453
+CG324 CG2N1 1 0.347450500075 0.138767581228
+CG324 CG2N2 1 0.347450500075 0.138767581228
+CG324 CG2O1 1 0.347450500075 0.138767581228
+CG324 CG2O2 1 0.320723538531 0.130979917850
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+CG324 CG2O4 1 0.329632525712 0.102486650838
+CG324 CG2O5 1 0.347450500075 0.125520000000
+CG324 CG2O6 1 0.347450500075 0.110698234855
+CG324 CG2O7 1 0.308518226092 0.100764063435
+CG324 CG2R51 1 0.356359487256 0.093557084179
+CG324 CG2R52 1 0.365268474438 0.059170695450
+CG324 CG2R53 1 0.365268474438 0.059170695450
+CG324 CG2R57 1 0.356359487256 0.093557084179
+CG324 CG2R61 1 0.346773417049 0.110698234855
+CG324 CG2R62 1 0.338541512893 0.125520000000
+CG324 CG2R63 1 0.338541512893 0.132309697301
+CG324 CG2R64 1 0.356359487256 0.083680000000
+CG324 CG2R66 1 0.338541512893 0.110698234855
+CG324 CG2R67 1 0.346773417049 0.110698234855
+CG324 CG2RC0 1 0.334977918021 0.131646486622
+CG324 CG2R71 1 0.346987232741 0.108300154755
+CG324 CG2RC7 1 0.334977918021 0.131646486622
+CG324 CG301 1 0.338541512893 0.041840000000
+CG324 CG302 1 0.374177461619 0.059170695450
+CG324 CG311 1 0.338541512893 0.041840000000
+CG324 CG312 1 0.351904993665 0.085746484010
+CG324 CG314 1 0.338541512893 0.041840000000
+CG324 CG321 1 0.338541512893 0.041840000000
+CG324 CG322 1 0.338541512893 0.102486650838
+CG324 CG323 1 0.365268474438 0.138767581228
+CG324 CG324 1 0.338541512893 0.041840000000
+CG324 CG331 1 0.338541512893 0.041840000000
+CG324 CG334 1 0.338541512893 0.041840000000
+CG324 CG3C50 1 0.338541512893 0.041840000000
+CG324 CG3C51 1 0.338541512893 0.041840000000
+CG324 CG3C52 1 0.338541512893 0.041840000000
+CG324 CG3C53 1 0.338541512893 0.041840000000
+CG324 CG3C54 1 0.338541512893 0.041840000000
+CG324 CG3C31 1 0.338541512893 0.041840000000
+CG324 CG3C41 1 0.338541512893 0.041840000000
+CG324 CG3RC1 1 0.338541512893 0.041840000000
+CG324 CG3AM0 1 0.344777803920 0.110698234855
+CG324 CG3AM1 1 0.345668702638 0.116852760686
+CG324 CG3AM2 1 0.346559601357 0.118341390899
+CG324 NG1T1 1 0.328741626994 0.177512086349
+CG324 NG2D1 1 0.334087019303 0.187114168357
+CG324 NG2S0 1 0.334087019303 0.004184000000
+CG324 NG2S1 1 0.307360057758 0.187114168357
+CG324 NG2S2 1 0.334087019303 0.187114168357
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+CG331 CG3AM0 1 0.344777803920 0.110698234855
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+CG331 NG1T1 1 0.328741626994 0.177512086349
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+CG331 NG2R43 1 0.334087019303 0.187114168357
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+CG334 CG331 1 0.338541512893 0.041840000000
+CG334 CG334 1 0.338541512893 0.041840000000
+CG334 CG3C50 1 0.338541512893 0.041840000000
+CG334 CG3C51 1 0.338541512893 0.041840000000
+CG334 CG3C52 1 0.338541512893 0.041840000000
+CG334 CG3C53 1 0.338541512893 0.041840000000
+CG334 CG3C54 1 0.338541512893 0.041840000000
+CG334 CG3C31 1 0.338541512893 0.041840000000
+CG334 CG3C41 1 0.338541512893 0.041840000000
+CG334 CG3RC1 1 0.338541512893 0.041840000000
+CG334 CG3AM0 1 0.344777803920 0.110698234855
+CG334 CG3AM1 1 0.345668702638 0.116852760686
+CG334 CG3AM2 1 0.346559601357 0.118341390899
+CG334 NG1T1 1 0.328741626994 0.177512086349
+CG334 NG2D1 1 0.334087019303 0.187114168357
+CG334 NG2S0 1 0.334087019303 0.004184000000
+CG334 NG2S1 1 0.307360057758 0.187114168357
+CG334 NG2S2 1 0.334087019303 0.187114168357
+CG334 NG2S3 1 0.334087019303 0.187114168357
+CG334 NG2O1 1 0.334087019303 0.187114168357
+CG334 NG2P1 1 0.334087019303 0.187114168357
+CG334 NG2R43 1 0.334087019303 0.187114168357
+CG334 NG2R50 1 0.334087019303 0.187114168357
+CG334 NG2R51 1 0.334087019303 0.187114168357
+CG334 NG2R52 1 0.334087019303 0.187114168357
+CG334 NG2R53 1 0.334087019303 0.187114168357
+CG334 NG2R57 1 0.334087019303 0.187114168357
+CG334 NG2R60 1 0.337650614175 0.102486650838
+CG334 NG2R61 1 0.334087019303 0.187114168357
+CG334 NG2R62 1 0.352795892384 0.093557084179
+CG334 NG2R67 1 0.334087019303 0.187114168357
+CG334 NG2RC0 1 0.334087019303 0.187114168357
+CG334 NG301 1 0.347450500075 0.078275472531
+CG334 NG311 1 0.347450500075 0.088756043175
+CG334 NG321 1 0.346559601357 0.102486650838
+CG334 NG331 1 0.345668702638 0.110698234855
+CG334 NG3C51 1 0.334087019303 0.187114168357
+CG334 NG3N1 1 0.351904993665 0.102486650838
+CG334 NG3P0 1 0.334087019303 0.187114168357
+CG334 NG3P1 1 0.334087019303 0.187114168357
+CG334 NG3P2 1 0.334087019303 0.187114168357
+CG334 NG3P3 1 0.334087019303 0.187114168357
+CG334 OG2D1 1 0.293996576986 0.144938011577
+CG334 OG2D2 1 0.320723538531 0.144938011577
+CG334 OG2D3 1 0.293996576986 0.144938011577
+CG334 OG2D4 1 0.320723538531 0.144938011577
+CG334 OG2D5 1 0.320010819556 0.169954883425
+CG334 OG2N1 1 0.320723538531 0.144938011577
+CG334 OG2P1 1 0.320723538531 0.144938011577
+CG334 OG2R50 1 0.320723538531 0.144938011577
+CG334 OG3R60 1 0.316269044940 0.132309697301
+CG334 OG301 1 0.316269044940 0.132309697301
+CG334 OG302 1 0.316269044940 0.132309697301
+CG334 OG303 1 0.316269044940 0.132309697301
+CG334 OG304 1 0.316269044940 0.132309697301
+CG334 OG311 1 0.326514380198 0.183381431383
+CG334 OG312 1 0.325178032121 0.144938011577
+CG334 OG3C31 1 0.316269044940 0.132309697301
+CG334 OG3C51 1 0.316269044940 0.132309697301
+CG334 OG3C61 1 0.316269044940 0.132309697301
+CG334 SG2D1 1 0.351904993665 0.314496560236
+CG334 SG2R50 1 0.347450500075 0.280671252536
+CG334 SG311 1 0.347450500075 0.280671252536
+CG334 SG301 1 0.345223253279 0.257919081884
+CG334 SG302 1 0.365268474438 0.286840588481
+CG334 SG3O1 1 0.356359487256 0.286840588481
+CG334 SG3O2 1 0.347450500075 0.247528778125
+CG334 SG3O3 1 0.347450500075 0.247528778125
+CG334 FGA1 1 0.314487247504 0.153729976257
+CG334 FGA2 1 0.314487247504 0.135577095411
+CG334 FGA3 1 0.311814551349 0.130309939452
+CG334 FGP1 1 0.311814551349 0.130309939452
+CG334 FGR1 1 0.320723538531 0.144938011577
+CG334 CLGA1 1 0.339432411611 0.245040988571
+CG334 CLGA3 1 0.339432411611 0.232955260941
+CG334 CLGR1 1 0.341214209048 0.236682781799
+CG334 BRGA1 1 0.344777803920 0.289876023155
+CG334 BRGA2 1 0.351904993665 0.304599797767
+CG334 BRGA3 1 0.347450500075 0.307459952514
+CG334 BRGR1 1 0.353686791102 0.271154190821
+CG334 IGR1 1 0.364377575719 0.310293744700
+CG334 PG0 1 0.360813980847 0.320014464673
+CG334 PG1 1 0.360813980847 0.320014464673
+CG334 PG2 1 0.360813980847 0.320014464673
+CG334 ALG1 1 0.347450500075 0.337324864189
+CG334 CC301 1 0.338541512893 0.041840000000
+CG334 CC3062 1 0.338541512893 0.041840000000
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+CG334 CC3161 1 0.338541512893 0.041840000000
+CG334 CC3162 1 0.338541512893 0.041840000000
+CG334 CC3163 1 0.338541512893 0.041840000000
+CG334 CC321 1 0.338541512893 0.041840000000
+CG334 CC3261 1 0.338541512893 0.041840000000
+CG334 CC3263 1 0.338541512893 0.041840000000
+CG334 CC331 1 0.338541512893 0.041840000000
+CG334 CC2O1 1 0.347450500075 0.138767581228
+CG334 CC2O2 1 0.347450500075 0.110698234855
+CG334 CC2O3 1 0.347450500075 0.125520000000
+CG334 CC2O4 1 0.329632525712 0.102486650838
+CG334 OC2D1 1 0.293996576986 0.144938011577
+CG334 OC2D2 1 0.320723538531 0.144938011577
+CG334 OC2D3 1 0.293996576986 0.144938011577
+CG334 OC2D4 1 0.293996576986 0.144938011577
+CG334 OC3C61 1 0.316269044940 0.132309697301
+CG334 OC311 1 0.326514380198 0.183381431383
+CG334 NC2D1 1 0.307360057758 0.187114168357
+CG334 HCP1 1 0.189271432669 0.089736802707
+CG334 HCA1 1 0.288651184677 0.088756043175
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+CG334 HCA3 1 0.288651184677 0.064818249282
+CG334 CC312 1 0.338541512893 0.041840000000
+CG334 CC322 1 0.338541512893 0.041840000000
+CG334 HCR1 1 0.240542653898 0.089736802707
+CG334 HCA3M 1 0.288651184677 0.064818249282
+CG334 CC321C 1 0.338541512893 0.041840000000
+CG334 CC321D 1 0.338541512893 0.041840000000
+CG334 CC311C 1 0.338541512893 0.041840000000
+CG334 CC311D 1 0.338541512893 0.041840000000
+CG334 OC301 1 0.316269044940 0.132309697301
+CG334 OC302 1 0.316269044940 0.132309697301
+CG334 HCP1M 1 0.189271432669 0.089736802707
+CG334 OC311M 1 0.326514380198 0.183381431383
+CG334 OC3C5M 1 0.316269044940 0.132309697301
+CG334 CC322C 1 0.338541512893 0.041840000000
+CG334 HCA2C2 1 0.285087589805 0.078275472531
+CG334 CC312C 1 0.338541512893 0.041840000000
+CG334 HCA1C2 1 0.288651184677 0.088756043175
+CG334 OC3C51 1 0.316269044940 0.132309697301
+CG334 CC3152 1 0.338541512893 0.041840000000
+CG334 CC3051 1 0.338541512893 0.041840000000
+CG334 CC3251 1 0.338541512893 0.041840000000
+CG334 CC3151 1 0.338541512893 0.041840000000
+CG334 CC3153 1 0.338541512893 0.041840000000
+CG334 OC2DP 1 0.320723538531 0.144938011577
+CG334 OC312 1 0.326959829558 0.163176000000
+CG334 OC30P 1 0.326959829558 0.163176000000
+CG334 PC 1 0.360813980847 0.320014464673
+CG334 SC 1 0.356359487256 0.286840588481
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+CG334 OC303 1 0.316269044940 0.132309697301
+CG334 HN1 1 0.189271432669 0.089736802707
+CG334 HN2 1 0.189271432669 0.089736802707
+CG334 HN3 1 0.267269615442 0.089736802707
+CG334 HN4 1 0.189271432669 0.089736802707
+CG334 HN5 1 0.189271432669 0.089736802707
+CG334 HN6 1 0.286869387241 0.062058748940
+CG334 HN7 1 0.286869387241 0.062058748940
+CG334 HN8 1 0.288651184677 0.070011711020
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+CG334 NN1 1 0.334087019303 0.187114168357
+CG334 NN2 1 0.334087019303 0.187114168357
+CG334 NN2B 1 0.334087019303 0.187114168357
+CG334 NN2G 1 0.334087019303 0.187114168357
+CG334 NN2U 1 0.334087019303 0.187114168357
+CG334 NN3 1 0.334087019303 0.187114168357
+CG334 NN3A 1 0.334087019303 0.187114168357
+CG334 NN3G 1 0.334087019303 0.187114168357
+CG334 NN4 1 0.334087019303 0.187114168357
+CG334 NN6 1 0.334087019303 0.187114168357
+CG334 ON1 1 0.320723538531 0.144938011577
+CG334 ON1C 1 0.320723538531 0.144938011577
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+CG334 ON4 1 0.326959829558 0.163176000000
+CG334 ON5 1 0.326959829558 0.163176000000
+CG334 ON6 1 0.326959829558 0.163176000000
+CG334 ON6B 1 0.326959829558 0.163176000000
+CG334 CN1 1 0.338541512893 0.132309697301
+CG334 CN1T 1 0.338541512893 0.132309697301
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+CG334 CN3T 1 0.338541512893 0.125520000000
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+CG334 CN5G 1 0.338541512893 0.114583559030
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+CG334 P 1 0.360813980847 0.320014464673
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+CG334 HAL1 1 0.286869387241 0.062058748940
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+CG334 HBL 1 0.286869387241 0.062058748940
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+CG334 HL 1 0.231633666716 0.089736802707
+CG334 HEL1 1 0.280633096214 0.073666921749
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+CG334 CL 1 0.347450500075 0.110698234855
+CG334 CCL 1 0.347450500075 0.110698234855
+CG334 CTL1 1 0.338541512893 0.041840000000
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+CG334 CTL5 1 0.338541512893 0.041840000000
+CG334 CEL1 1 0.355468588538 0.109105371453
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+CG334 OBL 1 0.293996576986 0.144938011577
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+CG334 OSL 1 0.316269044940 0.132309697301
+CG334 OSLP 1 0.316269044940 0.132309697301
+CG334 NH3L 1 0.334087019303 0.187114168357
+CG334 NTL 1 0.334087019303 0.187114168357
+CG334 SL 1 0.356359487256 0.286840588481
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+CG3C50 H 1 0.189271432669 0.089736802707
+CG3C50 HA 1 0.286869387241 0.062058748940
+CG3C50 HB1 1 0.286869387241 0.062058748940
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+CG3C50 HE1 1 0.280633096214 0.073666921749
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+CG3C50 HP 1 0.290272620344 0.072469005789
+CG3C50 HR1 1 0.249451641079 0.089736802707
+CG3C50 HR2 1 0.231633666716 0.089736802707
+CG3C50 HR3 1 0.300054688270 0.036952087465
+CG3C50 HS 1 0.209361198763 0.132309697301
+CG3C50 HA1 1 0.288651184677 0.088756043175
+CG3C50 HA2 1 0.288651184677 0.077149148019
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+CG3C50 N 1 0.334087019303 0.004184000000
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+CG3C50 NH1 1 0.307360057758 0.187114168357
+CG3C50 NH2 1 0.334087019303 0.187114168357
+CG3C50 NH3 1 0.334087019303 0.187114168357
+CG3C50 NP 1 0.334087019303 0.187114168357
+CG3C50 NR1 1 0.334087019303 0.187114168357
+CG3C50 NR2 1 0.334087019303 0.187114168357
+CG3C50 NR3 1 0.334087019303 0.187114168357
+CG3C50 NY 1 0.334087019303 0.187114168357
+CG3C50 O 1 0.293996576986 0.144938011577
+CG3C50 OB 1 0.293996576986 0.144938011577
+CG3C50 OC 1 0.320723538531 0.144938011577
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+CG3C50 OS 1 0.326959829558 0.163176000000
+CG3C50 S 1 0.347450500075 0.280671252536
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+CG3C50 HT 1 0.189271432669 0.089736802707
+CG3C50 OT 1 0.326799467788 0.163176000000
+CG3C50 OX 1 0.320723538531 0.144938011577
+CG3C50 HX 1 0.189271432669 0.089736802707
+CG3C50 LIT 1 0.284864865125 0.020196198771
+CG3C50 SOD 1 0.294954293108 0.090610410351
+CG3C50 MG 1 0.274842254546 0.051243325419
+CG3C50 POT 1 0.326403017859 0.123410269913
+CG3C50 CAL 1 0.291056611216 0.144938011577
+CG3C50 RUB 1 0.338541512893 0.162045623205
+CG3C50 CES 1 0.356359487256 0.182376331798
+CG3C50 BAR 1 0.337650614175 0.162045623205
+CG3C50 ZN 1 0.266378716724 0.209200000000
+CG3C50 CAD 1 0.290165712498 0.144938011577
+CG3C50 CLA 1 0.371504765465 0.162045623205
+CG3C50 HGA1 1 0.288651184677 0.088756043175
+CG3C50 HGA2 1 0.288651184677 0.078275472531
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+CG3C50 HGA4 1 0.280633096214 0.073666921749
+CG3C50 HGA5 1 0.281523994932 0.067464972838
+CG3C50 HGA6 1 0.286869387241 0.070011711020
+CG3C50 HGA7 1 0.285087589805 0.072469005789
+CG3C50 HGAAM0 1 0.283305792369 0.070011711020
+CG3C50 HGAAM1 1 0.283305792369 0.070011711020
+CG3C50 HGAAM2 1 0.281523994932 0.083680000000
+CG3C50 HGP1 1 0.189271432669 0.089736802707
+CG3C50 HGP2 1 0.189271432669 0.089736802707
+CG3C50 HGP3 1 0.209361198763 0.132309697301
+CG3C50 HGP4 1 0.189271432669 0.089736802707
+CG3C50 HGP5 1 0.231633666716 0.089736802707
+CG3C50 HGPAM1 1 0.247224394284 0.039692909190
+CG3C50 HGPAM2 1 0.247224394284 0.041840000000
+CG3C50 HGPAM3 1 0.246778944925 0.045833423612
+CG3C50 HGR51 1 0.290272620344 0.072469005789
+CG3C50 HGR52 1 0.249451641079 0.089736802707
+CG3C50 HGR53 1 0.231633666716 0.089736802707
+CG3C50 HGR61 1 0.290272620344 0.072469005789
+CG3C50 HGR62 1 0.267269615442 0.089736802707
+CG3C50 HGR63 1 0.249451641079 0.089736802707
+CG3C50 HGR71 1 0.290272620344 0.072469005789
+CG3C50 CG1T1 1 0.333196120584 0.170981810495
+CG3C50 CG1T2 1 0.346782326036 0.134409982486
+CG3C50 CG1N1 1 0.335868816739 0.177512086349
+CG3C50 CG2D1 1 0.355468588538 0.109105371453
+CG3C50 CG2D2 1 0.354577689820 0.105847757841
+CG3C50 CG2D1O 1 0.355468588538 0.109105371453
+CG3C50 CG2D2O 1 0.355468588538 0.109105371453
+CG3C50 CG2DC1 1 0.355468588538 0.109105371453
+CG3C50 CG2DC2 1 0.355468588538 0.109105371453
+CG3C50 CG2DC3 1 0.354577689820 0.105847757841
+CG3C50 CG25C1 1 0.355468588538 0.109105371453
+CG3C50 CG25C2 1 0.355468588538 0.109105371453
+CG3C50 CG251O 1 0.355468588538 0.109105371453
+CG3C50 CG252O 1 0.355468588538 0.109105371453
+CG3C50 CG2N1 1 0.347450500075 0.138767581228
+CG3C50 CG2N2 1 0.347450500075 0.138767581228
+CG3C50 CG2O1 1 0.347450500075 0.138767581228
+CG3C50 CG2O2 1 0.320723538531 0.130979917850
+CG3C50 CG2O3 1 0.347450500075 0.110698234855
+CG3C50 CG2O4 1 0.329632525712 0.102486650838
+CG3C50 CG2O5 1 0.347450500075 0.125520000000
+CG3C50 CG2O6 1 0.347450500075 0.110698234855
+CG3C50 CG2O7 1 0.308518226092 0.100764063435
+CG3C50 CG2R51 1 0.356359487256 0.093557084179
+CG3C50 CG2R52 1 0.365268474438 0.059170695450
+CG3C50 CG2R53 1 0.365268474438 0.059170695450
+CG3C50 CG2R57 1 0.356359487256 0.093557084179
+CG3C50 CG2R61 1 0.346773417049 0.110698234855
+CG3C50 CG2R62 1 0.338541512893 0.125520000000
+CG3C50 CG2R63 1 0.338541512893 0.132309697301
+CG3C50 CG2R64 1 0.356359487256 0.083680000000
+CG3C50 CG2R66 1 0.338541512893 0.110698234855
+CG3C50 CG2R67 1 0.346773417049 0.110698234855
+CG3C50 CG2RC0 1 0.334977918021 0.131646486622
+CG3C50 CG2R71 1 0.346987232741 0.108300154755
+CG3C50 CG2RC7 1 0.334977918021 0.131646486622
+CG3C50 CG301 1 0.338541512893 0.041840000000
+CG3C50 CG302 1 0.374177461619 0.059170695450
+CG3C50 CG311 1 0.338541512893 0.041840000000
+CG3C50 CG312 1 0.351904993665 0.085746484010
+CG3C50 CG314 1 0.338541512893 0.041840000000
+CG3C50 CG321 1 0.338541512893 0.041840000000
+CG3C50 CG322 1 0.338541512893 0.102486650838
+CG3C50 CG323 1 0.365268474438 0.138767581228
+CG3C50 CG324 1 0.338541512893 0.041840000000
+CG3C50 CG331 1 0.338541512893 0.041840000000
+CG3C50 CG334 1 0.338541512893 0.041840000000
+CG3C50 CG3C50 1 0.338541512893 0.041840000000
+CG3C50 CG3C51 1 0.338541512893 0.041840000000
+CG3C50 CG3C52 1 0.338541512893 0.041840000000
+CG3C50 CG3C53 1 0.338541512893 0.041840000000
+CG3C50 CG3C54 1 0.338541512893 0.041840000000
+CG3C50 CG3C31 1 0.338541512893 0.041840000000
+CG3C50 CG3C41 1 0.338541512893 0.041840000000
+CG3C50 CG3RC1 1 0.338541512893 0.041840000000
+CG3C50 CG3AM0 1 0.344777803920 0.110698234855
+CG3C50 CG3AM1 1 0.345668702638 0.116852760686
+CG3C50 CG3AM2 1 0.346559601357 0.118341390899
+CG3C50 NG1T1 1 0.328741626994 0.177512086349
+CG3C50 NG2D1 1 0.334087019303 0.187114168357
+CG3C50 NG2S0 1 0.334087019303 0.004184000000
+CG3C50 NG2S1 1 0.307360057758 0.187114168357
+CG3C50 NG2S2 1 0.334087019303 0.187114168357
+CG3C50 NG2S3 1 0.334087019303 0.187114168357
+CG3C50 NG2O1 1 0.334087019303 0.187114168357
+CG3C50 NG2P1 1 0.334087019303 0.187114168357
+CG3C50 NG2R43 1 0.334087019303 0.187114168357
+CG3C50 NG2R50 1 0.334087019303 0.187114168357
+CG3C50 NG2R51 1 0.334087019303 0.187114168357
+CG3C50 NG2R52 1 0.334087019303 0.187114168357
+CG3C50 NG2R53 1 0.334087019303 0.187114168357
+CG3C50 NG2R57 1 0.334087019303 0.187114168357
+CG3C50 NG2R60 1 0.337650614175 0.102486650838
+CG3C50 NG2R61 1 0.334087019303 0.187114168357
+CG3C50 NG2R62 1 0.352795892384 0.093557084179
+CG3C50 NG2R67 1 0.334087019303 0.187114168357
+CG3C50 NG2RC0 1 0.334087019303 0.187114168357
+CG3C50 NG301 1 0.347450500075 0.078275472531
+CG3C50 NG311 1 0.347450500075 0.088756043175
+CG3C50 NG321 1 0.346559601357 0.102486650838
+CG3C50 NG331 1 0.345668702638 0.110698234855
+CG3C50 NG3C51 1 0.334087019303 0.187114168357
+CG3C50 NG3N1 1 0.351904993665 0.102486650838
+CG3C50 NG3P0 1 0.334087019303 0.187114168357
+CG3C50 NG3P1 1 0.334087019303 0.187114168357
+CG3C50 NG3P2 1 0.334087019303 0.187114168357
+CG3C50 NG3P3 1 0.334087019303 0.187114168357
+CG3C50 OG2D1 1 0.293996576986 0.144938011577
+CG3C50 OG2D2 1 0.320723538531 0.144938011577
+CG3C50 OG2D3 1 0.293996576986 0.144938011577
+CG3C50 OG2D4 1 0.320723538531 0.144938011577
+CG3C50 OG2D5 1 0.320010819556 0.169954883425
+CG3C50 OG2N1 1 0.320723538531 0.144938011577
+CG3C50 OG2P1 1 0.320723538531 0.144938011577
+CG3C50 OG2R50 1 0.320723538531 0.144938011577
+CG3C50 OG3R60 1 0.316269044940 0.132309697301
+CG3C50 OG301 1 0.316269044940 0.132309697301
+CG3C50 OG302 1 0.316269044940 0.132309697301
+CG3C50 OG303 1 0.316269044940 0.132309697301
+CG3C50 OG304 1 0.316269044940 0.132309697301
+CG3C50 OG311 1 0.326514380198 0.183381431383
+CG3C50 OG312 1 0.325178032121 0.144938011577
+CG3C50 OG3C31 1 0.316269044940 0.132309697301
+CG3C50 OG3C51 1 0.316269044940 0.132309697301
+CG3C50 OG3C61 1 0.316269044940 0.132309697301
+CG3C50 SG2D1 1 0.351904993665 0.314496560236
+CG3C50 SG2R50 1 0.347450500075 0.280671252536
+CG3C50 SG311 1 0.347450500075 0.280671252536
+CG3C50 SG301 1 0.345223253279 0.257919081884
+CG3C50 SG302 1 0.365268474438 0.286840588481
+CG3C50 SG3O1 1 0.356359487256 0.286840588481
+CG3C50 SG3O2 1 0.347450500075 0.247528778125
+CG3C50 SG3O3 1 0.347450500075 0.247528778125
+CG3C50 FGA1 1 0.314487247504 0.153729976257
+CG3C50 FGA2 1 0.314487247504 0.135577095411
+CG3C50 FGA3 1 0.311814551349 0.130309939452
+CG3C50 FGP1 1 0.311814551349 0.130309939452
+CG3C50 FGR1 1 0.320723538531 0.144938011577
+CG3C50 CLGA1 1 0.339432411611 0.245040988571
+CG3C50 CLGA3 1 0.339432411611 0.232955260941
+CG3C50 CLGR1 1 0.341214209048 0.236682781799
+CG3C50 BRGA1 1 0.344777803920 0.289876023155
+CG3C50 BRGA2 1 0.351904993665 0.304599797767
+CG3C50 BRGA3 1 0.347450500075 0.307459952514
+CG3C50 BRGR1 1 0.353686791102 0.271154190821
+CG3C50 IGR1 1 0.364377575719 0.310293744700
+CG3C50 PG0 1 0.360813980847 0.320014464673
+CG3C50 PG1 1 0.360813980847 0.320014464673
+CG3C50 PG2 1 0.360813980847 0.320014464673
+CG3C50 ALG1 1 0.347450500075 0.337324864189
+CG3C50 CC301 1 0.338541512893 0.041840000000
+CG3C50 CC3062 1 0.338541512893 0.041840000000
+CG3C50 CC311 1 0.338541512893 0.041840000000
+CG3C50 CC3161 1 0.338541512893 0.041840000000
+CG3C50 CC3162 1 0.338541512893 0.041840000000
+CG3C50 CC3163 1 0.338541512893 0.041840000000
+CG3C50 CC321 1 0.338541512893 0.041840000000
+CG3C50 CC3261 1 0.338541512893 0.041840000000
+CG3C50 CC3263 1 0.338541512893 0.041840000000
+CG3C50 CC331 1 0.338541512893 0.041840000000
+CG3C50 CC2O1 1 0.347450500075 0.138767581228
+CG3C50 CC2O2 1 0.347450500075 0.110698234855
+CG3C50 CC2O3 1 0.347450500075 0.125520000000
+CG3C50 CC2O4 1 0.329632525712 0.102486650838
+CG3C50 OC2D1 1 0.293996576986 0.144938011577
+CG3C50 OC2D2 1 0.320723538531 0.144938011577
+CG3C50 OC2D3 1 0.293996576986 0.144938011577
+CG3C50 OC2D4 1 0.293996576986 0.144938011577
+CG3C50 OC3C61 1 0.316269044940 0.132309697301
+CG3C50 OC311 1 0.326514380198 0.183381431383
+CG3C50 NC2D1 1 0.307360057758 0.187114168357
+CG3C50 HCP1 1 0.189271432669 0.089736802707
+CG3C50 HCA1 1 0.288651184677 0.088756043175
+CG3C50 HCA2 1 0.288651184677 0.078275472531
+CG3C50 HCA3 1 0.288651184677 0.064818249282
+CG3C50 CC312 1 0.338541512893 0.041840000000
+CG3C50 CC322 1 0.338541512893 0.041840000000
+CG3C50 HCR1 1 0.240542653898 0.089736802707
+CG3C50 HCA3M 1 0.288651184677 0.064818249282
+CG3C50 CC321C 1 0.338541512893 0.041840000000
+CG3C50 CC321D 1 0.338541512893 0.041840000000
+CG3C50 CC311C 1 0.338541512893 0.041840000000
+CG3C50 CC311D 1 0.338541512893 0.041840000000
+CG3C50 OC301 1 0.316269044940 0.132309697301
+CG3C50 OC302 1 0.316269044940 0.132309697301
+CG3C50 HCP1M 1 0.189271432669 0.089736802707
+CG3C50 OC311M 1 0.326514380198 0.183381431383
+CG3C50 OC3C5M 1 0.316269044940 0.132309697301
+CG3C50 CC322C 1 0.338541512893 0.041840000000
+CG3C50 HCA2C2 1 0.285087589805 0.078275472531
+CG3C50 CC312C 1 0.338541512893 0.041840000000
+CG3C50 HCA1C2 1 0.288651184677 0.088756043175
+CG3C50 OC3C51 1 0.316269044940 0.132309697301
+CG3C50 CC3152 1 0.338541512893 0.041840000000
+CG3C50 CC3051 1 0.338541512893 0.041840000000
+CG3C50 CC3251 1 0.338541512893 0.041840000000
+CG3C50 CC3151 1 0.338541512893 0.041840000000
+CG3C50 CC3153 1 0.338541512893 0.041840000000
+CG3C50 OC2DP 1 0.320723538531 0.144938011577
+CG3C50 OC312 1 0.326959829558 0.163176000000
+CG3C50 OC30P 1 0.326959829558 0.163176000000
+CG3C50 PC 1 0.360813980847 0.320014464673
+CG3C50 SC 1 0.356359487256 0.286840588481
+CG3C50 CC312D 1 0.338541512893 0.041840000000
+CG3C50 OC303 1 0.316269044940 0.132309697301
+CG3C50 HN1 1 0.189271432669 0.089736802707
+CG3C50 HN2 1 0.189271432669 0.089736802707
+CG3C50 HN3 1 0.267269615442 0.089736802707
+CG3C50 HN4 1 0.189271432669 0.089736802707
+CG3C50 HN5 1 0.189271432669 0.089736802707
+CG3C50 HN6 1 0.286869387241 0.062058748940
+CG3C50 HN7 1 0.286869387241 0.062058748940
+CG3C50 HN8 1 0.288651184677 0.070011711020
+CG3C50 HN9 1 0.288651184677 0.064818249282
+CG3C50 NN1 1 0.334087019303 0.187114168357
+CG3C50 NN2 1 0.334087019303 0.187114168357
+CG3C50 NN2B 1 0.334087019303 0.187114168357
+CG3C50 NN2G 1 0.334087019303 0.187114168357
+CG3C50 NN2U 1 0.334087019303 0.187114168357
+CG3C50 NN3 1 0.334087019303 0.187114168357
+CG3C50 NN3A 1 0.334087019303 0.187114168357
+CG3C50 NN3G 1 0.334087019303 0.187114168357
+CG3C50 NN4 1 0.334087019303 0.187114168357
+CG3C50 NN6 1 0.334087019303 0.187114168357
+CG3C50 ON1 1 0.320723538531 0.144938011577
+CG3C50 ON1C 1 0.320723538531 0.144938011577
+CG3C50 ON2 1 0.326959829558 0.163176000000
+CG3C50 ON3 1 0.320723538531 0.144938011577
+CG3C50 ON4 1 0.326959829558 0.163176000000
+CG3C50 ON5 1 0.326959829558 0.163176000000
+CG3C50 ON6 1 0.326959829558 0.163176000000
+CG3C50 ON6B 1 0.326959829558 0.163176000000
+CG3C50 CN1 1 0.338541512893 0.132309697301
+CG3C50 CN1T 1 0.338541512893 0.132309697301
+CG3C50 CN2 1 0.338541512893 0.132309697301
+CG3C50 CN3 1 0.338541512893 0.125520000000
+CG3C50 CN3T 1 0.338541512893 0.125520000000
+CG3C50 CN4 1 0.338541512893 0.114583559030
+CG3C50 CN5 1 0.338541512893 0.114583559030
+CG3C50 CN5G 1 0.338541512893 0.114583559030
+CG3C50 CN7 1 0.338541512893 0.041840000000
+CG3C50 CN7B 1 0.338541512893 0.041840000000
+CG3C50 CN8 1 0.338541512893 0.041840000000
+CG3C50 CN8B 1 0.338541512893 0.041840000000
+CG3C50 CN9 1 0.338541512893 0.041840000000
+CG3C50 P 1 0.360813980847 0.320014464673
+CG3C50 P2 1 0.360813980847 0.320014464673
+CG3C50 HOL 1 0.189271432669 0.089736802707
+CG3C50 HAL1 1 0.286869387241 0.062058748940
+CG3C50 HAL2 1 0.288651184677 0.070011711020
+CG3C50 HAL3 1 0.288651184677 0.064818249282
+CG3C50 HBL 1 0.286869387241 0.062058748940
+CG3C50 HCL 1 0.189271432669 0.089736802707
+CG3C50 HL 1 0.231633666716 0.089736802707
+CG3C50 HEL1 1 0.280633096214 0.073666921749
+CG3C50 HEL2 1 0.281523994932 0.067464972838
+CG3C50 CL 1 0.347450500075 0.110698234855
+CG3C50 CCL 1 0.347450500075 0.110698234855
+CG3C50 CTL1 1 0.338541512893 0.041840000000
+CG3C50 CTL2 1 0.338541512893 0.041840000000
+CG3C50 CTL3 1 0.338541512893 0.041840000000
+CG3C50 CTL5 1 0.338541512893 0.041840000000
+CG3C50 CEL1 1 0.355468588538 0.109105371453
+CG3C50 CEL2 1 0.354577689820 0.105847757841
+CG3C50 CRL1 1 0.338541512893 0.041840000000
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+CG3C50 OBL 1 0.293996576986 0.144938011577
+CG3C50 OCL 1 0.320723538531 0.144938011577
+CG3C50 O2L 1 0.320723538531 0.144938011577
+CG3C50 OHL 1 0.326959829558 0.163176000000
+CG3C50 OSL 1 0.316269044940 0.132309697301
+CG3C50 OSLP 1 0.316269044940 0.132309697301
+CG3C50 NH3L 1 0.334087019303 0.187114168357
+CG3C50 NTL 1 0.334087019303 0.187114168357
+CG3C50 SL 1 0.356359487256 0.286840588481
+CG3C50 PL 1 0.360813980847 0.320014464673
+CG3C50 HCA1A 1 0.288651184677 0.088756043175
+CG3C50 HCA2A 1 0.288651184677 0.078275472531
+CG3C50 HCA3A 1 0.288651184677 0.064818249282
+CG3C50 CC30A 1 0.338541512893 0.041840000000
+CG3C50 CC31A 1 0.338541512893 0.041840000000
+CG3C50 CC32A 1 0.338541512893 0.041840000000
+CG3C50 CC33A 1 0.338541512893 0.041840000000
+CG3C50 CC326A 1 0.338541512893 0.041840000000
+CG3C50 HCA25A 1 0.285087589805 0.078275472531
+CG3C50 CC325A 1 0.338541512893 0.041840000000
+CG3C50 CC325B 1 0.338541512893 0.041840000000
+CG3C50 OC305A 1 0.316269044940 0.132309697301
+CG3C50 OC30A 1 0.316269044940 0.132309697301
+CG3C50 CPA 1 0.329632525712 0.125520000000
+CG3C50 CPB 1 0.329632525712 0.125520000000
+CG3C50 CPM 1 0.329632525712 0.125520000000
+CG3C50 CM 1 0.356359487256 0.138767581228
+CG3C50 CST 1 0.308518226092 0.100764063435
+CG3C50 NPH 1 0.334087019303 0.187114168357
+CG3C50 OM 1 0.320723538531 0.144938011577
+CG3C50 OST 1 0.320010819556 0.169954883425
+CG3C50 FE 1 0.227179173126 0.000000000000
+CG3C50 ON2B 1 0.326959829558 0.163176000000
+CG3C50 SP 1 0.365268474438 0.280671252536
+CG3C51 C 1 0.347450500075 0.138767581228
+CG3C51 CA 1 0.346773417049 0.110698234855
+CG3C51 CC 1 0.347450500075 0.110698234855
+CG3C51 CD 1 0.347450500075 0.110698234855
+CG3C51 CE1 1 0.355468588538 0.109105371453
+CG3C51 CE2 1 0.354577689820 0.105847757841
+CG3C51 CP1 1 0.338541512893 0.041840000000
+CG3C51 CP2 1 0.338541512893 0.041840000000
+CG3C51 CP3 1 0.338541512893 0.041840000000
+CG3C51 CPH1 1 0.329632525712 0.093557084179
+CG3C51 CPH2 1 0.329632525712 0.093557084179
+CG3C51 CS 1 0.365268474438 0.138767581228
+CG3C51 CPT 1 0.334977918021 0.131646486622
+CG3C51 CY 1 0.346559601357 0.113045454929
+CG3C51 CAI 1 0.346559601357 0.113045454929
+CG3C51 CT 1 0.338541512893 0.041840000000
+CG3C51 CT1 1 0.338541512893 0.041840000000
+CG3C51 CT2 1 0.338541512893 0.041840000000
+CG3C51 CT2A 1 0.338541512893 0.041840000000
+CG3C51 CT3 1 0.338541512893 0.041840000000
+CG3C51 H 1 0.189271432669 0.089736802707
+CG3C51 HA 1 0.286869387241 0.062058748940
+CG3C51 HB1 1 0.286869387241 0.062058748940
+CG3C51 HB2 1 0.288651184677 0.070011711020
+CG3C51 HE1 1 0.280633096214 0.073666921749
+CG3C51 HE2 1 0.281523994932 0.067464972838
+CG3C51 HC 1 0.189271432669 0.089736802707
+CG3C51 HP 1 0.290272620344 0.072469005789
+CG3C51 HR1 1 0.249451641079 0.089736802707
+CG3C51 HR2 1 0.231633666716 0.089736802707
+CG3C51 HR3 1 0.300054688270 0.036952087465
+CG3C51 HS 1 0.209361198763 0.132309697301
+CG3C51 HA1 1 0.288651184677 0.088756043175
+CG3C51 HA2 1 0.288651184677 0.077149148019
+CG3C51 HA3 1 0.288651184677 0.064818249282
+CG3C51 N 1 0.334087019303 0.004184000000
+CG3C51 NC2 1 0.334087019303 0.187114168357
+CG3C51 NH1 1 0.307360057758 0.187114168357
+CG3C51 NH2 1 0.334087019303 0.187114168357
+CG3C51 NH3 1 0.334087019303 0.187114168357
+CG3C51 NP 1 0.334087019303 0.187114168357
+CG3C51 NR1 1 0.334087019303 0.187114168357
+CG3C51 NR2 1 0.334087019303 0.187114168357
+CG3C51 NR3 1 0.334087019303 0.187114168357
+CG3C51 NY 1 0.334087019303 0.187114168357
+CG3C51 O 1 0.293996576986 0.144938011577
+CG3C51 OB 1 0.293996576986 0.144938011577
+CG3C51 OC 1 0.320723538531 0.144938011577
+CG3C51 OH1 1 0.326959829558 0.163176000000
+CG3C51 OS 1 0.326959829558 0.163176000000
+CG3C51 S 1 0.347450500075 0.280671252536
+CG3C51 SM 1 0.345223253279 0.257919081884
+CG3C51 SS 1 0.365268474438 0.286840588481
+CG3C51 HT 1 0.189271432669 0.089736802707
+CG3C51 OT 1 0.326799467788 0.163176000000
+CG3C51 OX 1 0.320723538531 0.144938011577
+CG3C51 HX 1 0.189271432669 0.089736802707
+CG3C51 LIT 1 0.284864865125 0.020196198771
+CG3C51 SOD 1 0.294954293108 0.090610410351
+CG3C51 MG 1 0.274842254546 0.051243325419
+CG3C51 POT 1 0.326403017859 0.123410269913
+CG3C51 CAL 1 0.291056611216 0.144938011577
+CG3C51 RUB 1 0.338541512893 0.162045623205
+CG3C51 CES 1 0.356359487256 0.182376331798
+CG3C51 BAR 1 0.337650614175 0.162045623205
+CG3C51 ZN 1 0.266378716724 0.209200000000
+CG3C51 CAD 1 0.290165712498 0.144938011577
+CG3C51 CLA 1 0.371504765465 0.162045623205
+CG3C51 HGA1 1 0.288651184677 0.088756043175
+CG3C51 HGA2 1 0.288651184677 0.078275472531
+CG3C51 HGA3 1 0.288651184677 0.064818249282
+CG3C51 HGA4 1 0.280633096214 0.073666921749
+CG3C51 HGA5 1 0.281523994932 0.067464972838
+CG3C51 HGA6 1 0.286869387241 0.070011711020
+CG3C51 HGA7 1 0.285087589805 0.072469005789
+CG3C51 HGAAM0 1 0.283305792369 0.070011711020
+CG3C51 HGAAM1 1 0.283305792369 0.070011711020
+CG3C51 HGAAM2 1 0.281523994932 0.083680000000
+CG3C51 HGP1 1 0.189271432669 0.089736802707
+CG3C51 HGP2 1 0.189271432669 0.089736802707
+CG3C51 HGP3 1 0.209361198763 0.132309697301
+CG3C51 HGP4 1 0.189271432669 0.089736802707
+CG3C51 HGP5 1 0.231633666716 0.089736802707
+CG3C51 HGPAM1 1 0.247224394284 0.039692909190
+CG3C51 HGPAM2 1 0.247224394284 0.041840000000
+CG3C51 HGPAM3 1 0.246778944925 0.045833423612
+CG3C51 HGR51 1 0.290272620344 0.072469005789
+CG3C51 HGR52 1 0.249451641079 0.089736802707
+CG3C51 HGR53 1 0.231633666716 0.089736802707
+CG3C51 HGR61 1 0.290272620344 0.072469005789
+CG3C51 HGR62 1 0.267269615442 0.089736802707
+CG3C51 HGR63 1 0.249451641079 0.089736802707
+CG3C51 HGR71 1 0.290272620344 0.072469005789
+CG3C51 CG1T1 1 0.333196120584 0.170981810495
+CG3C51 CG1T2 1 0.346782326036 0.134409982486
+CG3C51 CG1N1 1 0.335868816739 0.177512086349
+CG3C51 CG2D1 1 0.355468588538 0.109105371453
+CG3C51 CG2D2 1 0.354577689820 0.105847757841
+CG3C51 CG2D1O 1 0.355468588538 0.109105371453
+CG3C51 CG2D2O 1 0.355468588538 0.109105371453
+CG3C51 CG2DC1 1 0.355468588538 0.109105371453
+CG3C51 CG2DC2 1 0.355468588538 0.109105371453
+CG3C51 CG2DC3 1 0.354577689820 0.105847757841
+CG3C51 CG25C1 1 0.355468588538 0.109105371453
+CG3C51 CG25C2 1 0.355468588538 0.109105371453
+CG3C51 CG251O 1 0.355468588538 0.109105371453
+CG3C51 CG252O 1 0.355468588538 0.109105371453
+CG3C51 CG2N1 1 0.347450500075 0.138767581228
+CG3C51 CG2N2 1 0.347450500075 0.138767581228
+CG3C51 CG2O1 1 0.347450500075 0.138767581228
+CG3C51 CG2O2 1 0.320723538531 0.130979917850
+CG3C51 CG2O3 1 0.347450500075 0.110698234855
+CG3C51 CG2O4 1 0.329632525712 0.102486650838
+CG3C51 CG2O5 1 0.347450500075 0.125520000000
+CG3C51 CG2O6 1 0.347450500075 0.110698234855
+CG3C51 CG2O7 1 0.308518226092 0.100764063435
+CG3C51 CG2R51 1 0.356359487256 0.093557084179
+CG3C51 CG2R52 1 0.365268474438 0.059170695450
+CG3C51 CG2R53 1 0.365268474438 0.059170695450
+CG3C51 CG2R57 1 0.356359487256 0.093557084179
+CG3C51 CG2R61 1 0.346773417049 0.110698234855
+CG3C51 CG2R62 1 0.338541512893 0.125520000000
+CG3C51 CG2R63 1 0.338541512893 0.132309697301
+CG3C51 CG2R64 1 0.356359487256 0.083680000000
+CG3C51 CG2R66 1 0.338541512893 0.110698234855
+CG3C51 CG2R67 1 0.346773417049 0.110698234855
+CG3C51 CG2RC0 1 0.334977918021 0.131646486622
+CG3C51 CG2R71 1 0.346987232741 0.108300154755
+CG3C51 CG2RC7 1 0.334977918021 0.131646486622
+CG3C51 CG301 1 0.338541512893 0.041840000000
+CG3C51 CG302 1 0.374177461619 0.059170695450
+CG3C51 CG311 1 0.338541512893 0.041840000000
+CG3C51 CG312 1 0.351904993665 0.085746484010
+CG3C51 CG314 1 0.338541512893 0.041840000000
+CG3C51 CG321 1 0.338541512893 0.041840000000
+CG3C51 CG322 1 0.338541512893 0.102486650838
+CG3C51 CG323 1 0.365268474438 0.138767581228
+CG3C51 CG324 1 0.338541512893 0.041840000000
+CG3C51 CG331 1 0.338541512893 0.041840000000
+CG3C51 CG334 1 0.338541512893 0.041840000000
+CG3C51 CG3C50 1 0.338541512893 0.041840000000
+CG3C51 CG3C51 1 0.338541512893 0.041840000000
+CG3C51 CG3C52 1 0.338541512893 0.041840000000
+CG3C51 CG3C53 1 0.338541512893 0.041840000000
+CG3C51 CG3C54 1 0.338541512893 0.041840000000
+CG3C51 CG3C31 1 0.338541512893 0.041840000000
+CG3C51 CG3C41 1 0.338541512893 0.041840000000
+CG3C51 CG3RC1 1 0.338541512893 0.041840000000
+CG3C51 CG3AM0 1 0.344777803920 0.110698234855
+CG3C51 CG3AM1 1 0.345668702638 0.116852760686
+CG3C51 CG3AM2 1 0.346559601357 0.118341390899
+CG3C51 NG1T1 1 0.328741626994 0.177512086349
+CG3C51 NG2D1 1 0.334087019303 0.187114168357
+CG3C51 NG2S0 1 0.334087019303 0.004184000000
+CG3C51 NG2S1 1 0.307360057758 0.187114168357
+CG3C51 NG2S2 1 0.334087019303 0.187114168357
+CG3C51 NG2S3 1 0.334087019303 0.187114168357
+CG3C51 NG2O1 1 0.334087019303 0.187114168357
+CG3C51 NG2P1 1 0.334087019303 0.187114168357
+CG3C51 NG2R43 1 0.334087019303 0.187114168357
+CG3C51 NG2R50 1 0.334087019303 0.187114168357
+CG3C51 NG2R51 1 0.334087019303 0.187114168357
+CG3C51 NG2R52 1 0.334087019303 0.187114168357
+CG3C51 NG2R53 1 0.334087019303 0.187114168357
+CG3C51 NG2R57 1 0.334087019303 0.187114168357
+CG3C51 NG2R60 1 0.337650614175 0.102486650838
+CG3C51 NG2R61 1 0.334087019303 0.187114168357
+CG3C51 NG2R62 1 0.352795892384 0.093557084179
+CG3C51 NG2R67 1 0.334087019303 0.187114168357
+CG3C51 NG2RC0 1 0.334087019303 0.187114168357
+CG3C51 NG301 1 0.347450500075 0.078275472531
+CG3C51 NG311 1 0.347450500075 0.088756043175
+CG3C51 NG321 1 0.346559601357 0.102486650838
+CG3C51 NG331 1 0.345668702638 0.110698234855
+CG3C51 NG3C51 1 0.334087019303 0.187114168357
+CG3C51 NG3N1 1 0.351904993665 0.102486650838
+CG3C51 NG3P0 1 0.334087019303 0.187114168357
+CG3C51 NG3P1 1 0.334087019303 0.187114168357
+CG3C51 NG3P2 1 0.334087019303 0.187114168357
+CG3C51 NG3P3 1 0.334087019303 0.187114168357
+CG3C51 OG2D1 1 0.293996576986 0.144938011577
+CG3C51 OG2D2 1 0.320723538531 0.144938011577
+CG3C51 OG2D3 1 0.293996576986 0.144938011577
+CG3C51 OG2D4 1 0.320723538531 0.144938011577
+CG3C51 OG2D5 1 0.320010819556 0.169954883425
+CG3C51 OG2N1 1 0.320723538531 0.144938011577
+CG3C51 OG2P1 1 0.320723538531 0.144938011577
+CG3C51 OG2R50 1 0.320723538531 0.144938011577
+CG3C51 OG3R60 1 0.316269044940 0.132309697301
+CG3C51 OG301 1 0.316269044940 0.132309697301
+CG3C51 OG302 1 0.316269044940 0.132309697301
+CG3C51 OG303 1 0.316269044940 0.132309697301
+CG3C51 OG304 1 0.316269044940 0.132309697301
+CG3C51 OG311 1 0.326514380198 0.183381431383
+CG3C51 OG312 1 0.325178032121 0.144938011577
+CG3C51 OG3C31 1 0.316269044940 0.132309697301
+CG3C51 OG3C51 1 0.316269044940 0.132309697301
+CG3C51 OG3C61 1 0.316269044940 0.132309697301
+CG3C51 SG2D1 1 0.351904993665 0.314496560236
+CG3C51 SG2R50 1 0.347450500075 0.280671252536
+CG3C51 SG311 1 0.347450500075 0.280671252536
+CG3C51 SG301 1 0.345223253279 0.257919081884
+CG3C51 SG302 1 0.365268474438 0.286840588481
+CG3C51 SG3O1 1 0.356359487256 0.286840588481
+CG3C51 SG3O2 1 0.347450500075 0.247528778125
+CG3C51 SG3O3 1 0.347450500075 0.247528778125
+CG3C51 FGA1 1 0.314487247504 0.153729976257
+CG3C51 FGA2 1 0.314487247504 0.135577095411
+CG3C51 FGA3 1 0.311814551349 0.130309939452
+CG3C51 FGP1 1 0.311814551349 0.130309939452
+CG3C51 FGR1 1 0.320723538531 0.144938011577
+CG3C51 CLGA1 1 0.339432411611 0.245040988571
+CG3C51 CLGA3 1 0.339432411611 0.232955260941
+CG3C51 CLGR1 1 0.341214209048 0.236682781799
+CG3C51 BRGA1 1 0.344777803920 0.289876023155
+CG3C51 BRGA2 1 0.351904993665 0.304599797767
+CG3C51 BRGA3 1 0.347450500075 0.307459952514
+CG3C51 BRGR1 1 0.353686791102 0.271154190821
+CG3C51 IGR1 1 0.364377575719 0.310293744700
+CG3C51 PG0 1 0.360813980847 0.320014464673
+CG3C51 PG1 1 0.360813980847 0.320014464673
+CG3C51 PG2 1 0.360813980847 0.320014464673
+CG3C51 ALG1 1 0.347450500075 0.337324864189
+CG3C51 CC301 1 0.338541512893 0.041840000000
+CG3C51 CC3062 1 0.338541512893 0.041840000000
+CG3C51 CC311 1 0.338541512893 0.041840000000
+CG3C51 CC3161 1 0.338541512893 0.041840000000
+CG3C51 CC3162 1 0.338541512893 0.041840000000
+CG3C51 CC3163 1 0.338541512893 0.041840000000
+CG3C51 CC321 1 0.338541512893 0.041840000000
+CG3C51 CC3261 1 0.338541512893 0.041840000000
+CG3C51 CC3263 1 0.338541512893 0.041840000000
+CG3C51 CC331 1 0.338541512893 0.041840000000
+CG3C51 CC2O1 1 0.347450500075 0.138767581228
+CG3C51 CC2O2 1 0.347450500075 0.110698234855
+CG3C51 CC2O3 1 0.347450500075 0.125520000000
+CG3C51 CC2O4 1 0.329632525712 0.102486650838
+CG3C51 OC2D1 1 0.293996576986 0.144938011577
+CG3C51 OC2D2 1 0.320723538531 0.144938011577
+CG3C51 OC2D3 1 0.293996576986 0.144938011577
+CG3C51 OC2D4 1 0.293996576986 0.144938011577
+CG3C51 OC3C61 1 0.316269044940 0.132309697301
+CG3C51 OC311 1 0.326514380198 0.183381431383
+CG3C51 NC2D1 1 0.307360057758 0.187114168357
+CG3C51 HCP1 1 0.189271432669 0.089736802707
+CG3C51 HCA1 1 0.288651184677 0.088756043175
+CG3C51 HCA2 1 0.288651184677 0.078275472531
+CG3C51 HCA3 1 0.288651184677 0.064818249282
+CG3C51 CC312 1 0.338541512893 0.041840000000
+CG3C51 CC322 1 0.338541512893 0.041840000000
+CG3C51 HCR1 1 0.240542653898 0.089736802707
+CG3C51 HCA3M 1 0.288651184677 0.064818249282
+CG3C51 CC321C 1 0.338541512893 0.041840000000
+CG3C51 CC321D 1 0.338541512893 0.041840000000
+CG3C51 CC311C 1 0.338541512893 0.041840000000
+CG3C51 CC311D 1 0.338541512893 0.041840000000
+CG3C51 OC301 1 0.316269044940 0.132309697301
+CG3C51 OC302 1 0.316269044940 0.132309697301
+CG3C51 HCP1M 1 0.189271432669 0.089736802707
+CG3C51 OC311M 1 0.326514380198 0.183381431383
+CG3C51 OC3C5M 1 0.316269044940 0.132309697301
+CG3C51 CC322C 1 0.338541512893 0.041840000000
+CG3C51 HCA2C2 1 0.285087589805 0.078275472531
+CG3C51 CC312C 1 0.338541512893 0.041840000000
+CG3C51 HCA1C2 1 0.288651184677 0.088756043175
+CG3C51 OC3C51 1 0.316269044940 0.132309697301
+CG3C51 CC3152 1 0.338541512893 0.041840000000
+CG3C51 CC3051 1 0.338541512893 0.041840000000
+CG3C51 CC3251 1 0.338541512893 0.041840000000
+CG3C51 CC3151 1 0.338541512893 0.041840000000
+CG3C51 CC3153 1 0.338541512893 0.041840000000
+CG3C51 OC2DP 1 0.320723538531 0.144938011577
+CG3C51 OC312 1 0.326959829558 0.163176000000
+CG3C51 OC30P 1 0.326959829558 0.163176000000
+CG3C51 PC 1 0.360813980847 0.320014464673
+CG3C51 SC 1 0.356359487256 0.286840588481
+CG3C51 CC312D 1 0.338541512893 0.041840000000
+CG3C51 OC303 1 0.316269044940 0.132309697301
+CG3C51 HN1 1 0.189271432669 0.089736802707
+CG3C51 HN2 1 0.189271432669 0.089736802707
+CG3C51 HN3 1 0.267269615442 0.089736802707
+CG3C51 HN4 1 0.189271432669 0.089736802707
+CG3C51 HN5 1 0.189271432669 0.089736802707
+CG3C51 HN6 1 0.286869387241 0.062058748940
+CG3C51 HN7 1 0.286869387241 0.062058748940
+CG3C51 HN8 1 0.288651184677 0.070011711020
+CG3C51 HN9 1 0.288651184677 0.064818249282
+CG3C51 NN1 1 0.334087019303 0.187114168357
+CG3C51 NN2 1 0.334087019303 0.187114168357
+CG3C51 NN2B 1 0.334087019303 0.187114168357
+CG3C51 NN2G 1 0.334087019303 0.187114168357
+CG3C51 NN2U 1 0.334087019303 0.187114168357
+CG3C51 NN3 1 0.334087019303 0.187114168357
+CG3C51 NN3A 1 0.334087019303 0.187114168357
+CG3C51 NN3G 1 0.334087019303 0.187114168357
+CG3C51 NN4 1 0.334087019303 0.187114168357
+CG3C51 NN6 1 0.334087019303 0.187114168357
+CG3C51 ON1 1 0.320723538531 0.144938011577
+CG3C51 ON1C 1 0.320723538531 0.144938011577
+CG3C51 ON2 1 0.326959829558 0.163176000000
+CG3C51 ON3 1 0.320723538531 0.144938011577
+CG3C51 ON4 1 0.326959829558 0.163176000000
+CG3C51 ON5 1 0.326959829558 0.163176000000
+CG3C51 ON6 1 0.326959829558 0.163176000000
+CG3C51 ON6B 1 0.326959829558 0.163176000000
+CG3C51 CN1 1 0.338541512893 0.132309697301
+CG3C51 CN1T 1 0.338541512893 0.132309697301
+CG3C51 CN2 1 0.338541512893 0.132309697301
+CG3C51 CN3 1 0.338541512893 0.125520000000
+CG3C51 CN3T 1 0.338541512893 0.125520000000
+CG3C51 CN4 1 0.338541512893 0.114583559030
+CG3C51 CN5 1 0.338541512893 0.114583559030
+CG3C51 CN5G 1 0.338541512893 0.114583559030
+CG3C51 CN7 1 0.338541512893 0.041840000000
+CG3C51 CN7B 1 0.338541512893 0.041840000000
+CG3C51 CN8 1 0.338541512893 0.041840000000
+CG3C51 CN8B 1 0.338541512893 0.041840000000
+CG3C51 CN9 1 0.338541512893 0.041840000000
+CG3C51 P 1 0.360813980847 0.320014464673
+CG3C51 P2 1 0.360813980847 0.320014464673
+CG3C51 HOL 1 0.189271432669 0.089736802707
+CG3C51 HAL1 1 0.286869387241 0.062058748940
+CG3C51 HAL2 1 0.288651184677 0.070011711020
+CG3C51 HAL3 1 0.288651184677 0.064818249282
+CG3C51 HBL 1 0.286869387241 0.062058748940
+CG3C51 HCL 1 0.189271432669 0.089736802707
+CG3C51 HL 1 0.231633666716 0.089736802707
+CG3C51 HEL1 1 0.280633096214 0.073666921749
+CG3C51 HEL2 1 0.281523994932 0.067464972838
+CG3C51 CL 1 0.347450500075 0.110698234855
+CG3C51 CCL 1 0.347450500075 0.110698234855
+CG3C51 CTL1 1 0.338541512893 0.041840000000
+CG3C51 CTL2 1 0.338541512893 0.041840000000
+CG3C51 CTL3 1 0.338541512893 0.041840000000
+CG3C51 CTL5 1 0.338541512893 0.041840000000
+CG3C51 CEL1 1 0.355468588538 0.109105371453
+CG3C51 CEL2 1 0.354577689820 0.105847757841
+CG3C51 CRL1 1 0.338541512893 0.041840000000
+CG3C51 CRL2 1 0.338541512893 0.041840000000
+CG3C51 OBL 1 0.293996576986 0.144938011577
+CG3C51 OCL 1 0.320723538531 0.144938011577
+CG3C51 O2L 1 0.320723538531 0.144938011577
+CG3C51 OHL 1 0.326959829558 0.163176000000
+CG3C51 OSL 1 0.316269044940 0.132309697301
+CG3C51 OSLP 1 0.316269044940 0.132309697301
+CG3C51 NH3L 1 0.334087019303 0.187114168357
+CG3C51 NTL 1 0.334087019303 0.187114168357
+CG3C51 SL 1 0.356359487256 0.286840588481
+CG3C51 PL 1 0.360813980847 0.320014464673
+CG3C51 HCA1A 1 0.288651184677 0.088756043175
+CG3C51 HCA2A 1 0.288651184677 0.078275472531
+CG3C51 HCA3A 1 0.288651184677 0.064818249282
+CG3C51 CC30A 1 0.338541512893 0.041840000000
+CG3C51 CC31A 1 0.338541512893 0.041840000000
+CG3C51 CC32A 1 0.338541512893 0.041840000000
+CG3C51 CC33A 1 0.338541512893 0.041840000000
+CG3C51 CC326A 1 0.338541512893 0.041840000000
+CG3C51 HCA25A 1 0.285087589805 0.078275472531
+CG3C51 CC325A 1 0.338541512893 0.041840000000
+CG3C51 CC325B 1 0.338541512893 0.041840000000
+CG3C51 OC305A 1 0.316269044940 0.132309697301
+CG3C51 OC30A 1 0.316269044940 0.132309697301
+CG3C51 CPA 1 0.329632525712 0.125520000000
+CG3C51 CPB 1 0.329632525712 0.125520000000
+CG3C51 CPM 1 0.329632525712 0.125520000000
+CG3C51 CM 1 0.356359487256 0.138767581228
+CG3C51 CST 1 0.308518226092 0.100764063435
+CG3C51 NPH 1 0.334087019303 0.187114168357
+CG3C51 OM 1 0.320723538531 0.144938011577
+CG3C51 OST 1 0.320010819556 0.169954883425
+CG3C51 FE 1 0.227179173126 0.000000000000
+CG3C51 ON2B 1 0.326959829558 0.163176000000
+CG3C51 SP 1 0.365268474438 0.280671252536
+CG3C52 C 1 0.347450500075 0.138767581228
+CG3C52 CA 1 0.346773417049 0.110698234855
+CG3C52 CC 1 0.347450500075 0.110698234855
+CG3C52 CD 1 0.347450500075 0.110698234855
+CG3C52 CE1 1 0.355468588538 0.109105371453
+CG3C52 CE2 1 0.354577689820 0.105847757841
+CG3C52 CP1 1 0.338541512893 0.041840000000
+CG3C52 CP2 1 0.338541512893 0.041840000000
+CG3C52 CP3 1 0.338541512893 0.041840000000
+CG3C52 CPH1 1 0.329632525712 0.093557084179
+CG3C52 CPH2 1 0.329632525712 0.093557084179
+CG3C52 CS 1 0.365268474438 0.138767581228
+CG3C52 CPT 1 0.334977918021 0.131646486622
+CG3C52 CY 1 0.346559601357 0.113045454929
+CG3C52 CAI 1 0.346559601357 0.113045454929
+CG3C52 CT 1 0.338541512893 0.041840000000
+CG3C52 CT1 1 0.338541512893 0.041840000000
+CG3C52 CT2 1 0.338541512893 0.041840000000
+CG3C52 CT2A 1 0.338541512893 0.041840000000
+CG3C52 CT3 1 0.338541512893 0.041840000000
+CG3C52 H 1 0.189271432669 0.089736802707
+CG3C52 HA 1 0.286869387241 0.062058748940
+CG3C52 HB1 1 0.286869387241 0.062058748940
+CG3C52 HB2 1 0.288651184677 0.070011711020
+CG3C52 HE1 1 0.280633096214 0.073666921749
+CG3C52 HE2 1 0.281523994932 0.067464972838
+CG3C52 HC 1 0.189271432669 0.089736802707
+CG3C52 HP 1 0.290272620344 0.072469005789
+CG3C52 HR1 1 0.249451641079 0.089736802707
+CG3C52 HR2 1 0.231633666716 0.089736802707
+CG3C52 HR3 1 0.300054688270 0.036952087465
+CG3C52 HS 1 0.209361198763 0.132309697301
+CG3C52 HA1 1 0.288651184677 0.088756043175
+CG3C52 HA2 1 0.288651184677 0.077149148019
+CG3C52 HA3 1 0.288651184677 0.064818249282
+CG3C52 N 1 0.334087019303 0.004184000000
+CG3C52 NC2 1 0.334087019303 0.187114168357
+CG3C52 NH1 1 0.307360057758 0.187114168357
+CG3C52 NH2 1 0.334087019303 0.187114168357
+CG3C52 NH3 1 0.334087019303 0.187114168357
+CG3C52 NP 1 0.334087019303 0.187114168357
+CG3C52 NR1 1 0.334087019303 0.187114168357
+CG3C52 NR2 1 0.334087019303 0.187114168357
+CG3C52 NR3 1 0.334087019303 0.187114168357
+CG3C52 NY 1 0.334087019303 0.187114168357
+CG3C52 O 1 0.293996576986 0.144938011577
+CG3C52 OB 1 0.293996576986 0.144938011577
+CG3C52 OC 1 0.320723538531 0.144938011577
+CG3C52 OH1 1 0.326959829558 0.163176000000
+CG3C52 OS 1 0.326959829558 0.163176000000
+CG3C52 S 1 0.347450500075 0.280671252536
+CG3C52 SM 1 0.345223253279 0.257919081884
+CG3C52 SS 1 0.365268474438 0.286840588481
+CG3C52 HT 1 0.189271432669 0.089736802707
+CG3C52 OT 1 0.326799467788 0.163176000000
+CG3C52 OX 1 0.320723538531 0.144938011577
+CG3C52 HX 1 0.189271432669 0.089736802707
+CG3C52 LIT 1 0.284864865125 0.020196198771
+CG3C52 SOD 1 0.294954293108 0.090610410351
+CG3C52 MG 1 0.274842254546 0.051243325419
+CG3C52 POT 1 0.326403017859 0.123410269913
+CG3C52 CAL 1 0.291056611216 0.144938011577
+CG3C52 RUB 1 0.338541512893 0.162045623205
+CG3C52 CES 1 0.356359487256 0.182376331798
+CG3C52 BAR 1 0.337650614175 0.162045623205
+CG3C52 ZN 1 0.266378716724 0.209200000000
+CG3C52 CAD 1 0.290165712498 0.144938011577
+CG3C52 CLA 1 0.371504765465 0.162045623205
+CG3C52 HGA1 1 0.288651184677 0.088756043175
+CG3C52 HGA2 1 0.288651184677 0.078275472531
+CG3C52 HGA3 1 0.288651184677 0.064818249282
+CG3C52 HGA4 1 0.280633096214 0.073666921749
+CG3C52 HGA5 1 0.281523994932 0.067464972838
+CG3C52 HGA6 1 0.286869387241 0.070011711020
+CG3C52 HGA7 1 0.285087589805 0.072469005789
+CG3C52 HGAAM0 1 0.283305792369 0.070011711020
+CG3C52 HGAAM1 1 0.283305792369 0.070011711020
+CG3C52 HGAAM2 1 0.281523994932 0.083680000000
+CG3C52 HGP1 1 0.189271432669 0.089736802707
+CG3C52 HGP2 1 0.189271432669 0.089736802707
+CG3C52 HGP3 1 0.209361198763 0.132309697301
+CG3C52 HGP4 1 0.189271432669 0.089736802707
+CG3C52 HGP5 1 0.231633666716 0.089736802707
+CG3C52 HGPAM1 1 0.247224394284 0.039692909190
+CG3C52 HGPAM2 1 0.247224394284 0.041840000000
+CG3C52 HGPAM3 1 0.246778944925 0.045833423612
+CG3C52 HGR51 1 0.290272620344 0.072469005789
+CG3C52 HGR52 1 0.249451641079 0.089736802707
+CG3C52 HGR53 1 0.231633666716 0.089736802707
+CG3C52 HGR61 1 0.290272620344 0.072469005789
+CG3C52 HGR62 1 0.267269615442 0.089736802707
+CG3C52 HGR63 1 0.249451641079 0.089736802707
+CG3C52 HGR71 1 0.290272620344 0.072469005789
+CG3C52 CG1T1 1 0.333196120584 0.170981810495
+CG3C52 CG1T2 1 0.346782326036 0.134409982486
+CG3C52 CG1N1 1 0.335868816739 0.177512086349
+CG3C52 CG2D1 1 0.355468588538 0.109105371453
+CG3C52 CG2D2 1 0.354577689820 0.105847757841
+CG3C52 CG2D1O 1 0.355468588538 0.109105371453
+CG3C52 CG2D2O 1 0.355468588538 0.109105371453
+CG3C52 CG2DC1 1 0.355468588538 0.109105371453
+CG3C52 CG2DC2 1 0.355468588538 0.109105371453
+CG3C52 CG2DC3 1 0.354577689820 0.105847757841
+CG3C52 CG25C1 1 0.355468588538 0.109105371453
+CG3C52 CG25C2 1 0.355468588538 0.109105371453
+CG3C52 CG251O 1 0.355468588538 0.109105371453
+CG3C52 CG252O 1 0.355468588538 0.109105371453
+CG3C52 CG2N1 1 0.347450500075 0.138767581228
+CG3C52 CG2N2 1 0.347450500075 0.138767581228
+CG3C52 CG2O1 1 0.347450500075 0.138767581228
+CG3C52 CG2O2 1 0.320723538531 0.130979917850
+CG3C52 CG2O3 1 0.347450500075 0.110698234855
+CG3C52 CG2O4 1 0.329632525712 0.102486650838
+CG3C52 CG2O5 1 0.347450500075 0.125520000000
+CG3C52 CG2O6 1 0.347450500075 0.110698234855
+CG3C52 CG2O7 1 0.308518226092 0.100764063435
+CG3C52 CG2R51 1 0.356359487256 0.093557084179
+CG3C52 CG2R52 1 0.365268474438 0.059170695450
+CG3C52 CG2R53 1 0.365268474438 0.059170695450
+CG3C52 CG2R57 1 0.356359487256 0.093557084179
+CG3C52 CG2R61 1 0.346773417049 0.110698234855
+CG3C52 CG2R62 1 0.338541512893 0.125520000000
+CG3C52 CG2R63 1 0.338541512893 0.132309697301
+CG3C52 CG2R64 1 0.356359487256 0.083680000000
+CG3C52 CG2R66 1 0.338541512893 0.110698234855
+CG3C52 CG2R67 1 0.346773417049 0.110698234855
+CG3C52 CG2RC0 1 0.334977918021 0.131646486622
+CG3C52 CG2R71 1 0.346987232741 0.108300154755
+CG3C52 CG2RC7 1 0.334977918021 0.131646486622
+CG3C52 CG301 1 0.338541512893 0.041840000000
+CG3C52 CG302 1 0.374177461619 0.059170695450
+CG3C52 CG311 1 0.338541512893 0.041840000000
+CG3C52 CG312 1 0.351904993665 0.085746484010
+CG3C52 CG314 1 0.338541512893 0.041840000000
+CG3C52 CG321 1 0.338541512893 0.041840000000
+CG3C52 CG322 1 0.338541512893 0.102486650838
+CG3C52 CG323 1 0.365268474438 0.138767581228
+CG3C52 CG324 1 0.338541512893 0.041840000000
+CG3C52 CG331 1 0.338541512893 0.041840000000
+CG3C52 CG334 1 0.338541512893 0.041840000000
+CG3C52 CG3C50 1 0.338541512893 0.041840000000
+CG3C52 CG3C51 1 0.338541512893 0.041840000000
+CG3C52 CG3C52 1 0.338541512893 0.041840000000
+CG3C52 CG3C53 1 0.338541512893 0.041840000000
+CG3C52 CG3C54 1 0.338541512893 0.041840000000
+CG3C52 CG3C31 1 0.338541512893 0.041840000000
+CG3C52 CG3C41 1 0.338541512893 0.041840000000
+CG3C52 CG3RC1 1 0.338541512893 0.041840000000
+CG3C52 CG3AM0 1 0.344777803920 0.110698234855
+CG3C52 CG3AM1 1 0.345668702638 0.116852760686
+CG3C52 CG3AM2 1 0.346559601357 0.118341390899
+CG3C52 NG1T1 1 0.328741626994 0.177512086349
+CG3C52 NG2D1 1 0.334087019303 0.187114168357
+CG3C52 NG2S0 1 0.334087019303 0.004184000000
+CG3C52 NG2S1 1 0.307360057758 0.187114168357
+CG3C52 NG2S2 1 0.334087019303 0.187114168357
+CG3C52 NG2S3 1 0.334087019303 0.187114168357
+CG3C52 NG2O1 1 0.334087019303 0.187114168357
+CG3C52 NG2P1 1 0.334087019303 0.187114168357
+CG3C52 NG2R43 1 0.334087019303 0.187114168357
+CG3C52 NG2R50 1 0.334087019303 0.187114168357
+CG3C52 NG2R51 1 0.334087019303 0.187114168357
+CG3C52 NG2R52 1 0.334087019303 0.187114168357
+CG3C52 NG2R53 1 0.334087019303 0.187114168357
+CG3C52 NG2R57 1 0.334087019303 0.187114168357
+CG3C52 NG2R60 1 0.337650614175 0.102486650838
+CG3C52 NG2R61 1 0.334087019303 0.187114168357
+CG3C52 NG2R62 1 0.352795892384 0.093557084179
+CG3C52 NG2R67 1 0.334087019303 0.187114168357
+CG3C52 NG2RC0 1 0.334087019303 0.187114168357
+CG3C52 NG301 1 0.347450500075 0.078275472531
+CG3C52 NG311 1 0.347450500075 0.088756043175
+CG3C52 NG321 1 0.346559601357 0.102486650838
+CG3C52 NG331 1 0.345668702638 0.110698234855
+CG3C52 NG3C51 1 0.334087019303 0.187114168357
+CG3C52 NG3N1 1 0.351904993665 0.102486650838
+CG3C52 NG3P0 1 0.334087019303 0.187114168357
+CG3C52 NG3P1 1 0.334087019303 0.187114168357
+CG3C52 NG3P2 1 0.334087019303 0.187114168357
+CG3C52 NG3P3 1 0.334087019303 0.187114168357
+CG3C52 OG2D1 1 0.293996576986 0.144938011577
+CG3C52 OG2D2 1 0.320723538531 0.144938011577
+CG3C52 OG2D3 1 0.293996576986 0.144938011577
+CG3C52 OG2D4 1 0.320723538531 0.144938011577
+CG3C52 OG2D5 1 0.320010819556 0.169954883425
+CG3C52 OG2N1 1 0.320723538531 0.144938011577
+CG3C52 OG2P1 1 0.320723538531 0.144938011577
+CG3C52 OG2R50 1 0.320723538531 0.144938011577
+CG3C52 OG3R60 1 0.316269044940 0.132309697301
+CG3C52 OG301 1 0.316269044940 0.132309697301
+CG3C52 OG302 1 0.316269044940 0.132309697301
+CG3C52 OG303 1 0.316269044940 0.132309697301
+CG3C52 OG304 1 0.316269044940 0.132309697301
+CG3C52 OG311 1 0.326514380198 0.183381431383
+CG3C52 OG312 1 0.325178032121 0.144938011577
+CG3C52 OG3C31 1 0.316269044940 0.132309697301
+CG3C52 OG3C51 1 0.316269044940 0.132309697301
+CG3C52 OG3C61 1 0.316269044940 0.132309697301
+CG3C52 SG2D1 1 0.351904993665 0.314496560236
+CG3C52 SG2R50 1 0.347450500075 0.280671252536
+CG3C52 SG311 1 0.347450500075 0.280671252536
+CG3C52 SG301 1 0.345223253279 0.257919081884
+CG3C52 SG302 1 0.365268474438 0.286840588481
+CG3C52 SG3O1 1 0.356359487256 0.286840588481
+CG3C52 SG3O2 1 0.347450500075 0.247528778125
+CG3C52 SG3O3 1 0.347450500075 0.247528778125
+CG3C52 FGA1 1 0.314487247504 0.153729976257
+CG3C52 FGA2 1 0.314487247504 0.135577095411
+CG3C52 FGA3 1 0.311814551349 0.130309939452
+CG3C52 FGP1 1 0.311814551349 0.130309939452
+CG3C52 FGR1 1 0.320723538531 0.144938011577
+CG3C52 CLGA1 1 0.339432411611 0.245040988571
+CG3C52 CLGA3 1 0.339432411611 0.232955260941
+CG3C52 CLGR1 1 0.341214209048 0.236682781799
+CG3C52 BRGA1 1 0.344777803920 0.289876023155
+CG3C52 BRGA2 1 0.351904993665 0.304599797767
+CG3C52 BRGA3 1 0.347450500075 0.307459952514
+CG3C52 BRGR1 1 0.353686791102 0.271154190821
+CG3C52 IGR1 1 0.364377575719 0.310293744700
+CG3C52 PG0 1 0.360813980847 0.320014464673
+CG3C52 PG1 1 0.360813980847 0.320014464673
+CG3C52 PG2 1 0.360813980847 0.320014464673
+CG3C52 ALG1 1 0.347450500075 0.337324864189
+CG3C52 CC301 1 0.338541512893 0.041840000000
+CG3C52 CC3062 1 0.338541512893 0.041840000000
+CG3C52 CC311 1 0.338541512893 0.041840000000
+CG3C52 CC3161 1 0.338541512893 0.041840000000
+CG3C52 CC3162 1 0.338541512893 0.041840000000
+CG3C52 CC3163 1 0.338541512893 0.041840000000
+CG3C52 CC321 1 0.338541512893 0.041840000000
+CG3C52 CC3261 1 0.338541512893 0.041840000000
+CG3C52 CC3263 1 0.338541512893 0.041840000000
+CG3C52 CC331 1 0.338541512893 0.041840000000
+CG3C52 CC2O1 1 0.347450500075 0.138767581228
+CG3C52 CC2O2 1 0.347450500075 0.110698234855
+CG3C52 CC2O3 1 0.347450500075 0.125520000000
+CG3C52 CC2O4 1 0.329632525712 0.102486650838
+CG3C52 OC2D1 1 0.293996576986 0.144938011577
+CG3C52 OC2D2 1 0.320723538531 0.144938011577
+CG3C52 OC2D3 1 0.293996576986 0.144938011577
+CG3C52 OC2D4 1 0.293996576986 0.144938011577
+CG3C52 OC3C61 1 0.316269044940 0.132309697301
+CG3C52 OC311 1 0.326514380198 0.183381431383
+CG3C52 NC2D1 1 0.307360057758 0.187114168357
+CG3C52 HCP1 1 0.189271432669 0.089736802707
+CG3C52 HCA1 1 0.288651184677 0.088756043175
+CG3C52 HCA2 1 0.288651184677 0.078275472531
+CG3C52 HCA3 1 0.288651184677 0.064818249282
+CG3C52 CC312 1 0.338541512893 0.041840000000
+CG3C52 CC322 1 0.338541512893 0.041840000000
+CG3C52 HCR1 1 0.240542653898 0.089736802707
+CG3C52 HCA3M 1 0.288651184677 0.064818249282
+CG3C52 CC321C 1 0.338541512893 0.041840000000
+CG3C52 CC321D 1 0.338541512893 0.041840000000
+CG3C52 CC311C 1 0.338541512893 0.041840000000
+CG3C52 CC311D 1 0.338541512893 0.041840000000
+CG3C52 OC301 1 0.316269044940 0.132309697301
+CG3C52 OC302 1 0.316269044940 0.132309697301
+CG3C52 HCP1M 1 0.189271432669 0.089736802707
+CG3C52 OC311M 1 0.326514380198 0.183381431383
+CG3C52 OC3C5M 1 0.316269044940 0.132309697301
+CG3C52 CC322C 1 0.338541512893 0.041840000000
+CG3C52 HCA2C2 1 0.285087589805 0.078275472531
+CG3C52 CC312C 1 0.338541512893 0.041840000000
+CG3C52 HCA1C2 1 0.288651184677 0.088756043175
+CG3C52 OC3C51 1 0.316269044940 0.132309697301
+CG3C52 CC3152 1 0.338541512893 0.041840000000
+CG3C52 CC3051 1 0.338541512893 0.041840000000
+CG3C52 CC3251 1 0.338541512893 0.041840000000
+CG3C52 CC3151 1 0.338541512893 0.041840000000
+CG3C52 CC3153 1 0.338541512893 0.041840000000
+CG3C52 OC2DP 1 0.320723538531 0.144938011577
+CG3C52 OC312 1 0.326959829558 0.163176000000
+CG3C52 OC30P 1 0.326959829558 0.163176000000
+CG3C52 PC 1 0.360813980847 0.320014464673
+CG3C52 SC 1 0.356359487256 0.286840588481
+CG3C52 CC312D 1 0.338541512893 0.041840000000
+CG3C52 OC303 1 0.316269044940 0.132309697301
+CG3C52 HN1 1 0.189271432669 0.089736802707
+CG3C52 HN2 1 0.189271432669 0.089736802707
+CG3C52 HN3 1 0.267269615442 0.089736802707
+CG3C52 HN4 1 0.189271432669 0.089736802707
+CG3C52 HN5 1 0.189271432669 0.089736802707
+CG3C52 HN6 1 0.286869387241 0.062058748940
+CG3C52 HN7 1 0.286869387241 0.062058748940
+CG3C52 HN8 1 0.288651184677 0.070011711020
+CG3C52 HN9 1 0.288651184677 0.064818249282
+CG3C52 NN1 1 0.334087019303 0.187114168357
+CG3C52 NN2 1 0.334087019303 0.187114168357
+CG3C52 NN2B 1 0.334087019303 0.187114168357
+CG3C52 NN2G 1 0.334087019303 0.187114168357
+CG3C52 NN2U 1 0.334087019303 0.187114168357
+CG3C52 NN3 1 0.334087019303 0.187114168357
+CG3C52 NN3A 1 0.334087019303 0.187114168357
+CG3C52 NN3G 1 0.334087019303 0.187114168357
+CG3C52 NN4 1 0.334087019303 0.187114168357
+CG3C52 NN6 1 0.334087019303 0.187114168357
+CG3C52 ON1 1 0.320723538531 0.144938011577
+CG3C52 ON1C 1 0.320723538531 0.144938011577
+CG3C52 ON2 1 0.326959829558 0.163176000000
+CG3C52 ON3 1 0.320723538531 0.144938011577
+CG3C52 ON4 1 0.326959829558 0.163176000000
+CG3C52 ON5 1 0.326959829558 0.163176000000
+CG3C52 ON6 1 0.326959829558 0.163176000000
+CG3C52 ON6B 1 0.326959829558 0.163176000000
+CG3C52 CN1 1 0.338541512893 0.132309697301
+CG3C52 CN1T 1 0.338541512893 0.132309697301
+CG3C52 CN2 1 0.338541512893 0.132309697301
+CG3C52 CN3 1 0.338541512893 0.125520000000
+CG3C52 CN3T 1 0.338541512893 0.125520000000
+CG3C52 CN4 1 0.338541512893 0.114583559030
+CG3C52 CN5 1 0.338541512893 0.114583559030
+CG3C52 CN5G 1 0.338541512893 0.114583559030
+CG3C52 CN7 1 0.338541512893 0.041840000000
+CG3C52 CN7B 1 0.338541512893 0.041840000000
+CG3C52 CN8 1 0.338541512893 0.041840000000
+CG3C52 CN8B 1 0.338541512893 0.041840000000
+CG3C52 CN9 1 0.338541512893 0.041840000000
+CG3C52 P 1 0.360813980847 0.320014464673
+CG3C52 P2 1 0.360813980847 0.320014464673
+CG3C52 HOL 1 0.189271432669 0.089736802707
+CG3C52 HAL1 1 0.286869387241 0.062058748940
+CG3C52 HAL2 1 0.288651184677 0.070011711020
+CG3C52 HAL3 1 0.288651184677 0.064818249282
+CG3C52 HBL 1 0.286869387241 0.062058748940
+CG3C52 HCL 1 0.189271432669 0.089736802707
+CG3C52 HL 1 0.231633666716 0.089736802707
+CG3C52 HEL1 1 0.280633096214 0.073666921749
+CG3C52 HEL2 1 0.281523994932 0.067464972838
+CG3C52 CL 1 0.347450500075 0.110698234855
+CG3C52 CCL 1 0.347450500075 0.110698234855
+CG3C52 CTL1 1 0.338541512893 0.041840000000
+CG3C52 CTL2 1 0.338541512893 0.041840000000
+CG3C52 CTL3 1 0.338541512893 0.041840000000
+CG3C52 CTL5 1 0.338541512893 0.041840000000
+CG3C52 CEL1 1 0.355468588538 0.109105371453
+CG3C52 CEL2 1 0.354577689820 0.105847757841
+CG3C52 CRL1 1 0.338541512893 0.041840000000
+CG3C52 CRL2 1 0.338541512893 0.041840000000
+CG3C52 OBL 1 0.293996576986 0.144938011577
+CG3C52 OCL 1 0.320723538531 0.144938011577
+CG3C52 O2L 1 0.320723538531 0.144938011577
+CG3C52 OHL 1 0.326959829558 0.163176000000
+CG3C52 OSL 1 0.316269044940 0.132309697301
+CG3C52 OSLP 1 0.316269044940 0.132309697301
+CG3C52 NH3L 1 0.334087019303 0.187114168357
+CG3C52 NTL 1 0.334087019303 0.187114168357
+CG3C52 SL 1 0.356359487256 0.286840588481
+CG3C52 PL 1 0.360813980847 0.320014464673
+CG3C52 HCA1A 1 0.288651184677 0.088756043175
+CG3C52 HCA2A 1 0.288651184677 0.078275472531
+CG3C52 HCA3A 1 0.288651184677 0.064818249282
+CG3C52 CC30A 1 0.338541512893 0.041840000000
+CG3C52 CC31A 1 0.338541512893 0.041840000000
+CG3C52 CC32A 1 0.338541512893 0.041840000000
+CG3C52 CC33A 1 0.338541512893 0.041840000000
+CG3C52 CC326A 1 0.338541512893 0.041840000000
+CG3C52 HCA25A 1 0.285087589805 0.078275472531
+CG3C52 CC325A 1 0.338541512893 0.041840000000
+CG3C52 CC325B 1 0.338541512893 0.041840000000
+CG3C52 OC305A 1 0.316269044940 0.132309697301
+CG3C52 OC30A 1 0.316269044940 0.132309697301
+CG3C52 CPA 1 0.329632525712 0.125520000000
+CG3C52 CPB 1 0.329632525712 0.125520000000
+CG3C52 CPM 1 0.329632525712 0.125520000000
+CG3C52 CM 1 0.356359487256 0.138767581228
+CG3C52 CST 1 0.308518226092 0.100764063435
+CG3C52 NPH 1 0.334087019303 0.187114168357
+CG3C52 OM 1 0.320723538531 0.144938011577
+CG3C52 OST 1 0.320010819556 0.169954883425
+CG3C52 FE 1 0.227179173126 0.000000000000
+CG3C52 ON2B 1 0.326959829558 0.163176000000
+CG3C52 SP 1 0.365268474438 0.280671252536
+CG3C53 C 1 0.347450500075 0.138767581228
+CG3C53 CA 1 0.346773417049 0.110698234855
+CG3C53 CC 1 0.347450500075 0.110698234855
+CG3C53 CD 1 0.347450500075 0.110698234855
+CG3C53 CE1 1 0.355468588538 0.109105371453
+CG3C53 CE2 1 0.354577689820 0.105847757841
+CG3C53 CP1 1 0.338541512893 0.041840000000
+CG3C53 CP2 1 0.338541512893 0.041840000000
+CG3C53 CP3 1 0.338541512893 0.041840000000
+CG3C53 CPH1 1 0.329632525712 0.093557084179
+CG3C53 CPH2 1 0.329632525712 0.093557084179
+CG3C53 CS 1 0.365268474438 0.138767581228
+CG3C53 CPT 1 0.334977918021 0.131646486622
+CG3C53 CY 1 0.346559601357 0.113045454929
+CG3C53 CAI 1 0.346559601357 0.113045454929
+CG3C53 CT 1 0.338541512893 0.041840000000
+CG3C53 CT1 1 0.338541512893 0.041840000000
+CG3C53 CT2 1 0.338541512893 0.041840000000
+CG3C53 CT2A 1 0.338541512893 0.041840000000
+CG3C53 CT3 1 0.338541512893 0.041840000000
+CG3C53 H 1 0.189271432669 0.089736802707
+CG3C53 HA 1 0.286869387241 0.062058748940
+CG3C53 HB1 1 0.286869387241 0.062058748940
+CG3C53 HB2 1 0.288651184677 0.070011711020
+CG3C53 HE1 1 0.280633096214 0.073666921749
+CG3C53 HE2 1 0.281523994932 0.067464972838
+CG3C53 HC 1 0.189271432669 0.089736802707
+CG3C53 HP 1 0.290272620344 0.072469005789
+CG3C53 HR1 1 0.249451641079 0.089736802707
+CG3C53 HR2 1 0.231633666716 0.089736802707
+CG3C53 HR3 1 0.300054688270 0.036952087465
+CG3C53 HS 1 0.209361198763 0.132309697301
+CG3C53 HA1 1 0.288651184677 0.088756043175
+CG3C53 HA2 1 0.288651184677 0.077149148019
+CG3C53 HA3 1 0.288651184677 0.064818249282
+CG3C53 N 1 0.334087019303 0.004184000000
+CG3C53 NC2 1 0.334087019303 0.187114168357
+CG3C53 NH1 1 0.307360057758 0.187114168357
+CG3C53 NH2 1 0.334087019303 0.187114168357
+CG3C53 NH3 1 0.334087019303 0.187114168357
+CG3C53 NP 1 0.334087019303 0.187114168357
+CG3C53 NR1 1 0.334087019303 0.187114168357
+CG3C53 NR2 1 0.334087019303 0.187114168357
+CG3C53 NR3 1 0.334087019303 0.187114168357
+CG3C53 NY 1 0.334087019303 0.187114168357
+CG3C53 O 1 0.293996576986 0.144938011577
+CG3C53 OB 1 0.293996576986 0.144938011577
+CG3C53 OC 1 0.320723538531 0.144938011577
+CG3C53 OH1 1 0.326959829558 0.163176000000
+CG3C53 OS 1 0.326959829558 0.163176000000
+CG3C53 S 1 0.347450500075 0.280671252536
+CG3C53 SM 1 0.345223253279 0.257919081884
+CG3C53 SS 1 0.365268474438 0.286840588481
+CG3C53 HT 1 0.189271432669 0.089736802707
+CG3C53 OT 1 0.326799467788 0.163176000000
+CG3C53 OX 1 0.320723538531 0.144938011577
+CG3C53 HX 1 0.189271432669 0.089736802707
+CG3C53 LIT 1 0.284864865125 0.020196198771
+CG3C53 SOD 1 0.294954293108 0.090610410351
+CG3C53 MG 1 0.274842254546 0.051243325419
+CG3C53 POT 1 0.326403017859 0.123410269913
+CG3C53 CAL 1 0.291056611216 0.144938011577
+CG3C53 RUB 1 0.338541512893 0.162045623205
+CG3C53 CES 1 0.356359487256 0.182376331798
+CG3C53 BAR 1 0.337650614175 0.162045623205
+CG3C53 ZN 1 0.266378716724 0.209200000000
+CG3C53 CAD 1 0.290165712498 0.144938011577
+CG3C53 CLA 1 0.371504765465 0.162045623205
+CG3C53 HGA1 1 0.288651184677 0.088756043175
+CG3C53 HGA2 1 0.288651184677 0.078275472531
+CG3C53 HGA3 1 0.288651184677 0.064818249282
+CG3C53 HGA4 1 0.280633096214 0.073666921749
+CG3C53 HGA5 1 0.281523994932 0.067464972838
+CG3C53 HGA6 1 0.286869387241 0.070011711020
+CG3C53 HGA7 1 0.285087589805 0.072469005789
+CG3C53 HGAAM0 1 0.283305792369 0.070011711020
+CG3C53 HGAAM1 1 0.283305792369 0.070011711020
+CG3C53 HGAAM2 1 0.281523994932 0.083680000000
+CG3C53 HGP1 1 0.189271432669 0.089736802707
+CG3C53 HGP2 1 0.189271432669 0.089736802707
+CG3C53 HGP3 1 0.209361198763 0.132309697301
+CG3C53 HGP4 1 0.189271432669 0.089736802707
+CG3C53 HGP5 1 0.231633666716 0.089736802707
+CG3C53 HGPAM1 1 0.247224394284 0.039692909190
+CG3C53 HGPAM2 1 0.247224394284 0.041840000000
+CG3C53 HGPAM3 1 0.246778944925 0.045833423612
+CG3C53 HGR51 1 0.290272620344 0.072469005789
+CG3C53 HGR52 1 0.249451641079 0.089736802707
+CG3C53 HGR53 1 0.231633666716 0.089736802707
+CG3C53 HGR61 1 0.290272620344 0.072469005789
+CG3C53 HGR62 1 0.267269615442 0.089736802707
+CG3C53 HGR63 1 0.249451641079 0.089736802707
+CG3C53 HGR71 1 0.290272620344 0.072469005789
+CG3C53 CG1T1 1 0.333196120584 0.170981810495
+CG3C53 CG1T2 1 0.346782326036 0.134409982486
+CG3C53 CG1N1 1 0.335868816739 0.177512086349
+CG3C53 CG2D1 1 0.355468588538 0.109105371453
+CG3C53 CG2D2 1 0.354577689820 0.105847757841
+CG3C53 CG2D1O 1 0.355468588538 0.109105371453
+CG3C53 CG2D2O 1 0.355468588538 0.109105371453
+CG3C53 CG2DC1 1 0.355468588538 0.109105371453
+CG3C53 CG2DC2 1 0.355468588538 0.109105371453
+CG3C53 CG2DC3 1 0.354577689820 0.105847757841
+CG3C53 CG25C1 1 0.355468588538 0.109105371453
+CG3C53 CG25C2 1 0.355468588538 0.109105371453
+CG3C53 CG251O 1 0.355468588538 0.109105371453
+CG3C53 CG252O 1 0.355468588538 0.109105371453
+CG3C53 CG2N1 1 0.347450500075 0.138767581228
+CG3C53 CG2N2 1 0.347450500075 0.138767581228
+CG3C53 CG2O1 1 0.347450500075 0.138767581228
+CG3C53 CG2O2 1 0.320723538531 0.130979917850
+CG3C53 CG2O3 1 0.347450500075 0.110698234855
+CG3C53 CG2O4 1 0.329632525712 0.102486650838
+CG3C53 CG2O5 1 0.347450500075 0.125520000000
+CG3C53 CG2O6 1 0.347450500075 0.110698234855
+CG3C53 CG2O7 1 0.308518226092 0.100764063435
+CG3C53 CG2R51 1 0.356359487256 0.093557084179
+CG3C53 CG2R52 1 0.365268474438 0.059170695450
+CG3C53 CG2R53 1 0.365268474438 0.059170695450
+CG3C53 CG2R57 1 0.356359487256 0.093557084179
+CG3C53 CG2R61 1 0.346773417049 0.110698234855
+CG3C53 CG2R62 1 0.338541512893 0.125520000000
+CG3C53 CG2R63 1 0.338541512893 0.132309697301
+CG3C53 CG2R64 1 0.356359487256 0.083680000000
+CG3C53 CG2R66 1 0.338541512893 0.110698234855
+CG3C53 CG2R67 1 0.346773417049 0.110698234855
+CG3C53 CG2RC0 1 0.334977918021 0.131646486622
+CG3C53 CG2R71 1 0.346987232741 0.108300154755
+CG3C53 CG2RC7 1 0.334977918021 0.131646486622
+CG3C53 CG301 1 0.338541512893 0.041840000000
+CG3C53 CG302 1 0.374177461619 0.059170695450
+CG3C53 CG311 1 0.338541512893 0.041840000000
+CG3C53 CG312 1 0.351904993665 0.085746484010
+CG3C53 CG314 1 0.338541512893 0.041840000000
+CG3C53 CG321 1 0.338541512893 0.041840000000
+CG3C53 CG322 1 0.338541512893 0.102486650838
+CG3C53 CG323 1 0.365268474438 0.138767581228
+CG3C53 CG324 1 0.338541512893 0.041840000000
+CG3C53 CG331 1 0.338541512893 0.041840000000
+CG3C53 CG334 1 0.338541512893 0.041840000000
+CG3C53 CG3C50 1 0.338541512893 0.041840000000
+CG3C53 CG3C51 1 0.338541512893 0.041840000000
+CG3C53 CG3C52 1 0.338541512893 0.041840000000
+CG3C53 CG3C53 1 0.338541512893 0.041840000000
+CG3C53 CG3C54 1 0.338541512893 0.041840000000
+CG3C53 CG3C31 1 0.338541512893 0.041840000000
+CG3C53 CG3C41 1 0.338541512893 0.041840000000
+CG3C53 CG3RC1 1 0.338541512893 0.041840000000
+CG3C53 CG3AM0 1 0.344777803920 0.110698234855
+CG3C53 CG3AM1 1 0.345668702638 0.116852760686
+CG3C53 CG3AM2 1 0.346559601357 0.118341390899
+CG3C53 NG1T1 1 0.328741626994 0.177512086349
+CG3C53 NG2D1 1 0.334087019303 0.187114168357
+CG3C53 NG2S0 1 0.334087019303 0.004184000000
+CG3C53 NG2S1 1 0.307360057758 0.187114168357
+CG3C53 NG2S2 1 0.334087019303 0.187114168357
+CG3C53 NG2S3 1 0.334087019303 0.187114168357
+CG3C53 NG2O1 1 0.334087019303 0.187114168357
+CG3C53 NG2P1 1 0.334087019303 0.187114168357
+CG3C53 NG2R43 1 0.334087019303 0.187114168357
+CG3C53 NG2R50 1 0.334087019303 0.187114168357
+CG3C53 NG2R51 1 0.334087019303 0.187114168357
+CG3C53 NG2R52 1 0.334087019303 0.187114168357
+CG3C53 NG2R53 1 0.334087019303 0.187114168357
+CG3C53 NG2R57 1 0.334087019303 0.187114168357
+CG3C53 NG2R60 1 0.337650614175 0.102486650838
+CG3C53 NG2R61 1 0.334087019303 0.187114168357
+CG3C53 NG2R62 1 0.352795892384 0.093557084179
+CG3C53 NG2R67 1 0.334087019303 0.187114168357
+CG3C53 NG2RC0 1 0.334087019303 0.187114168357
+CG3C53 NG301 1 0.347450500075 0.078275472531
+CG3C53 NG311 1 0.347450500075 0.088756043175
+CG3C53 NG321 1 0.346559601357 0.102486650838
+CG3C53 NG331 1 0.345668702638 0.110698234855
+CG3C53 NG3C51 1 0.334087019303 0.187114168357
+CG3C53 NG3N1 1 0.351904993665 0.102486650838
+CG3C53 NG3P0 1 0.334087019303 0.187114168357
+CG3C53 NG3P1 1 0.334087019303 0.187114168357
+CG3C53 NG3P2 1 0.334087019303 0.187114168357
+CG3C53 NG3P3 1 0.334087019303 0.187114168357
+CG3C53 OG2D1 1 0.293996576986 0.144938011577
+CG3C53 OG2D2 1 0.320723538531 0.144938011577
+CG3C53 OG2D3 1 0.293996576986 0.144938011577
+CG3C53 OG2D4 1 0.320723538531 0.144938011577
+CG3C53 OG2D5 1 0.320010819556 0.169954883425
+CG3C53 OG2N1 1 0.320723538531 0.144938011577
+CG3C53 OG2P1 1 0.320723538531 0.144938011577
+CG3C53 OG2R50 1 0.320723538531 0.144938011577
+CG3C53 OG3R60 1 0.316269044940 0.132309697301
+CG3C53 OG301 1 0.316269044940 0.132309697301
+CG3C53 OG302 1 0.316269044940 0.132309697301
+CG3C53 OG303 1 0.316269044940 0.132309697301
+CG3C53 OG304 1 0.316269044940 0.132309697301
+CG3C53 OG311 1 0.326514380198 0.183381431383
+CG3C53 OG312 1 0.325178032121 0.144938011577
+CG3C53 OG3C31 1 0.316269044940 0.132309697301
+CG3C53 OG3C51 1 0.316269044940 0.132309697301
+CG3C53 OG3C61 1 0.316269044940 0.132309697301
+CG3C53 SG2D1 1 0.351904993665 0.314496560236
+CG3C53 SG2R50 1 0.347450500075 0.280671252536
+CG3C53 SG311 1 0.347450500075 0.280671252536
+CG3C53 SG301 1 0.345223253279 0.257919081884
+CG3C53 SG302 1 0.365268474438 0.286840588481
+CG3C53 SG3O1 1 0.356359487256 0.286840588481
+CG3C53 SG3O2 1 0.347450500075 0.247528778125
+CG3C53 SG3O3 1 0.347450500075 0.247528778125
+CG3C53 FGA1 1 0.314487247504 0.153729976257
+CG3C53 FGA2 1 0.314487247504 0.135577095411
+CG3C53 FGA3 1 0.311814551349 0.130309939452
+CG3C53 FGP1 1 0.311814551349 0.130309939452
+CG3C53 FGR1 1 0.320723538531 0.144938011577
+CG3C53 CLGA1 1 0.339432411611 0.245040988571
+CG3C53 CLGA3 1 0.339432411611 0.232955260941
+CG3C53 CLGR1 1 0.341214209048 0.236682781799
+CG3C53 BRGA1 1 0.344777803920 0.289876023155
+CG3C53 BRGA2 1 0.351904993665 0.304599797767
+CG3C53 BRGA3 1 0.347450500075 0.307459952514
+CG3C53 BRGR1 1 0.353686791102 0.271154190821
+CG3C53 IGR1 1 0.364377575719 0.310293744700
+CG3C53 PG0 1 0.360813980847 0.320014464673
+CG3C53 PG1 1 0.360813980847 0.320014464673
+CG3C53 PG2 1 0.360813980847 0.320014464673
+CG3C53 ALG1 1 0.347450500075 0.337324864189
+CG3C53 CC301 1 0.338541512893 0.041840000000
+CG3C53 CC3062 1 0.338541512893 0.041840000000
+CG3C53 CC311 1 0.338541512893 0.041840000000
+CG3C53 CC3161 1 0.338541512893 0.041840000000
+CG3C53 CC3162 1 0.338541512893 0.041840000000
+CG3C53 CC3163 1 0.338541512893 0.041840000000
+CG3C53 CC321 1 0.338541512893 0.041840000000
+CG3C53 CC3261 1 0.338541512893 0.041840000000
+CG3C53 CC3263 1 0.338541512893 0.041840000000
+CG3C53 CC331 1 0.338541512893 0.041840000000
+CG3C53 CC2O1 1 0.347450500075 0.138767581228
+CG3C53 CC2O2 1 0.347450500075 0.110698234855
+CG3C53 CC2O3 1 0.347450500075 0.125520000000
+CG3C53 CC2O4 1 0.329632525712 0.102486650838
+CG3C53 OC2D1 1 0.293996576986 0.144938011577
+CG3C53 OC2D2 1 0.320723538531 0.144938011577
+CG3C53 OC2D3 1 0.293996576986 0.144938011577
+CG3C53 OC2D4 1 0.293996576986 0.144938011577
+CG3C53 OC3C61 1 0.316269044940 0.132309697301
+CG3C53 OC311 1 0.326514380198 0.183381431383
+CG3C53 NC2D1 1 0.307360057758 0.187114168357
+CG3C53 HCP1 1 0.189271432669 0.089736802707
+CG3C53 HCA1 1 0.288651184677 0.088756043175
+CG3C53 HCA2 1 0.288651184677 0.078275472531
+CG3C53 HCA3 1 0.288651184677 0.064818249282
+CG3C53 CC312 1 0.338541512893 0.041840000000
+CG3C53 CC322 1 0.338541512893 0.041840000000
+CG3C53 HCR1 1 0.240542653898 0.089736802707
+CG3C53 HCA3M 1 0.288651184677 0.064818249282
+CG3C53 CC321C 1 0.338541512893 0.041840000000
+CG3C53 CC321D 1 0.338541512893 0.041840000000
+CG3C53 CC311C 1 0.338541512893 0.041840000000
+CG3C53 CC311D 1 0.338541512893 0.041840000000
+CG3C53 OC301 1 0.316269044940 0.132309697301
+CG3C53 OC302 1 0.316269044940 0.132309697301
+CG3C53 HCP1M 1 0.189271432669 0.089736802707
+CG3C53 OC311M 1 0.326514380198 0.183381431383
+CG3C53 OC3C5M 1 0.316269044940 0.132309697301
+CG3C53 CC322C 1 0.338541512893 0.041840000000
+CG3C53 HCA2C2 1 0.285087589805 0.078275472531
+CG3C53 CC312C 1 0.338541512893 0.041840000000
+CG3C53 HCA1C2 1 0.288651184677 0.088756043175
+CG3C53 OC3C51 1 0.316269044940 0.132309697301
+CG3C53 CC3152 1 0.338541512893 0.041840000000
+CG3C53 CC3051 1 0.338541512893 0.041840000000
+CG3C53 CC3251 1 0.338541512893 0.041840000000
+CG3C53 CC3151 1 0.338541512893 0.041840000000
+CG3C53 CC3153 1 0.338541512893 0.041840000000
+CG3C53 OC2DP 1 0.320723538531 0.144938011577
+CG3C53 OC312 1 0.326959829558 0.163176000000
+CG3C53 OC30P 1 0.326959829558 0.163176000000
+CG3C53 PC 1 0.360813980847 0.320014464673
+CG3C53 SC 1 0.356359487256 0.286840588481
+CG3C53 CC312D 1 0.338541512893 0.041840000000
+CG3C53 OC303 1 0.316269044940 0.132309697301
+CG3C53 HN1 1 0.189271432669 0.089736802707
+CG3C53 HN2 1 0.189271432669 0.089736802707
+CG3C53 HN3 1 0.267269615442 0.089736802707
+CG3C53 HN4 1 0.189271432669 0.089736802707
+CG3C53 HN5 1 0.189271432669 0.089736802707
+CG3C53 HN6 1 0.286869387241 0.062058748940
+CG3C53 HN7 1 0.286869387241 0.062058748940
+CG3C53 HN8 1 0.288651184677 0.070011711020
+CG3C53 HN9 1 0.288651184677 0.064818249282
+CG3C53 NN1 1 0.334087019303 0.187114168357
+CG3C53 NN2 1 0.334087019303 0.187114168357
+CG3C53 NN2B 1 0.334087019303 0.187114168357
+CG3C53 NN2G 1 0.334087019303 0.187114168357
+CG3C53 NN2U 1 0.334087019303 0.187114168357
+CG3C53 NN3 1 0.334087019303 0.187114168357
+CG3C53 NN3A 1 0.334087019303 0.187114168357
+CG3C53 NN3G 1 0.334087019303 0.187114168357
+CG3C53 NN4 1 0.334087019303 0.187114168357
+CG3C53 NN6 1 0.334087019303 0.187114168357
+CG3C53 ON1 1 0.320723538531 0.144938011577
+CG3C53 ON1C 1 0.320723538531 0.144938011577
+CG3C53 ON2 1 0.326959829558 0.163176000000
+CG3C53 ON3 1 0.320723538531 0.144938011577
+CG3C53 ON4 1 0.326959829558 0.163176000000
+CG3C53 ON5 1 0.326959829558 0.163176000000
+CG3C53 ON6 1 0.326959829558 0.163176000000
+CG3C53 ON6B 1 0.326959829558 0.163176000000
+CG3C53 CN1 1 0.338541512893 0.132309697301
+CG3C53 CN1T 1 0.338541512893 0.132309697301
+CG3C53 CN2 1 0.338541512893 0.132309697301
+CG3C53 CN3 1 0.338541512893 0.125520000000
+CG3C53 CN3T 1 0.338541512893 0.125520000000
+CG3C53 CN4 1 0.338541512893 0.114583559030
+CG3C53 CN5 1 0.338541512893 0.114583559030
+CG3C53 CN5G 1 0.338541512893 0.114583559030
+CG3C53 CN7 1 0.338541512893 0.041840000000
+CG3C53 CN7B 1 0.338541512893 0.041840000000
+CG3C53 CN8 1 0.338541512893 0.041840000000
+CG3C53 CN8B 1 0.338541512893 0.041840000000
+CG3C53 CN9 1 0.338541512893 0.041840000000
+CG3C53 P 1 0.360813980847 0.320014464673
+CG3C53 P2 1 0.360813980847 0.320014464673
+CG3C53 HOL 1 0.189271432669 0.089736802707
+CG3C53 HAL1 1 0.286869387241 0.062058748940
+CG3C53 HAL2 1 0.288651184677 0.070011711020
+CG3C53 HAL3 1 0.288651184677 0.064818249282
+CG3C53 HBL 1 0.286869387241 0.062058748940
+CG3C53 HCL 1 0.189271432669 0.089736802707
+CG3C53 HL 1 0.231633666716 0.089736802707
+CG3C53 HEL1 1 0.280633096214 0.073666921749
+CG3C53 HEL2 1 0.281523994932 0.067464972838
+CG3C53 CL 1 0.347450500075 0.110698234855
+CG3C53 CCL 1 0.347450500075 0.110698234855
+CG3C53 CTL1 1 0.338541512893 0.041840000000
+CG3C53 CTL2 1 0.338541512893 0.041840000000
+CG3C53 CTL3 1 0.338541512893 0.041840000000
+CG3C53 CTL5 1 0.338541512893 0.041840000000
+CG3C53 CEL1 1 0.355468588538 0.109105371453
+CG3C53 CEL2 1 0.354577689820 0.105847757841
+CG3C53 CRL1 1 0.338541512893 0.041840000000
+CG3C53 CRL2 1 0.338541512893 0.041840000000
+CG3C53 OBL 1 0.293996576986 0.144938011577
+CG3C53 OCL 1 0.320723538531 0.144938011577
+CG3C53 O2L 1 0.320723538531 0.144938011577
+CG3C53 OHL 1 0.326959829558 0.163176000000
+CG3C53 OSL 1 0.316269044940 0.132309697301
+CG3C53 OSLP 1 0.316269044940 0.132309697301
+CG3C53 NH3L 1 0.334087019303 0.187114168357
+CG3C53 NTL 1 0.334087019303 0.187114168357
+CG3C53 SL 1 0.356359487256 0.286840588481
+CG3C53 PL 1 0.360813980847 0.320014464673
+CG3C53 HCA1A 1 0.288651184677 0.088756043175
+CG3C53 HCA2A 1 0.288651184677 0.078275472531
+CG3C53 HCA3A 1 0.288651184677 0.064818249282
+CG3C53 CC30A 1 0.338541512893 0.041840000000
+CG3C53 CC31A 1 0.338541512893 0.041840000000
+CG3C53 CC32A 1 0.338541512893 0.041840000000
+CG3C53 CC33A 1 0.338541512893 0.041840000000
+CG3C53 CC326A 1 0.338541512893 0.041840000000
+CG3C53 HCA25A 1 0.285087589805 0.078275472531
+CG3C53 CC325A 1 0.338541512893 0.041840000000
+CG3C53 CC325B 1 0.338541512893 0.041840000000
+CG3C53 OC305A 1 0.316269044940 0.132309697301
+CG3C53 OC30A 1 0.316269044940 0.132309697301
+CG3C53 CPA 1 0.329632525712 0.125520000000
+CG3C53 CPB 1 0.329632525712 0.125520000000
+CG3C53 CPM 1 0.329632525712 0.125520000000
+CG3C53 CM 1 0.356359487256 0.138767581228
+CG3C53 CST 1 0.308518226092 0.100764063435
+CG3C53 NPH 1 0.334087019303 0.187114168357
+CG3C53 OM 1 0.320723538531 0.144938011577
+CG3C53 OST 1 0.320010819556 0.169954883425
+CG3C53 FE 1 0.227179173126 0.000000000000
+CG3C53 ON2B 1 0.326959829558 0.163176000000
+CG3C53 SP 1 0.365268474438 0.280671252536
+CG3C54 C 1 0.347450500075 0.138767581228
+CG3C54 CA 1 0.346773417049 0.110698234855
+CG3C54 CC 1 0.347450500075 0.110698234855
+CG3C54 CD 1 0.347450500075 0.110698234855
+CG3C54 CE1 1 0.355468588538 0.109105371453
+CG3C54 CE2 1 0.354577689820 0.105847757841
+CG3C54 CP1 1 0.338541512893 0.041840000000
+CG3C54 CP2 1 0.338541512893 0.041840000000
+CG3C54 CP3 1 0.338541512893 0.041840000000
+CG3C54 CPH1 1 0.329632525712 0.093557084179
+CG3C54 CPH2 1 0.329632525712 0.093557084179
+CG3C54 CS 1 0.365268474438 0.138767581228
+CG3C54 CPT 1 0.334977918021 0.131646486622
+CG3C54 CY 1 0.346559601357 0.113045454929
+CG3C54 CAI 1 0.346559601357 0.113045454929
+CG3C54 CT 1 0.338541512893 0.041840000000
+CG3C54 CT1 1 0.338541512893 0.041840000000
+CG3C54 CT2 1 0.338541512893 0.041840000000
+CG3C54 CT2A 1 0.338541512893 0.041840000000
+CG3C54 CT3 1 0.338541512893 0.041840000000
+CG3C54 H 1 0.189271432669 0.089736802707
+CG3C54 HA 1 0.286869387241 0.062058748940
+CG3C54 HB1 1 0.286869387241 0.062058748940
+CG3C54 HB2 1 0.288651184677 0.070011711020
+CG3C54 HE1 1 0.280633096214 0.073666921749
+CG3C54 HE2 1 0.281523994932 0.067464972838
+CG3C54 HC 1 0.189271432669 0.089736802707
+CG3C54 HP 1 0.290272620344 0.072469005789
+CG3C54 HR1 1 0.249451641079 0.089736802707
+CG3C54 HR2 1 0.231633666716 0.089736802707
+CG3C54 HR3 1 0.300054688270 0.036952087465
+CG3C54 HS 1 0.209361198763 0.132309697301
+CG3C54 HA1 1 0.288651184677 0.088756043175
+CG3C54 HA2 1 0.288651184677 0.077149148019
+CG3C54 HA3 1 0.288651184677 0.064818249282
+CG3C54 N 1 0.334087019303 0.004184000000
+CG3C54 NC2 1 0.334087019303 0.187114168357
+CG3C54 NH1 1 0.307360057758 0.187114168357
+CG3C54 NH2 1 0.334087019303 0.187114168357
+CG3C54 NH3 1 0.334087019303 0.187114168357
+CG3C54 NP 1 0.334087019303 0.187114168357
+CG3C54 NR1 1 0.334087019303 0.187114168357
+CG3C54 NR2 1 0.334087019303 0.187114168357
+CG3C54 NR3 1 0.334087019303 0.187114168357
+CG3C54 NY 1 0.334087019303 0.187114168357
+CG3C54 O 1 0.293996576986 0.144938011577
+CG3C54 OB 1 0.293996576986 0.144938011577
+CG3C54 OC 1 0.320723538531 0.144938011577
+CG3C54 OH1 1 0.326959829558 0.163176000000
+CG3C54 OS 1 0.326959829558 0.163176000000
+CG3C54 S 1 0.347450500075 0.280671252536
+CG3C54 SM 1 0.345223253279 0.257919081884
+CG3C54 SS 1 0.365268474438 0.286840588481
+CG3C54 HT 1 0.189271432669 0.089736802707
+CG3C54 OT 1 0.326799467788 0.163176000000
+CG3C54 OX 1 0.320723538531 0.144938011577
+CG3C54 HX 1 0.189271432669 0.089736802707
+CG3C54 LIT 1 0.284864865125 0.020196198771
+CG3C54 SOD 1 0.294954293108 0.090610410351
+CG3C54 MG 1 0.274842254546 0.051243325419
+CG3C54 POT 1 0.326403017859 0.123410269913
+CG3C54 CAL 1 0.291056611216 0.144938011577
+CG3C54 RUB 1 0.338541512893 0.162045623205
+CG3C54 CES 1 0.356359487256 0.182376331798
+CG3C54 BAR 1 0.337650614175 0.162045623205
+CG3C54 ZN 1 0.266378716724 0.209200000000
+CG3C54 CAD 1 0.290165712498 0.144938011577
+CG3C54 CLA 1 0.371504765465 0.162045623205
+CG3C54 HGA1 1 0.288651184677 0.088756043175
+CG3C54 HGA2 1 0.288651184677 0.078275472531
+CG3C54 HGA3 1 0.288651184677 0.064818249282
+CG3C54 HGA4 1 0.280633096214 0.073666921749
+CG3C54 HGA5 1 0.281523994932 0.067464972838
+CG3C54 HGA6 1 0.286869387241 0.070011711020
+CG3C54 HGA7 1 0.285087589805 0.072469005789
+CG3C54 HGAAM0 1 0.283305792369 0.070011711020
+CG3C54 HGAAM1 1 0.283305792369 0.070011711020
+CG3C54 HGAAM2 1 0.281523994932 0.083680000000
+CG3C54 HGP1 1 0.189271432669 0.089736802707
+CG3C54 HGP2 1 0.189271432669 0.089736802707
+CG3C54 HGP3 1 0.209361198763 0.132309697301
+CG3C54 HGP4 1 0.189271432669 0.089736802707
+CG3C54 HGP5 1 0.231633666716 0.089736802707
+CG3C54 HGPAM1 1 0.247224394284 0.039692909190
+CG3C54 HGPAM2 1 0.247224394284 0.041840000000
+CG3C54 HGPAM3 1 0.246778944925 0.045833423612
+CG3C54 HGR51 1 0.290272620344 0.072469005789
+CG3C54 HGR52 1 0.249451641079 0.089736802707
+CG3C54 HGR53 1 0.231633666716 0.089736802707
+CG3C54 HGR61 1 0.290272620344 0.072469005789
+CG3C54 HGR62 1 0.267269615442 0.089736802707
+CG3C54 HGR63 1 0.249451641079 0.089736802707
+CG3C54 HGR71 1 0.290272620344 0.072469005789
+CG3C54 CG1T1 1 0.333196120584 0.170981810495
+CG3C54 CG1T2 1 0.346782326036 0.134409982486
+CG3C54 CG1N1 1 0.335868816739 0.177512086349
+CG3C54 CG2D1 1 0.355468588538 0.109105371453
+CG3C54 CG2D2 1 0.354577689820 0.105847757841
+CG3C54 CG2D1O 1 0.355468588538 0.109105371453
+CG3C54 CG2D2O 1 0.355468588538 0.109105371453
+CG3C54 CG2DC1 1 0.355468588538 0.109105371453
+CG3C54 CG2DC2 1 0.355468588538 0.109105371453
+CG3C54 CG2DC3 1 0.354577689820 0.105847757841
+CG3C54 CG25C1 1 0.355468588538 0.109105371453
+CG3C54 CG25C2 1 0.355468588538 0.109105371453
+CG3C54 CG251O 1 0.355468588538 0.109105371453
+CG3C54 CG252O 1 0.355468588538 0.109105371453
+CG3C54 CG2N1 1 0.347450500075 0.138767581228
+CG3C54 CG2N2 1 0.347450500075 0.138767581228
+CG3C54 CG2O1 1 0.347450500075 0.138767581228
+CG3C54 CG2O2 1 0.320723538531 0.130979917850
+CG3C54 CG2O3 1 0.347450500075 0.110698234855
+CG3C54 CG2O4 1 0.329632525712 0.102486650838
+CG3C54 CG2O5 1 0.347450500075 0.125520000000
+CG3C54 CG2O6 1 0.347450500075 0.110698234855
+CG3C54 CG2O7 1 0.308518226092 0.100764063435
+CG3C54 CG2R51 1 0.356359487256 0.093557084179
+CG3C54 CG2R52 1 0.365268474438 0.059170695450
+CG3C54 CG2R53 1 0.365268474438 0.059170695450
+CG3C54 CG2R57 1 0.356359487256 0.093557084179
+CG3C54 CG2R61 1 0.346773417049 0.110698234855
+CG3C54 CG2R62 1 0.338541512893 0.125520000000
+CG3C54 CG2R63 1 0.338541512893 0.132309697301
+CG3C54 CG2R64 1 0.356359487256 0.083680000000
+CG3C54 CG2R66 1 0.338541512893 0.110698234855
+CG3C54 CG2R67 1 0.346773417049 0.110698234855
+CG3C54 CG2RC0 1 0.334977918021 0.131646486622
+CG3C54 CG2R71 1 0.346987232741 0.108300154755
+CG3C54 CG2RC7 1 0.334977918021 0.131646486622
+CG3C54 CG301 1 0.338541512893 0.041840000000
+CG3C54 CG302 1 0.374177461619 0.059170695450
+CG3C54 CG311 1 0.338541512893 0.041840000000
+CG3C54 CG312 1 0.351904993665 0.085746484010
+CG3C54 CG314 1 0.338541512893 0.041840000000
+CG3C54 CG321 1 0.338541512893 0.041840000000
+CG3C54 CG322 1 0.338541512893 0.102486650838
+CG3C54 CG323 1 0.365268474438 0.138767581228
+CG3C54 CG324 1 0.338541512893 0.041840000000
+CG3C54 CG331 1 0.338541512893 0.041840000000
+CG3C54 CG334 1 0.338541512893 0.041840000000
+CG3C54 CG3C50 1 0.338541512893 0.041840000000
+CG3C54 CG3C51 1 0.338541512893 0.041840000000
+CG3C54 CG3C52 1 0.338541512893 0.041840000000
+CG3C54 CG3C53 1 0.338541512893 0.041840000000
+CG3C54 CG3C54 1 0.338541512893 0.041840000000
+CG3C54 CG3C31 1 0.338541512893 0.041840000000
+CG3C54 CG3C41 1 0.338541512893 0.041840000000
+CG3C54 CG3RC1 1 0.338541512893 0.041840000000
+CG3C54 CG3AM0 1 0.344777803920 0.110698234855
+CG3C54 CG3AM1 1 0.345668702638 0.116852760686
+CG3C54 CG3AM2 1 0.346559601357 0.118341390899
+CG3C54 NG1T1 1 0.328741626994 0.177512086349
+CG3C54 NG2D1 1 0.334087019303 0.187114168357
+CG3C54 NG2S0 1 0.334087019303 0.004184000000
+CG3C54 NG2S1 1 0.307360057758 0.187114168357
+CG3C54 NG2S2 1 0.334087019303 0.187114168357
+CG3C54 NG2S3 1 0.334087019303 0.187114168357
+CG3C54 NG2O1 1 0.334087019303 0.187114168357
+CG3C54 NG2P1 1 0.334087019303 0.187114168357
+CG3C54 NG2R43 1 0.334087019303 0.187114168357
+CG3C54 NG2R50 1 0.334087019303 0.187114168357
+CG3C54 NG2R51 1 0.334087019303 0.187114168357
+CG3C54 NG2R52 1 0.334087019303 0.187114168357
+CG3C54 NG2R53 1 0.334087019303 0.187114168357
+CG3C54 NG2R57 1 0.334087019303 0.187114168357
+CG3C54 NG2R60 1 0.337650614175 0.102486650838
+CG3C54 NG2R61 1 0.334087019303 0.187114168357
+CG3C54 NG2R62 1 0.352795892384 0.093557084179
+CG3C54 NG2R67 1 0.334087019303 0.187114168357
+CG3C54 NG2RC0 1 0.334087019303 0.187114168357
+CG3C54 NG301 1 0.347450500075 0.078275472531
+CG3C54 NG311 1 0.347450500075 0.088756043175
+CG3C54 NG321 1 0.346559601357 0.102486650838
+CG3C54 NG331 1 0.345668702638 0.110698234855
+CG3C54 NG3C51 1 0.334087019303 0.187114168357
+CG3C54 NG3N1 1 0.351904993665 0.102486650838
+CG3C54 NG3P0 1 0.334087019303 0.187114168357
+CG3C54 NG3P1 1 0.334087019303 0.187114168357
+CG3C54 NG3P2 1 0.334087019303 0.187114168357
+CG3C54 NG3P3 1 0.334087019303 0.187114168357
+CG3C54 OG2D1 1 0.293996576986 0.144938011577
+CG3C54 OG2D2 1 0.320723538531 0.144938011577
+CG3C54 OG2D3 1 0.293996576986 0.144938011577
+CG3C54 OG2D4 1 0.320723538531 0.144938011577
+CG3C54 OG2D5 1 0.320010819556 0.169954883425
+CG3C54 OG2N1 1 0.320723538531 0.144938011577
+CG3C54 OG2P1 1 0.320723538531 0.144938011577
+CG3C54 OG2R50 1 0.320723538531 0.144938011577
+CG3C54 OG3R60 1 0.316269044940 0.132309697301
+CG3C54 OG301 1 0.316269044940 0.132309697301
+CG3C54 OG302 1 0.316269044940 0.132309697301
+CG3C54 OG303 1 0.316269044940 0.132309697301
+CG3C54 OG304 1 0.316269044940 0.132309697301
+CG3C54 OG311 1 0.326514380198 0.183381431383
+CG3C54 OG312 1 0.325178032121 0.144938011577
+CG3C54 OG3C31 1 0.316269044940 0.132309697301
+CG3C54 OG3C51 1 0.316269044940 0.132309697301
+CG3C54 OG3C61 1 0.316269044940 0.132309697301
+CG3C54 SG2D1 1 0.351904993665 0.314496560236
+CG3C54 SG2R50 1 0.347450500075 0.280671252536
+CG3C54 SG311 1 0.347450500075 0.280671252536
+CG3C54 SG301 1 0.345223253279 0.257919081884
+CG3C54 SG302 1 0.365268474438 0.286840588481
+CG3C54 SG3O1 1 0.356359487256 0.286840588481
+CG3C54 SG3O2 1 0.347450500075 0.247528778125
+CG3C54 SG3O3 1 0.347450500075 0.247528778125
+CG3C54 FGA1 1 0.314487247504 0.153729976257
+CG3C54 FGA2 1 0.314487247504 0.135577095411
+CG3C54 FGA3 1 0.311814551349 0.130309939452
+CG3C54 FGP1 1 0.311814551349 0.130309939452
+CG3C54 FGR1 1 0.320723538531 0.144938011577
+CG3C54 CLGA1 1 0.339432411611 0.245040988571
+CG3C54 CLGA3 1 0.339432411611 0.232955260941
+CG3C54 CLGR1 1 0.341214209048 0.236682781799
+CG3C54 BRGA1 1 0.344777803920 0.289876023155
+CG3C54 BRGA2 1 0.351904993665 0.304599797767
+CG3C54 BRGA3 1 0.347450500075 0.307459952514
+CG3C54 BRGR1 1 0.353686791102 0.271154190821
+CG3C54 IGR1 1 0.364377575719 0.310293744700
+CG3C54 PG0 1 0.360813980847 0.320014464673
+CG3C54 PG1 1 0.360813980847 0.320014464673
+CG3C54 PG2 1 0.360813980847 0.320014464673
+CG3C54 ALG1 1 0.347450500075 0.337324864189
+CG3C54 CC301 1 0.338541512893 0.041840000000
+CG3C54 CC3062 1 0.338541512893 0.041840000000
+CG3C54 CC311 1 0.338541512893 0.041840000000
+CG3C54 CC3161 1 0.338541512893 0.041840000000
+CG3C54 CC3162 1 0.338541512893 0.041840000000
+CG3C54 CC3163 1 0.338541512893 0.041840000000
+CG3C54 CC321 1 0.338541512893 0.041840000000
+CG3C54 CC3261 1 0.338541512893 0.041840000000
+CG3C54 CC3263 1 0.338541512893 0.041840000000
+CG3C54 CC331 1 0.338541512893 0.041840000000
+CG3C54 CC2O1 1 0.347450500075 0.138767581228
+CG3C54 CC2O2 1 0.347450500075 0.110698234855
+CG3C54 CC2O3 1 0.347450500075 0.125520000000
+CG3C54 CC2O4 1 0.329632525712 0.102486650838
+CG3C54 OC2D1 1 0.293996576986 0.144938011577
+CG3C54 OC2D2 1 0.320723538531 0.144938011577
+CG3C54 OC2D3 1 0.293996576986 0.144938011577
+CG3C54 OC2D4 1 0.293996576986 0.144938011577
+CG3C54 OC3C61 1 0.316269044940 0.132309697301
+CG3C54 OC311 1 0.326514380198 0.183381431383
+CG3C54 NC2D1 1 0.307360057758 0.187114168357
+CG3C54 HCP1 1 0.189271432669 0.089736802707
+CG3C54 HCA1 1 0.288651184677 0.088756043175
+CG3C54 HCA2 1 0.288651184677 0.078275472531
+CG3C54 HCA3 1 0.288651184677 0.064818249282
+CG3C54 CC312 1 0.338541512893 0.041840000000
+CG3C54 CC322 1 0.338541512893 0.041840000000
+CG3C54 HCR1 1 0.240542653898 0.089736802707
+CG3C54 HCA3M 1 0.288651184677 0.064818249282
+CG3C54 CC321C 1 0.338541512893 0.041840000000
+CG3C54 CC321D 1 0.338541512893 0.041840000000
+CG3C54 CC311C 1 0.338541512893 0.041840000000
+CG3C54 CC311D 1 0.338541512893 0.041840000000
+CG3C54 OC301 1 0.316269044940 0.132309697301
+CG3C54 OC302 1 0.316269044940 0.132309697301
+CG3C54 HCP1M 1 0.189271432669 0.089736802707
+CG3C54 OC311M 1 0.326514380198 0.183381431383
+CG3C54 OC3C5M 1 0.316269044940 0.132309697301
+CG3C54 CC322C 1 0.338541512893 0.041840000000
+CG3C54 HCA2C2 1 0.285087589805 0.078275472531
+CG3C54 CC312C 1 0.338541512893 0.041840000000
+CG3C54 HCA1C2 1 0.288651184677 0.088756043175
+CG3C54 OC3C51 1 0.316269044940 0.132309697301
+CG3C54 CC3152 1 0.338541512893 0.041840000000
+CG3C54 CC3051 1 0.338541512893 0.041840000000
+CG3C54 CC3251 1 0.338541512893 0.041840000000
+CG3C54 CC3151 1 0.338541512893 0.041840000000
+CG3C54 CC3153 1 0.338541512893 0.041840000000
+CG3C54 OC2DP 1 0.320723538531 0.144938011577
+CG3C54 OC312 1 0.326959829558 0.163176000000
+CG3C54 OC30P 1 0.326959829558 0.163176000000
+CG3C54 PC 1 0.360813980847 0.320014464673
+CG3C54 SC 1 0.356359487256 0.286840588481
+CG3C54 CC312D 1 0.338541512893 0.041840000000
+CG3C54 OC303 1 0.316269044940 0.132309697301
+CG3C54 HN1 1 0.189271432669 0.089736802707
+CG3C54 HN2 1 0.189271432669 0.089736802707
+CG3C54 HN3 1 0.267269615442 0.089736802707
+CG3C54 HN4 1 0.189271432669 0.089736802707
+CG3C54 HN5 1 0.189271432669 0.089736802707
+CG3C54 HN6 1 0.286869387241 0.062058748940
+CG3C54 HN7 1 0.286869387241 0.062058748940
+CG3C54 HN8 1 0.288651184677 0.070011711020
+CG3C54 HN9 1 0.288651184677 0.064818249282
+CG3C54 NN1 1 0.334087019303 0.187114168357
+CG3C54 NN2 1 0.334087019303 0.187114168357
+CG3C54 NN2B 1 0.334087019303 0.187114168357
+CG3C54 NN2G 1 0.334087019303 0.187114168357
+CG3C54 NN2U 1 0.334087019303 0.187114168357
+CG3C54 NN3 1 0.334087019303 0.187114168357
+CG3C54 NN3A 1 0.334087019303 0.187114168357
+CG3C54 NN3G 1 0.334087019303 0.187114168357
+CG3C54 NN4 1 0.334087019303 0.187114168357
+CG3C54 NN6 1 0.334087019303 0.187114168357
+CG3C54 ON1 1 0.320723538531 0.144938011577
+CG3C54 ON1C 1 0.320723538531 0.144938011577
+CG3C54 ON2 1 0.326959829558 0.163176000000
+CG3C54 ON3 1 0.320723538531 0.144938011577
+CG3C54 ON4 1 0.326959829558 0.163176000000
+CG3C54 ON5 1 0.326959829558 0.163176000000
+CG3C54 ON6 1 0.326959829558 0.163176000000
+CG3C54 ON6B 1 0.326959829558 0.163176000000
+CG3C54 CN1 1 0.338541512893 0.132309697301
+CG3C54 CN1T 1 0.338541512893 0.132309697301
+CG3C54 CN2 1 0.338541512893 0.132309697301
+CG3C54 CN3 1 0.338541512893 0.125520000000
+CG3C54 CN3T 1 0.338541512893 0.125520000000
+CG3C54 CN4 1 0.338541512893 0.114583559030
+CG3C54 CN5 1 0.338541512893 0.114583559030
+CG3C54 CN5G 1 0.338541512893 0.114583559030
+CG3C54 CN7 1 0.338541512893 0.041840000000
+CG3C54 CN7B 1 0.338541512893 0.041840000000
+CG3C54 CN8 1 0.338541512893 0.041840000000
+CG3C54 CN8B 1 0.338541512893 0.041840000000
+CG3C54 CN9 1 0.338541512893 0.041840000000
+CG3C54 P 1 0.360813980847 0.320014464673
+CG3C54 P2 1 0.360813980847 0.320014464673
+CG3C54 HOL 1 0.189271432669 0.089736802707
+CG3C54 HAL1 1 0.286869387241 0.062058748940
+CG3C54 HAL2 1 0.288651184677 0.070011711020
+CG3C54 HAL3 1 0.288651184677 0.064818249282
+CG3C54 HBL 1 0.286869387241 0.062058748940
+CG3C54 HCL 1 0.189271432669 0.089736802707
+CG3C54 HL 1 0.231633666716 0.089736802707
+CG3C54 HEL1 1 0.280633096214 0.073666921749
+CG3C54 HEL2 1 0.281523994932 0.067464972838
+CG3C54 CL 1 0.347450500075 0.110698234855
+CG3C54 CCL 1 0.347450500075 0.110698234855
+CG3C54 CTL1 1 0.338541512893 0.041840000000
+CG3C54 CTL2 1 0.338541512893 0.041840000000
+CG3C54 CTL3 1 0.338541512893 0.041840000000
+CG3C54 CTL5 1 0.338541512893 0.041840000000
+CG3C54 CEL1 1 0.355468588538 0.109105371453
+CG3C54 CEL2 1 0.354577689820 0.105847757841
+CG3C54 CRL1 1 0.338541512893 0.041840000000
+CG3C54 CRL2 1 0.338541512893 0.041840000000
+CG3C54 OBL 1 0.293996576986 0.144938011577
+CG3C54 OCL 1 0.320723538531 0.144938011577
+CG3C54 O2L 1 0.320723538531 0.144938011577
+CG3C54 OHL 1 0.326959829558 0.163176000000
+CG3C54 OSL 1 0.316269044940 0.132309697301
+CG3C54 OSLP 1 0.316269044940 0.132309697301
+CG3C54 NH3L 1 0.334087019303 0.187114168357
+CG3C54 NTL 1 0.334087019303 0.187114168357
+CG3C54 SL 1 0.356359487256 0.286840588481
+CG3C54 PL 1 0.360813980847 0.320014464673
+CG3C54 HCA1A 1 0.288651184677 0.088756043175
+CG3C54 HCA2A 1 0.288651184677 0.078275472531
+CG3C54 HCA3A 1 0.288651184677 0.064818249282
+CG3C54 CC30A 1 0.338541512893 0.041840000000
+CG3C54 CC31A 1 0.338541512893 0.041840000000
+CG3C54 CC32A 1 0.338541512893 0.041840000000
+CG3C54 CC33A 1 0.338541512893 0.041840000000
+CG3C54 CC326A 1 0.338541512893 0.041840000000
+CG3C54 HCA25A 1 0.285087589805 0.078275472531
+CG3C54 CC325A 1 0.338541512893 0.041840000000
+CG3C54 CC325B 1 0.338541512893 0.041840000000
+CG3C54 OC305A 1 0.316269044940 0.132309697301
+CG3C54 OC30A 1 0.316269044940 0.132309697301
+CG3C54 CPA 1 0.329632525712 0.125520000000
+CG3C54 CPB 1 0.329632525712 0.125520000000
+CG3C54 CPM 1 0.329632525712 0.125520000000
+CG3C54 CM 1 0.356359487256 0.138767581228
+CG3C54 CST 1 0.308518226092 0.100764063435
+CG3C54 NPH 1 0.334087019303 0.187114168357
+CG3C54 OM 1 0.320723538531 0.144938011577
+CG3C54 OST 1 0.320010819556 0.169954883425
+CG3C54 FE 1 0.227179173126 0.000000000000
+CG3C54 ON2B 1 0.326959829558 0.163176000000
+CG3C54 SP 1 0.365268474438 0.280671252536
+CG3C31 C 1 0.347450500075 0.138767581228
+CG3C31 CA 1 0.346773417049 0.110698234855
+CG3C31 CC 1 0.347450500075 0.110698234855
+CG3C31 CD 1 0.347450500075 0.110698234855
+CG3C31 CE1 1 0.355468588538 0.109105371453
+CG3C31 CE2 1 0.354577689820 0.105847757841
+CG3C31 CP1 1 0.338541512893 0.041840000000
+CG3C31 CP2 1 0.338541512893 0.041840000000
+CG3C31 CP3 1 0.338541512893 0.041840000000
+CG3C31 CPH1 1 0.329632525712 0.093557084179
+CG3C31 CPH2 1 0.329632525712 0.093557084179
+CG3C31 CS 1 0.365268474438 0.138767581228
+CG3C31 CPT 1 0.334977918021 0.131646486622
+CG3C31 CY 1 0.346559601357 0.113045454929
+CG3C31 CAI 1 0.346559601357 0.113045454929
+CG3C31 CT 1 0.338541512893 0.041840000000
+CG3C31 CT1 1 0.338541512893 0.041840000000
+CG3C31 CT2 1 0.338541512893 0.041840000000
+CG3C31 CT2A 1 0.338541512893 0.041840000000
+CG3C31 CT3 1 0.338541512893 0.041840000000
+CG3C31 H 1 0.189271432669 0.089736802707
+CG3C31 HA 1 0.286869387241 0.062058748940
+CG3C31 HB1 1 0.286869387241 0.062058748940
+CG3C31 HB2 1 0.288651184677 0.070011711020
+CG3C31 HE1 1 0.280633096214 0.073666921749
+CG3C31 HE2 1 0.281523994932 0.067464972838
+CG3C31 HC 1 0.189271432669 0.089736802707
+CG3C31 HP 1 0.290272620344 0.072469005789
+CG3C31 HR1 1 0.249451641079 0.089736802707
+CG3C31 HR2 1 0.231633666716 0.089736802707
+CG3C31 HR3 1 0.300054688270 0.036952087465
+CG3C31 HS 1 0.209361198763 0.132309697301
+CG3C31 HA1 1 0.288651184677 0.088756043175
+CG3C31 HA2 1 0.288651184677 0.077149148019
+CG3C31 HA3 1 0.288651184677 0.064818249282
+CG3C31 N 1 0.334087019303 0.004184000000
+CG3C31 NC2 1 0.334087019303 0.187114168357
+CG3C31 NH1 1 0.307360057758 0.187114168357
+CG3C31 NH2 1 0.334087019303 0.187114168357
+CG3C31 NH3 1 0.334087019303 0.187114168357
+CG3C31 NP 1 0.334087019303 0.187114168357
+CG3C31 NR1 1 0.334087019303 0.187114168357
+CG3C31 NR2 1 0.334087019303 0.187114168357
+CG3C31 NR3 1 0.334087019303 0.187114168357
+CG3C31 NY 1 0.334087019303 0.187114168357
+CG3C31 O 1 0.293996576986 0.144938011577
+CG3C31 OB 1 0.293996576986 0.144938011577
+CG3C31 OC 1 0.320723538531 0.144938011577
+CG3C31 OH1 1 0.326959829558 0.163176000000
+CG3C31 OS 1 0.326959829558 0.163176000000
+CG3C31 S 1 0.347450500075 0.280671252536
+CG3C31 SM 1 0.345223253279 0.257919081884
+CG3C31 SS 1 0.365268474438 0.286840588481
+CG3C31 HT 1 0.189271432669 0.089736802707
+CG3C31 OT 1 0.326799467788 0.163176000000
+CG3C31 OX 1 0.320723538531 0.144938011577
+CG3C31 HX 1 0.189271432669 0.089736802707
+CG3C31 LIT 1 0.284864865125 0.020196198771
+CG3C31 SOD 1 0.294954293108 0.090610410351
+CG3C31 MG 1 0.274842254546 0.051243325419
+CG3C31 POT 1 0.326403017859 0.123410269913
+CG3C31 CAL 1 0.291056611216 0.144938011577
+CG3C31 RUB 1 0.338541512893 0.162045623205
+CG3C31 CES 1 0.356359487256 0.182376331798
+CG3C31 BAR 1 0.337650614175 0.162045623205
+CG3C31 ZN 1 0.266378716724 0.209200000000
+CG3C31 CAD 1 0.290165712498 0.144938011577
+CG3C31 CLA 1 0.371504765465 0.162045623205
+CG3C31 HGA1 1 0.288651184677 0.088756043175
+CG3C31 HGA2 1 0.288651184677 0.078275472531
+CG3C31 HGA3 1 0.288651184677 0.064818249282
+CG3C31 HGA4 1 0.280633096214 0.073666921749
+CG3C31 HGA5 1 0.281523994932 0.067464972838
+CG3C31 HGA6 1 0.286869387241 0.070011711020
+CG3C31 HGA7 1 0.285087589805 0.072469005789
+CG3C31 HGAAM0 1 0.283305792369 0.070011711020
+CG3C31 HGAAM1 1 0.283305792369 0.070011711020
+CG3C31 HGAAM2 1 0.281523994932 0.083680000000
+CG3C31 HGP1 1 0.189271432669 0.089736802707
+CG3C31 HGP2 1 0.189271432669 0.089736802707
+CG3C31 HGP3 1 0.209361198763 0.132309697301
+CG3C31 HGP4 1 0.189271432669 0.089736802707
+CG3C31 HGP5 1 0.231633666716 0.089736802707
+CG3C31 HGPAM1 1 0.247224394284 0.039692909190
+CG3C31 HGPAM2 1 0.247224394284 0.041840000000
+CG3C31 HGPAM3 1 0.246778944925 0.045833423612
+CG3C31 HGR51 1 0.290272620344 0.072469005789
+CG3C31 HGR52 1 0.249451641079 0.089736802707
+CG3C31 HGR53 1 0.231633666716 0.089736802707
+CG3C31 HGR61 1 0.290272620344 0.072469005789
+CG3C31 HGR62 1 0.267269615442 0.089736802707
+CG3C31 HGR63 1 0.249451641079 0.089736802707
+CG3C31 HGR71 1 0.290272620344 0.072469005789
+CG3C31 CG1T1 1 0.333196120584 0.170981810495
+CG3C31 CG1T2 1 0.346782326036 0.134409982486
+CG3C31 CG1N1 1 0.335868816739 0.177512086349
+CG3C31 CG2D1 1 0.355468588538 0.109105371453
+CG3C31 CG2D2 1 0.354577689820 0.105847757841
+CG3C31 CG2D1O 1 0.355468588538 0.109105371453
+CG3C31 CG2D2O 1 0.355468588538 0.109105371453
+CG3C31 CG2DC1 1 0.355468588538 0.109105371453
+CG3C31 CG2DC2 1 0.355468588538 0.109105371453
+CG3C31 CG2DC3 1 0.354577689820 0.105847757841
+CG3C31 CG25C1 1 0.355468588538 0.109105371453
+CG3C31 CG25C2 1 0.355468588538 0.109105371453
+CG3C31 CG251O 1 0.355468588538 0.109105371453
+CG3C31 CG252O 1 0.355468588538 0.109105371453
+CG3C31 CG2N1 1 0.347450500075 0.138767581228
+CG3C31 CG2N2 1 0.347450500075 0.138767581228
+CG3C31 CG2O1 1 0.347450500075 0.138767581228
+CG3C31 CG2O2 1 0.320723538531 0.130979917850
+CG3C31 CG2O3 1 0.347450500075 0.110698234855
+CG3C31 CG2O4 1 0.329632525712 0.102486650838
+CG3C31 CG2O5 1 0.347450500075 0.125520000000
+CG3C31 CG2O6 1 0.347450500075 0.110698234855
+CG3C31 CG2O7 1 0.308518226092 0.100764063435
+CG3C31 CG2R51 1 0.356359487256 0.093557084179
+CG3C31 CG2R52 1 0.365268474438 0.059170695450
+CG3C31 CG2R53 1 0.365268474438 0.059170695450
+CG3C31 CG2R57 1 0.356359487256 0.093557084179
+CG3C31 CG2R61 1 0.346773417049 0.110698234855
+CG3C31 CG2R62 1 0.338541512893 0.125520000000
+CG3C31 CG2R63 1 0.338541512893 0.132309697301
+CG3C31 CG2R64 1 0.356359487256 0.083680000000
+CG3C31 CG2R66 1 0.338541512893 0.110698234855
+CG3C31 CG2R67 1 0.346773417049 0.110698234855
+CG3C31 CG2RC0 1 0.334977918021 0.131646486622
+CG3C31 CG2R71 1 0.346987232741 0.108300154755
+CG3C31 CG2RC7 1 0.334977918021 0.131646486622
+CG3C31 CG301 1 0.338541512893 0.041840000000
+CG3C31 CG302 1 0.374177461619 0.059170695450
+CG3C31 CG311 1 0.338541512893 0.041840000000
+CG3C31 CG312 1 0.351904993665 0.085746484010
+CG3C31 CG314 1 0.338541512893 0.041840000000
+CG3C31 CG321 1 0.338541512893 0.041840000000
+CG3C31 CG322 1 0.338541512893 0.102486650838
+CG3C31 CG323 1 0.365268474438 0.138767581228
+CG3C31 CG324 1 0.338541512893 0.041840000000
+CG3C31 CG331 1 0.338541512893 0.041840000000
+CG3C31 CG334 1 0.338541512893 0.041840000000
+CG3C31 CG3C50 1 0.338541512893 0.041840000000
+CG3C31 CG3C51 1 0.338541512893 0.041840000000
+CG3C31 CG3C52 1 0.338541512893 0.041840000000
+CG3C31 CG3C53 1 0.338541512893 0.041840000000
+CG3C31 CG3C54 1 0.338541512893 0.041840000000
+CG3C31 CG3C31 1 0.338541512893 0.041840000000
+CG3C31 CG3C41 1 0.338541512893 0.041840000000
+CG3C31 CG3RC1 1 0.338541512893 0.041840000000
+CG3C31 CG3AM0 1 0.344777803920 0.110698234855
+CG3C31 CG3AM1 1 0.345668702638 0.116852760686
+CG3C31 CG3AM2 1 0.346559601357 0.118341390899
+CG3C31 NG1T1 1 0.328741626994 0.177512086349
+CG3C31 NG2D1 1 0.334087019303 0.187114168357
+CG3C31 NG2S0 1 0.334087019303 0.004184000000
+CG3C31 NG2S1 1 0.307360057758 0.187114168357
+CG3C31 NG2S2 1 0.334087019303 0.187114168357
+CG3C31 NG2S3 1 0.334087019303 0.187114168357
+CG3C31 NG2O1 1 0.334087019303 0.187114168357
+CG3C31 NG2P1 1 0.334087019303 0.187114168357
+CG3C31 NG2R43 1 0.334087019303 0.187114168357
+CG3C31 NG2R50 1 0.334087019303 0.187114168357
+CG3C31 NG2R51 1 0.334087019303 0.187114168357
+CG3C31 NG2R52 1 0.334087019303 0.187114168357
+CG3C31 NG2R53 1 0.334087019303 0.187114168357
+CG3C31 NG2R57 1 0.334087019303 0.187114168357
+CG3C31 NG2R60 1 0.337650614175 0.102486650838
+CG3C31 NG2R61 1 0.334087019303 0.187114168357
+CG3C31 NG2R62 1 0.352795892384 0.093557084179
+CG3C31 NG2R67 1 0.334087019303 0.187114168357
+CG3C31 NG2RC0 1 0.334087019303 0.187114168357
+CG3C31 NG301 1 0.347450500075 0.078275472531
+CG3C31 NG311 1 0.347450500075 0.088756043175
+CG3C31 NG321 1 0.346559601357 0.102486650838
+CG3C31 NG331 1 0.345668702638 0.110698234855
+CG3C31 NG3C51 1 0.334087019303 0.187114168357
+CG3C31 NG3N1 1 0.351904993665 0.102486650838
+CG3C31 NG3P0 1 0.334087019303 0.187114168357
+CG3C31 NG3P1 1 0.334087019303 0.187114168357
+CG3C31 NG3P2 1 0.334087019303 0.187114168357
+CG3C31 NG3P3 1 0.334087019303 0.187114168357
+CG3C31 OG2D1 1 0.293996576986 0.144938011577
+CG3C31 OG2D2 1 0.320723538531 0.144938011577
+CG3C31 OG2D3 1 0.293996576986 0.144938011577
+CG3C31 OG2D4 1 0.320723538531 0.144938011577
+CG3C31 OG2D5 1 0.320010819556 0.169954883425
+CG3C31 OG2N1 1 0.320723538531 0.144938011577
+CG3C31 OG2P1 1 0.320723538531 0.144938011577
+CG3C31 OG2R50 1 0.320723538531 0.144938011577
+CG3C31 OG3R60 1 0.316269044940 0.132309697301
+CG3C31 OG301 1 0.316269044940 0.132309697301
+CG3C31 OG302 1 0.316269044940 0.132309697301
+CG3C31 OG303 1 0.316269044940 0.132309697301
+CG3C31 OG304 1 0.316269044940 0.132309697301
+CG3C31 OG311 1 0.326514380198 0.183381431383
+CG3C31 OG312 1 0.325178032121 0.144938011577
+CG3C31 OG3C31 1 0.316269044940 0.132309697301
+CG3C31 OG3C51 1 0.316269044940 0.132309697301
+CG3C31 OG3C61 1 0.316269044940 0.132309697301
+CG3C31 SG2D1 1 0.351904993665 0.314496560236
+CG3C31 SG2R50 1 0.347450500075 0.280671252536
+CG3C31 SG311 1 0.347450500075 0.280671252536
+CG3C31 SG301 1 0.345223253279 0.257919081884
+CG3C31 SG302 1 0.365268474438 0.286840588481
+CG3C31 SG3O1 1 0.356359487256 0.286840588481
+CG3C31 SG3O2 1 0.347450500075 0.247528778125
+CG3C31 SG3O3 1 0.347450500075 0.247528778125
+CG3C31 FGA1 1 0.314487247504 0.153729976257
+CG3C31 FGA2 1 0.314487247504 0.135577095411
+CG3C31 FGA3 1 0.311814551349 0.130309939452
+CG3C31 FGP1 1 0.311814551349 0.130309939452
+CG3C31 FGR1 1 0.320723538531 0.144938011577
+CG3C31 CLGA1 1 0.339432411611 0.245040988571
+CG3C31 CLGA3 1 0.339432411611 0.232955260941
+CG3C31 CLGR1 1 0.341214209048 0.236682781799
+CG3C31 BRGA1 1 0.344777803920 0.289876023155
+CG3C31 BRGA2 1 0.351904993665 0.304599797767
+CG3C31 BRGA3 1 0.347450500075 0.307459952514
+CG3C31 BRGR1 1 0.353686791102 0.271154190821
+CG3C31 IGR1 1 0.364377575719 0.310293744700
+CG3C31 PG0 1 0.360813980847 0.320014464673
+CG3C31 PG1 1 0.360813980847 0.320014464673
+CG3C31 PG2 1 0.360813980847 0.320014464673
+CG3C31 ALG1 1 0.347450500075 0.337324864189
+CG3C31 CC301 1 0.338541512893 0.041840000000
+CG3C31 CC3062 1 0.338541512893 0.041840000000
+CG3C31 CC311 1 0.338541512893 0.041840000000
+CG3C31 CC3161 1 0.338541512893 0.041840000000
+CG3C31 CC3162 1 0.338541512893 0.041840000000
+CG3C31 CC3163 1 0.338541512893 0.041840000000
+CG3C31 CC321 1 0.338541512893 0.041840000000
+CG3C31 CC3261 1 0.338541512893 0.041840000000
+CG3C31 CC3263 1 0.338541512893 0.041840000000
+CG3C31 CC331 1 0.338541512893 0.041840000000
+CG3C31 CC2O1 1 0.347450500075 0.138767581228
+CG3C31 CC2O2 1 0.347450500075 0.110698234855
+CG3C31 CC2O3 1 0.347450500075 0.125520000000
+CG3C31 CC2O4 1 0.329632525712 0.102486650838
+CG3C31 OC2D1 1 0.293996576986 0.144938011577
+CG3C31 OC2D2 1 0.320723538531 0.144938011577
+CG3C31 OC2D3 1 0.293996576986 0.144938011577
+CG3C31 OC2D4 1 0.293996576986 0.144938011577
+CG3C31 OC3C61 1 0.316269044940 0.132309697301
+CG3C31 OC311 1 0.326514380198 0.183381431383
+CG3C31 NC2D1 1 0.307360057758 0.187114168357
+CG3C31 HCP1 1 0.189271432669 0.089736802707
+CG3C31 HCA1 1 0.288651184677 0.088756043175
+CG3C31 HCA2 1 0.288651184677 0.078275472531
+CG3C31 HCA3 1 0.288651184677 0.064818249282
+CG3C31 CC312 1 0.338541512893 0.041840000000
+CG3C31 CC322 1 0.338541512893 0.041840000000
+CG3C31 HCR1 1 0.240542653898 0.089736802707
+CG3C31 HCA3M 1 0.288651184677 0.064818249282
+CG3C31 CC321C 1 0.338541512893 0.041840000000
+CG3C31 CC321D 1 0.338541512893 0.041840000000
+CG3C31 CC311C 1 0.338541512893 0.041840000000
+CG3C31 CC311D 1 0.338541512893 0.041840000000
+CG3C31 OC301 1 0.316269044940 0.132309697301
+CG3C31 OC302 1 0.316269044940 0.132309697301
+CG3C31 HCP1M 1 0.189271432669 0.089736802707
+CG3C31 OC311M 1 0.326514380198 0.183381431383
+CG3C31 OC3C5M 1 0.316269044940 0.132309697301
+CG3C31 CC322C 1 0.338541512893 0.041840000000
+CG3C31 HCA2C2 1 0.285087589805 0.078275472531
+CG3C31 CC312C 1 0.338541512893 0.041840000000
+CG3C31 HCA1C2 1 0.288651184677 0.088756043175
+CG3C31 OC3C51 1 0.316269044940 0.132309697301
+CG3C31 CC3152 1 0.338541512893 0.041840000000
+CG3C31 CC3051 1 0.338541512893 0.041840000000
+CG3C31 CC3251 1 0.338541512893 0.041840000000
+CG3C31 CC3151 1 0.338541512893 0.041840000000
+CG3C31 CC3153 1 0.338541512893 0.041840000000
+CG3C31 OC2DP 1 0.320723538531 0.144938011577
+CG3C31 OC312 1 0.326959829558 0.163176000000
+CG3C31 OC30P 1 0.326959829558 0.163176000000
+CG3C31 PC 1 0.360813980847 0.320014464673
+CG3C31 SC 1 0.356359487256 0.286840588481
+CG3C31 CC312D 1 0.338541512893 0.041840000000
+CG3C31 OC303 1 0.316269044940 0.132309697301
+CG3C31 HN1 1 0.189271432669 0.089736802707
+CG3C31 HN2 1 0.189271432669 0.089736802707
+CG3C31 HN3 1 0.267269615442 0.089736802707
+CG3C31 HN4 1 0.189271432669 0.089736802707
+CG3C31 HN5 1 0.189271432669 0.089736802707
+CG3C31 HN6 1 0.286869387241 0.062058748940
+CG3C31 HN7 1 0.286869387241 0.062058748940
+CG3C31 HN8 1 0.288651184677 0.070011711020
+CG3C31 HN9 1 0.288651184677 0.064818249282
+CG3C31 NN1 1 0.334087019303 0.187114168357
+CG3C31 NN2 1 0.334087019303 0.187114168357
+CG3C31 NN2B 1 0.334087019303 0.187114168357
+CG3C31 NN2G 1 0.334087019303 0.187114168357
+CG3C31 NN2U 1 0.334087019303 0.187114168357
+CG3C31 NN3 1 0.334087019303 0.187114168357
+CG3C31 NN3A 1 0.334087019303 0.187114168357
+CG3C31 NN3G 1 0.334087019303 0.187114168357
+CG3C31 NN4 1 0.334087019303 0.187114168357
+CG3C31 NN6 1 0.334087019303 0.187114168357
+CG3C31 ON1 1 0.320723538531 0.144938011577
+CG3C31 ON1C 1 0.320723538531 0.144938011577
+CG3C31 ON2 1 0.326959829558 0.163176000000
+CG3C31 ON3 1 0.320723538531 0.144938011577
+CG3C31 ON4 1 0.326959829558 0.163176000000
+CG3C31 ON5 1 0.326959829558 0.163176000000
+CG3C31 ON6 1 0.326959829558 0.163176000000
+CG3C31 ON6B 1 0.326959829558 0.163176000000
+CG3C31 CN1 1 0.338541512893 0.132309697301
+CG3C31 CN1T 1 0.338541512893 0.132309697301
+CG3C31 CN2 1 0.338541512893 0.132309697301
+CG3C31 CN3 1 0.338541512893 0.125520000000
+CG3C31 CN3T 1 0.338541512893 0.125520000000
+CG3C31 CN4 1 0.338541512893 0.114583559030
+CG3C31 CN5 1 0.338541512893 0.114583559030
+CG3C31 CN5G 1 0.338541512893 0.114583559030
+CG3C31 CN7 1 0.338541512893 0.041840000000
+CG3C31 CN7B 1 0.338541512893 0.041840000000
+CG3C31 CN8 1 0.338541512893 0.041840000000
+CG3C31 CN8B 1 0.338541512893 0.041840000000
+CG3C31 CN9 1 0.338541512893 0.041840000000
+CG3C31 P 1 0.360813980847 0.320014464673
+CG3C31 P2 1 0.360813980847 0.320014464673
+CG3C31 HOL 1 0.189271432669 0.089736802707
+CG3C31 HAL1 1 0.286869387241 0.062058748940
+CG3C31 HAL2 1 0.288651184677 0.070011711020
+CG3C31 HAL3 1 0.288651184677 0.064818249282
+CG3C31 HBL 1 0.286869387241 0.062058748940
+CG3C31 HCL 1 0.189271432669 0.089736802707
+CG3C31 HL 1 0.231633666716 0.089736802707
+CG3C31 HEL1 1 0.280633096214 0.073666921749
+CG3C31 HEL2 1 0.281523994932 0.067464972838
+CG3C31 CL 1 0.347450500075 0.110698234855
+CG3C31 CCL 1 0.347450500075 0.110698234855
+CG3C31 CTL1 1 0.338541512893 0.041840000000
+CG3C31 CTL2 1 0.338541512893 0.041840000000
+CG3C31 CTL3 1 0.338541512893 0.041840000000
+CG3C31 CTL5 1 0.338541512893 0.041840000000
+CG3C31 CEL1 1 0.355468588538 0.109105371453
+CG3C31 CEL2 1 0.354577689820 0.105847757841
+CG3C31 CRL1 1 0.338541512893 0.041840000000
+CG3C31 CRL2 1 0.338541512893 0.041840000000
+CG3C31 OBL 1 0.293996576986 0.144938011577
+CG3C31 OCL 1 0.320723538531 0.144938011577
+CG3C31 O2L 1 0.320723538531 0.144938011577
+CG3C31 OHL 1 0.326959829558 0.163176000000
+CG3C31 OSL 1 0.316269044940 0.132309697301
+CG3C31 OSLP 1 0.316269044940 0.132309697301
+CG3C31 NH3L 1 0.334087019303 0.187114168357
+CG3C31 NTL 1 0.334087019303 0.187114168357
+CG3C31 SL 1 0.356359487256 0.286840588481
+CG3C31 PL 1 0.360813980847 0.320014464673
+CG3C31 HCA1A 1 0.288651184677 0.088756043175
+CG3C31 HCA2A 1 0.288651184677 0.078275472531
+CG3C31 HCA3A 1 0.288651184677 0.064818249282
+CG3C31 CC30A 1 0.338541512893 0.041840000000
+CG3C31 CC31A 1 0.338541512893 0.041840000000
+CG3C31 CC32A 1 0.338541512893 0.041840000000
+CG3C31 CC33A 1 0.338541512893 0.041840000000
+CG3C31 CC326A 1 0.338541512893 0.041840000000
+CG3C31 HCA25A 1 0.285087589805 0.078275472531
+CG3C31 CC325A 1 0.338541512893 0.041840000000
+CG3C31 CC325B 1 0.338541512893 0.041840000000
+CG3C31 OC305A 1 0.316269044940 0.132309697301
+CG3C31 OC30A 1 0.316269044940 0.132309697301
+CG3C31 CPA 1 0.329632525712 0.125520000000
+CG3C31 CPB 1 0.329632525712 0.125520000000
+CG3C31 CPM 1 0.329632525712 0.125520000000
+CG3C31 CM 1 0.356359487256 0.138767581228
+CG3C31 CST 1 0.308518226092 0.100764063435
+CG3C31 NPH 1 0.334087019303 0.187114168357
+CG3C31 OM 1 0.320723538531 0.144938011577
+CG3C31 OST 1 0.320010819556 0.169954883425
+CG3C31 FE 1 0.227179173126 0.000000000000
+CG3C31 ON2B 1 0.326959829558 0.163176000000
+CG3C31 SP 1 0.365268474438 0.280671252536
+CG3C41 C 1 0.347450500075 0.138767581228
+CG3C41 CA 1 0.346773417049 0.110698234855
+CG3C41 CC 1 0.347450500075 0.110698234855
+CG3C41 CD 1 0.347450500075 0.110698234855
+CG3C41 CE1 1 0.355468588538 0.109105371453
+CG3C41 CE2 1 0.354577689820 0.105847757841
+CG3C41 CP1 1 0.338541512893 0.041840000000
+CG3C41 CP2 1 0.338541512893 0.041840000000
+CG3C41 CP3 1 0.338541512893 0.041840000000
+CG3C41 CPH1 1 0.329632525712 0.093557084179
+CG3C41 CPH2 1 0.329632525712 0.093557084179
+CG3C41 CS 1 0.365268474438 0.138767581228
+CG3C41 CPT 1 0.334977918021 0.131646486622
+CG3C41 CY 1 0.346559601357 0.113045454929
+CG3C41 CAI 1 0.346559601357 0.113045454929
+CG3C41 CT 1 0.338541512893 0.041840000000
+CG3C41 CT1 1 0.338541512893 0.041840000000
+CG3C41 CT2 1 0.338541512893 0.041840000000
+CG3C41 CT2A 1 0.338541512893 0.041840000000
+CG3C41 CT3 1 0.338541512893 0.041840000000
+CG3C41 H 1 0.189271432669 0.089736802707
+CG3C41 HA 1 0.286869387241 0.062058748940
+CG3C41 HB1 1 0.286869387241 0.062058748940
+CG3C41 HB2 1 0.288651184677 0.070011711020
+CG3C41 HE1 1 0.280633096214 0.073666921749
+CG3C41 HE2 1 0.281523994932 0.067464972838
+CG3C41 HC 1 0.189271432669 0.089736802707
+CG3C41 HP 1 0.290272620344 0.072469005789
+CG3C41 HR1 1 0.249451641079 0.089736802707
+CG3C41 HR2 1 0.231633666716 0.089736802707
+CG3C41 HR3 1 0.300054688270 0.036952087465
+CG3C41 HS 1 0.209361198763 0.132309697301
+CG3C41 HA1 1 0.288651184677 0.088756043175
+CG3C41 HA2 1 0.288651184677 0.077149148019
+CG3C41 HA3 1 0.288651184677 0.064818249282
+CG3C41 N 1 0.334087019303 0.004184000000
+CG3C41 NC2 1 0.334087019303 0.187114168357
+CG3C41 NH1 1 0.307360057758 0.187114168357
+CG3C41 NH2 1 0.334087019303 0.187114168357
+CG3C41 NH3 1 0.334087019303 0.187114168357
+CG3C41 NP 1 0.334087019303 0.187114168357
+CG3C41 NR1 1 0.334087019303 0.187114168357
+CG3C41 NR2 1 0.334087019303 0.187114168357
+CG3C41 NR3 1 0.334087019303 0.187114168357
+CG3C41 NY 1 0.334087019303 0.187114168357
+CG3C41 O 1 0.293996576986 0.144938011577
+CG3C41 OB 1 0.293996576986 0.144938011577
+CG3C41 OC 1 0.320723538531 0.144938011577
+CG3C41 OH1 1 0.326959829558 0.163176000000
+CG3C41 OS 1 0.326959829558 0.163176000000
+CG3C41 S 1 0.347450500075 0.280671252536
+CG3C41 SM 1 0.345223253279 0.257919081884
+CG3C41 SS 1 0.365268474438 0.286840588481
+CG3C41 HT 1 0.189271432669 0.089736802707
+CG3C41 OT 1 0.326799467788 0.163176000000
+CG3C41 OX 1 0.320723538531 0.144938011577
+CG3C41 HX 1 0.189271432669 0.089736802707
+CG3C41 LIT 1 0.284864865125 0.020196198771
+CG3C41 SOD 1 0.294954293108 0.090610410351
+CG3C41 MG 1 0.274842254546 0.051243325419
+CG3C41 POT 1 0.326403017859 0.123410269913
+CG3C41 CAL 1 0.291056611216 0.144938011577
+CG3C41 RUB 1 0.338541512893 0.162045623205
+CG3C41 CES 1 0.356359487256 0.182376331798
+CG3C41 BAR 1 0.337650614175 0.162045623205
+CG3C41 ZN 1 0.266378716724 0.209200000000
+CG3C41 CAD 1 0.290165712498 0.144938011577
+CG3C41 CLA 1 0.371504765465 0.162045623205
+CG3C41 HGA1 1 0.288651184677 0.088756043175
+CG3C41 HGA2 1 0.288651184677 0.078275472531
+CG3C41 HGA3 1 0.288651184677 0.064818249282
+CG3C41 HGA4 1 0.280633096214 0.073666921749
+CG3C41 HGA5 1 0.281523994932 0.067464972838
+CG3C41 HGA6 1 0.286869387241 0.070011711020
+CG3C41 HGA7 1 0.285087589805 0.072469005789
+CG3C41 HGAAM0 1 0.283305792369 0.070011711020
+CG3C41 HGAAM1 1 0.283305792369 0.070011711020
+CG3C41 HGAAM2 1 0.281523994932 0.083680000000
+CG3C41 HGP1 1 0.189271432669 0.089736802707
+CG3C41 HGP2 1 0.189271432669 0.089736802707
+CG3C41 HGP3 1 0.209361198763 0.132309697301
+CG3C41 HGP4 1 0.189271432669 0.089736802707
+CG3C41 HGP5 1 0.231633666716 0.089736802707
+CG3C41 HGPAM1 1 0.247224394284 0.039692909190
+CG3C41 HGPAM2 1 0.247224394284 0.041840000000
+CG3C41 HGPAM3 1 0.246778944925 0.045833423612
+CG3C41 HGR51 1 0.290272620344 0.072469005789
+CG3C41 HGR52 1 0.249451641079 0.089736802707
+CG3C41 HGR53 1 0.231633666716 0.089736802707
+CG3C41 HGR61 1 0.290272620344 0.072469005789
+CG3C41 HGR62 1 0.267269615442 0.089736802707
+CG3C41 HGR63 1 0.249451641079 0.089736802707
+CG3C41 HGR71 1 0.290272620344 0.072469005789
+CG3C41 CG1T1 1 0.333196120584 0.170981810495
+CG3C41 CG1T2 1 0.346782326036 0.134409982486
+CG3C41 CG1N1 1 0.335868816739 0.177512086349
+CG3C41 CG2D1 1 0.355468588538 0.109105371453
+CG3C41 CG2D2 1 0.354577689820 0.105847757841
+CG3C41 CG2D1O 1 0.355468588538 0.109105371453
+CG3C41 CG2D2O 1 0.355468588538 0.109105371453
+CG3C41 CG2DC1 1 0.355468588538 0.109105371453
+CG3C41 CG2DC2 1 0.355468588538 0.109105371453
+CG3C41 CG2DC3 1 0.354577689820 0.105847757841
+CG3C41 CG25C1 1 0.355468588538 0.109105371453
+CG3C41 CG25C2 1 0.355468588538 0.109105371453
+CG3C41 CG251O 1 0.355468588538 0.109105371453
+CG3C41 CG252O 1 0.355468588538 0.109105371453
+CG3C41 CG2N1 1 0.347450500075 0.138767581228
+CG3C41 CG2N2 1 0.347450500075 0.138767581228
+CG3C41 CG2O1 1 0.347450500075 0.138767581228
+CG3C41 CG2O2 1 0.320723538531 0.130979917850
+CG3C41 CG2O3 1 0.347450500075 0.110698234855
+CG3C41 CG2O4 1 0.329632525712 0.102486650838
+CG3C41 CG2O5 1 0.347450500075 0.125520000000
+CG3C41 CG2O6 1 0.347450500075 0.110698234855
+CG3C41 CG2O7 1 0.308518226092 0.100764063435
+CG3C41 CG2R51 1 0.356359487256 0.093557084179
+CG3C41 CG2R52 1 0.365268474438 0.059170695450
+CG3C41 CG2R53 1 0.365268474438 0.059170695450
+CG3C41 CG2R57 1 0.356359487256 0.093557084179
+CG3C41 CG2R61 1 0.346773417049 0.110698234855
+CG3C41 CG2R62 1 0.338541512893 0.125520000000
+CG3C41 CG2R63 1 0.338541512893 0.132309697301
+CG3C41 CG2R64 1 0.356359487256 0.083680000000
+CG3C41 CG2R66 1 0.338541512893 0.110698234855
+CG3C41 CG2R67 1 0.346773417049 0.110698234855
+CG3C41 CG2RC0 1 0.334977918021 0.131646486622
+CG3C41 CG2R71 1 0.346987232741 0.108300154755
+CG3C41 CG2RC7 1 0.334977918021 0.131646486622
+CG3C41 CG301 1 0.338541512893 0.041840000000
+CG3C41 CG302 1 0.374177461619 0.059170695450
+CG3C41 CG311 1 0.338541512893 0.041840000000
+CG3C41 CG312 1 0.351904993665 0.085746484010
+CG3C41 CG314 1 0.338541512893 0.041840000000
+CG3C41 CG321 1 0.338541512893 0.041840000000
+CG3C41 CG322 1 0.338541512893 0.102486650838
+CG3C41 CG323 1 0.365268474438 0.138767581228
+CG3C41 CG324 1 0.338541512893 0.041840000000
+CG3C41 CG331 1 0.338541512893 0.041840000000
+CG3C41 CG334 1 0.338541512893 0.041840000000
+CG3C41 CG3C50 1 0.338541512893 0.041840000000
+CG3C41 CG3C51 1 0.338541512893 0.041840000000
+CG3C41 CG3C52 1 0.338541512893 0.041840000000
+CG3C41 CG3C53 1 0.338541512893 0.041840000000
+CG3C41 CG3C54 1 0.338541512893 0.041840000000
+CG3C41 CG3C31 1 0.338541512893 0.041840000000
+CG3C41 CG3C41 1 0.338541512893 0.041840000000
+CG3C41 CG3RC1 1 0.338541512893 0.041840000000
+CG3C41 CG3AM0 1 0.344777803920 0.110698234855
+CG3C41 CG3AM1 1 0.345668702638 0.116852760686
+CG3C41 CG3AM2 1 0.346559601357 0.118341390899
+CG3C41 NG1T1 1 0.328741626994 0.177512086349
+CG3C41 NG2D1 1 0.334087019303 0.187114168357
+CG3C41 NG2S0 1 0.334087019303 0.004184000000
+CG3C41 NG2S1 1 0.307360057758 0.187114168357
+CG3C41 NG2S2 1 0.334087019303 0.187114168357
+CG3C41 NG2S3 1 0.334087019303 0.187114168357
+CG3C41 NG2O1 1 0.334087019303 0.187114168357
+CG3C41 NG2P1 1 0.334087019303 0.187114168357
+CG3C41 NG2R43 1 0.334087019303 0.187114168357
+CG3C41 NG2R50 1 0.334087019303 0.187114168357
+CG3C41 NG2R51 1 0.334087019303 0.187114168357
+CG3C41 NG2R52 1 0.334087019303 0.187114168357
+CG3C41 NG2R53 1 0.334087019303 0.187114168357
+CG3C41 NG2R57 1 0.334087019303 0.187114168357
+CG3C41 NG2R60 1 0.337650614175 0.102486650838
+CG3C41 NG2R61 1 0.334087019303 0.187114168357
+CG3C41 NG2R62 1 0.352795892384 0.093557084179
+CG3C41 NG2R67 1 0.334087019303 0.187114168357
+CG3C41 NG2RC0 1 0.334087019303 0.187114168357
+CG3C41 NG301 1 0.347450500075 0.078275472531
+CG3C41 NG311 1 0.347450500075 0.088756043175
+CG3C41 NG321 1 0.346559601357 0.102486650838
+CG3C41 NG331 1 0.345668702638 0.110698234855
+CG3C41 NG3C51 1 0.334087019303 0.187114168357
+CG3C41 NG3N1 1 0.351904993665 0.102486650838
+CG3C41 NG3P0 1 0.334087019303 0.187114168357
+CG3C41 NG3P1 1 0.334087019303 0.187114168357
+CG3C41 NG3P2 1 0.334087019303 0.187114168357
+CG3C41 NG3P3 1 0.334087019303 0.187114168357
+CG3C41 OG2D1 1 0.293996576986 0.144938011577
+CG3C41 OG2D2 1 0.320723538531 0.144938011577
+CG3C41 OG2D3 1 0.293996576986 0.144938011577
+CG3C41 OG2D4 1 0.320723538531 0.144938011577
+CG3C41 OG2D5 1 0.320010819556 0.169954883425
+CG3C41 OG2N1 1 0.320723538531 0.144938011577
+CG3C41 OG2P1 1 0.320723538531 0.144938011577
+CG3C41 OG2R50 1 0.320723538531 0.144938011577
+CG3C41 OG3R60 1 0.316269044940 0.132309697301
+CG3C41 OG301 1 0.316269044940 0.132309697301
+CG3C41 OG302 1 0.316269044940 0.132309697301
+CG3C41 OG303 1 0.316269044940 0.132309697301
+CG3C41 OG304 1 0.316269044940 0.132309697301
+CG3C41 OG311 1 0.326514380198 0.183381431383
+CG3C41 OG312 1 0.325178032121 0.144938011577
+CG3C41 OG3C31 1 0.316269044940 0.132309697301
+CG3C41 OG3C51 1 0.316269044940 0.132309697301
+CG3C41 OG3C61 1 0.316269044940 0.132309697301
+CG3C41 SG2D1 1 0.351904993665 0.314496560236
+CG3C41 SG2R50 1 0.347450500075 0.280671252536
+CG3C41 SG311 1 0.347450500075 0.280671252536
+CG3C41 SG301 1 0.345223253279 0.257919081884
+CG3C41 SG302 1 0.365268474438 0.286840588481
+CG3C41 SG3O1 1 0.356359487256 0.286840588481
+CG3C41 SG3O2 1 0.347450500075 0.247528778125
+CG3C41 SG3O3 1 0.347450500075 0.247528778125
+CG3C41 FGA1 1 0.314487247504 0.153729976257
+CG3C41 FGA2 1 0.314487247504 0.135577095411
+CG3C41 FGA3 1 0.311814551349 0.130309939452
+CG3C41 FGP1 1 0.311814551349 0.130309939452
+CG3C41 FGR1 1 0.320723538531 0.144938011577
+CG3C41 CLGA1 1 0.339432411611 0.245040988571
+CG3C41 CLGA3 1 0.339432411611 0.232955260941
+CG3C41 CLGR1 1 0.341214209048 0.236682781799
+CG3C41 BRGA1 1 0.344777803920 0.289876023155
+CG3C41 BRGA2 1 0.351904993665 0.304599797767
+CG3C41 BRGA3 1 0.347450500075 0.307459952514
+CG3C41 BRGR1 1 0.353686791102 0.271154190821
+CG3C41 IGR1 1 0.364377575719 0.310293744700
+CG3C41 PG0 1 0.360813980847 0.320014464673
+CG3C41 PG1 1 0.360813980847 0.320014464673
+CG3C41 PG2 1 0.360813980847 0.320014464673
+CG3C41 ALG1 1 0.347450500075 0.337324864189
+CG3C41 CC301 1 0.338541512893 0.041840000000
+CG3C41 CC3062 1 0.338541512893 0.041840000000
+CG3C41 CC311 1 0.338541512893 0.041840000000
+CG3C41 CC3161 1 0.338541512893 0.041840000000
+CG3C41 CC3162 1 0.338541512893 0.041840000000
+CG3C41 CC3163 1 0.338541512893 0.041840000000
+CG3C41 CC321 1 0.338541512893 0.041840000000
+CG3C41 CC3261 1 0.338541512893 0.041840000000
+CG3C41 CC3263 1 0.338541512893 0.041840000000
+CG3C41 CC331 1 0.338541512893 0.041840000000
+CG3C41 CC2O1 1 0.347450500075 0.138767581228
+CG3C41 CC2O2 1 0.347450500075 0.110698234855
+CG3C41 CC2O3 1 0.347450500075 0.125520000000
+CG3C41 CC2O4 1 0.329632525712 0.102486650838
+CG3C41 OC2D1 1 0.293996576986 0.144938011577
+CG3C41 OC2D2 1 0.320723538531 0.144938011577
+CG3C41 OC2D3 1 0.293996576986 0.144938011577
+CG3C41 OC2D4 1 0.293996576986 0.144938011577
+CG3C41 OC3C61 1 0.316269044940 0.132309697301
+CG3C41 OC311 1 0.326514380198 0.183381431383
+CG3C41 NC2D1 1 0.307360057758 0.187114168357
+CG3C41 HCP1 1 0.189271432669 0.089736802707
+CG3C41 HCA1 1 0.288651184677 0.088756043175
+CG3C41 HCA2 1 0.288651184677 0.078275472531
+CG3C41 HCA3 1 0.288651184677 0.064818249282
+CG3C41 CC312 1 0.338541512893 0.041840000000
+CG3C41 CC322 1 0.338541512893 0.041840000000
+CG3C41 HCR1 1 0.240542653898 0.089736802707
+CG3C41 HCA3M 1 0.288651184677 0.064818249282
+CG3C41 CC321C 1 0.338541512893 0.041840000000
+CG3C41 CC321D 1 0.338541512893 0.041840000000
+CG3C41 CC311C 1 0.338541512893 0.041840000000
+CG3C41 CC311D 1 0.338541512893 0.041840000000
+CG3C41 OC301 1 0.316269044940 0.132309697301
+CG3C41 OC302 1 0.316269044940 0.132309697301
+CG3C41 HCP1M 1 0.189271432669 0.089736802707
+CG3C41 OC311M 1 0.326514380198 0.183381431383
+CG3C41 OC3C5M 1 0.316269044940 0.132309697301
+CG3C41 CC322C 1 0.338541512893 0.041840000000
+CG3C41 HCA2C2 1 0.285087589805 0.078275472531
+CG3C41 CC312C 1 0.338541512893 0.041840000000
+CG3C41 HCA1C2 1 0.288651184677 0.088756043175
+CG3C41 OC3C51 1 0.316269044940 0.132309697301
+CG3C41 CC3152 1 0.338541512893 0.041840000000
+CG3C41 CC3051 1 0.338541512893 0.041840000000
+CG3C41 CC3251 1 0.338541512893 0.041840000000
+CG3C41 CC3151 1 0.338541512893 0.041840000000
+CG3C41 CC3153 1 0.338541512893 0.041840000000
+CG3C41 OC2DP 1 0.320723538531 0.144938011577
+CG3C41 OC312 1 0.326959829558 0.163176000000
+CG3C41 OC30P 1 0.326959829558 0.163176000000
+CG3C41 PC 1 0.360813980847 0.320014464673
+CG3C41 SC 1 0.356359487256 0.286840588481
+CG3C41 CC312D 1 0.338541512893 0.041840000000
+CG3C41 OC303 1 0.316269044940 0.132309697301
+CG3C41 HN1 1 0.189271432669 0.089736802707
+CG3C41 HN2 1 0.189271432669 0.089736802707
+CG3C41 HN3 1 0.267269615442 0.089736802707
+CG3C41 HN4 1 0.189271432669 0.089736802707
+CG3C41 HN5 1 0.189271432669 0.089736802707
+CG3C41 HN6 1 0.286869387241 0.062058748940
+CG3C41 HN7 1 0.286869387241 0.062058748940
+CG3C41 HN8 1 0.288651184677 0.070011711020
+CG3C41 HN9 1 0.288651184677 0.064818249282
+CG3C41 NN1 1 0.334087019303 0.187114168357
+CG3C41 NN2 1 0.334087019303 0.187114168357
+CG3C41 NN2B 1 0.334087019303 0.187114168357
+CG3C41 NN2G 1 0.334087019303 0.187114168357
+CG3C41 NN2U 1 0.334087019303 0.187114168357
+CG3C41 NN3 1 0.334087019303 0.187114168357
+CG3C41 NN3A 1 0.334087019303 0.187114168357
+CG3C41 NN3G 1 0.334087019303 0.187114168357
+CG3C41 NN4 1 0.334087019303 0.187114168357
+CG3C41 NN6 1 0.334087019303 0.187114168357
+CG3C41 ON1 1 0.320723538531 0.144938011577
+CG3C41 ON1C 1 0.320723538531 0.144938011577
+CG3C41 ON2 1 0.326959829558 0.163176000000
+CG3C41 ON3 1 0.320723538531 0.144938011577
+CG3C41 ON4 1 0.326959829558 0.163176000000
+CG3C41 ON5 1 0.326959829558 0.163176000000
+CG3C41 ON6 1 0.326959829558 0.163176000000
+CG3C41 ON6B 1 0.326959829558 0.163176000000
+CG3C41 CN1 1 0.338541512893 0.132309697301
+CG3C41 CN1T 1 0.338541512893 0.132309697301
+CG3C41 CN2 1 0.338541512893 0.132309697301
+CG3C41 CN3 1 0.338541512893 0.125520000000
+CG3C41 CN3T 1 0.338541512893 0.125520000000
+CG3C41 CN4 1 0.338541512893 0.114583559030
+CG3C41 CN5 1 0.338541512893 0.114583559030
+CG3C41 CN5G 1 0.338541512893 0.114583559030
+CG3C41 CN7 1 0.338541512893 0.041840000000
+CG3C41 CN7B 1 0.338541512893 0.041840000000
+CG3C41 CN8 1 0.338541512893 0.041840000000
+CG3C41 CN8B 1 0.338541512893 0.041840000000
+CG3C41 CN9 1 0.338541512893 0.041840000000
+CG3C41 P 1 0.360813980847 0.320014464673
+CG3C41 P2 1 0.360813980847 0.320014464673
+CG3C41 HOL 1 0.189271432669 0.089736802707
+CG3C41 HAL1 1 0.286869387241 0.062058748940
+CG3C41 HAL2 1 0.288651184677 0.070011711020
+CG3C41 HAL3 1 0.288651184677 0.064818249282
+CG3C41 HBL 1 0.286869387241 0.062058748940
+CG3C41 HCL 1 0.189271432669 0.089736802707
+CG3C41 HL 1 0.231633666716 0.089736802707
+CG3C41 HEL1 1 0.280633096214 0.073666921749
+CG3C41 HEL2 1 0.281523994932 0.067464972838
+CG3C41 CL 1 0.347450500075 0.110698234855
+CG3C41 CCL 1 0.347450500075 0.110698234855
+CG3C41 CTL1 1 0.338541512893 0.041840000000
+CG3C41 CTL2 1 0.338541512893 0.041840000000
+CG3C41 CTL3 1 0.338541512893 0.041840000000
+CG3C41 CTL5 1 0.338541512893 0.041840000000
+CG3C41 CEL1 1 0.355468588538 0.109105371453
+CG3C41 CEL2 1 0.354577689820 0.105847757841
+CG3C41 CRL1 1 0.338541512893 0.041840000000
+CG3C41 CRL2 1 0.338541512893 0.041840000000
+CG3C41 OBL 1 0.293996576986 0.144938011577
+CG3C41 OCL 1 0.320723538531 0.144938011577
+CG3C41 O2L 1 0.320723538531 0.144938011577
+CG3C41 OHL 1 0.326959829558 0.163176000000
+CG3C41 OSL 1 0.316269044940 0.132309697301
+CG3C41 OSLP 1 0.316269044940 0.132309697301
+CG3C41 NH3L 1 0.334087019303 0.187114168357
+CG3C41 NTL 1 0.334087019303 0.187114168357
+CG3C41 SL 1 0.356359487256 0.286840588481
+CG3C41 PL 1 0.360813980847 0.320014464673
+CG3C41 HCA1A 1 0.288651184677 0.088756043175
+CG3C41 HCA2A 1 0.288651184677 0.078275472531
+CG3C41 HCA3A 1 0.288651184677 0.064818249282
+CG3C41 CC30A 1 0.338541512893 0.041840000000
+CG3C41 CC31A 1 0.338541512893 0.041840000000
+CG3C41 CC32A 1 0.338541512893 0.041840000000
+CG3C41 CC33A 1 0.338541512893 0.041840000000
+CG3C41 CC326A 1 0.338541512893 0.041840000000
+CG3C41 HCA25A 1 0.285087589805 0.078275472531
+CG3C41 CC325A 1 0.338541512893 0.041840000000
+CG3C41 CC325B 1 0.338541512893 0.041840000000
+CG3C41 OC305A 1 0.316269044940 0.132309697301
+CG3C41 OC30A 1 0.316269044940 0.132309697301
+CG3C41 CPA 1 0.329632525712 0.125520000000
+CG3C41 CPB 1 0.329632525712 0.125520000000
+CG3C41 CPM 1 0.329632525712 0.125520000000
+CG3C41 CM 1 0.356359487256 0.138767581228
+CG3C41 CST 1 0.308518226092 0.100764063435
+CG3C41 NPH 1 0.334087019303 0.187114168357
+CG3C41 OM 1 0.320723538531 0.144938011577
+CG3C41 OST 1 0.320010819556 0.169954883425
+CG3C41 FE 1 0.227179173126 0.000000000000
+CG3C41 ON2B 1 0.326959829558 0.163176000000
+CG3C41 SP 1 0.365268474438 0.280671252536
+CG3RC1 C 1 0.347450500075 0.138767581228
+CG3RC1 CA 1 0.346773417049 0.110698234855
+CG3RC1 CC 1 0.347450500075 0.110698234855
+CG3RC1 CD 1 0.347450500075 0.110698234855
+CG3RC1 CE1 1 0.355468588538 0.109105371453
+CG3RC1 CE2 1 0.354577689820 0.105847757841
+CG3RC1 CP1 1 0.338541512893 0.041840000000
+CG3RC1 CP2 1 0.338541512893 0.041840000000
+CG3RC1 CP3 1 0.338541512893 0.041840000000
+CG3RC1 CPH1 1 0.329632525712 0.093557084179
+CG3RC1 CPH2 1 0.329632525712 0.093557084179
+CG3RC1 CS 1 0.365268474438 0.138767581228
+CG3RC1 CPT 1 0.334977918021 0.131646486622
+CG3RC1 CY 1 0.346559601357 0.113045454929
+CG3RC1 CAI 1 0.346559601357 0.113045454929
+CG3RC1 CT 1 0.338541512893 0.041840000000
+CG3RC1 CT1 1 0.338541512893 0.041840000000
+CG3RC1 CT2 1 0.338541512893 0.041840000000
+CG3RC1 CT2A 1 0.338541512893 0.041840000000
+CG3RC1 CT3 1 0.338541512893 0.041840000000
+CG3RC1 H 1 0.189271432669 0.089736802707
+CG3RC1 HA 1 0.286869387241 0.062058748940
+CG3RC1 HB1 1 0.286869387241 0.062058748940
+CG3RC1 HB2 1 0.288651184677 0.070011711020
+CG3RC1 HE1 1 0.280633096214 0.073666921749
+CG3RC1 HE2 1 0.281523994932 0.067464972838
+CG3RC1 HC 1 0.189271432669 0.089736802707
+CG3RC1 HP 1 0.290272620344 0.072469005789
+CG3RC1 HR1 1 0.249451641079 0.089736802707
+CG3RC1 HR2 1 0.231633666716 0.089736802707
+CG3RC1 HR3 1 0.300054688270 0.036952087465
+CG3RC1 HS 1 0.209361198763 0.132309697301
+CG3RC1 HA1 1 0.288651184677 0.088756043175
+CG3RC1 HA2 1 0.288651184677 0.077149148019
+CG3RC1 HA3 1 0.288651184677 0.064818249282
+CG3RC1 N 1 0.334087019303 0.004184000000
+CG3RC1 NC2 1 0.334087019303 0.187114168357
+CG3RC1 NH1 1 0.307360057758 0.187114168357
+CG3RC1 NH2 1 0.334087019303 0.187114168357
+CG3RC1 NH3 1 0.334087019303 0.187114168357
+CG3RC1 NP 1 0.334087019303 0.187114168357
+CG3RC1 NR1 1 0.334087019303 0.187114168357
+CG3RC1 NR2 1 0.334087019303 0.187114168357
+CG3RC1 NR3 1 0.334087019303 0.187114168357
+CG3RC1 NY 1 0.334087019303 0.187114168357
+CG3RC1 O 1 0.293996576986 0.144938011577
+CG3RC1 OB 1 0.293996576986 0.144938011577
+CG3RC1 OC 1 0.320723538531 0.144938011577
+CG3RC1 OH1 1 0.326959829558 0.163176000000
+CG3RC1 OS 1 0.326959829558 0.163176000000
+CG3RC1 S 1 0.347450500075 0.280671252536
+CG3RC1 SM 1 0.345223253279 0.257919081884
+CG3RC1 SS 1 0.365268474438 0.286840588481
+CG3RC1 HT 1 0.189271432669 0.089736802707
+CG3RC1 OT 1 0.326799467788 0.163176000000
+CG3RC1 OX 1 0.320723538531 0.144938011577
+CG3RC1 HX 1 0.189271432669 0.089736802707
+CG3RC1 LIT 1 0.284864865125 0.020196198771
+CG3RC1 SOD 1 0.294954293108 0.090610410351
+CG3RC1 MG 1 0.274842254546 0.051243325419
+CG3RC1 POT 1 0.326403017859 0.123410269913
+CG3RC1 CAL 1 0.291056611216 0.144938011577
+CG3RC1 RUB 1 0.338541512893 0.162045623205
+CG3RC1 CES 1 0.356359487256 0.182376331798
+CG3RC1 BAR 1 0.337650614175 0.162045623205
+CG3RC1 ZN 1 0.266378716724 0.209200000000
+CG3RC1 CAD 1 0.290165712498 0.144938011577
+CG3RC1 CLA 1 0.371504765465 0.162045623205
+CG3RC1 HGA1 1 0.288651184677 0.088756043175
+CG3RC1 HGA2 1 0.288651184677 0.078275472531
+CG3RC1 HGA3 1 0.288651184677 0.064818249282
+CG3RC1 HGA4 1 0.280633096214 0.073666921749
+CG3RC1 HGA5 1 0.281523994932 0.067464972838
+CG3RC1 HGA6 1 0.286869387241 0.070011711020
+CG3RC1 HGA7 1 0.285087589805 0.072469005789
+CG3RC1 HGAAM0 1 0.283305792369 0.070011711020
+CG3RC1 HGAAM1 1 0.283305792369 0.070011711020
+CG3RC1 HGAAM2 1 0.281523994932 0.083680000000
+CG3RC1 HGP1 1 0.189271432669 0.089736802707
+CG3RC1 HGP2 1 0.189271432669 0.089736802707
+CG3RC1 HGP3 1 0.209361198763 0.132309697301
+CG3RC1 HGP4 1 0.189271432669 0.089736802707
+CG3RC1 HGP5 1 0.231633666716 0.089736802707
+CG3RC1 HGPAM1 1 0.247224394284 0.039692909190
+CG3RC1 HGPAM2 1 0.247224394284 0.041840000000
+CG3RC1 HGPAM3 1 0.246778944925 0.045833423612
+CG3RC1 HGR51 1 0.290272620344 0.072469005789
+CG3RC1 HGR52 1 0.249451641079 0.089736802707
+CG3RC1 HGR53 1 0.231633666716 0.089736802707
+CG3RC1 HGR61 1 0.290272620344 0.072469005789
+CG3RC1 HGR62 1 0.267269615442 0.089736802707
+CG3RC1 HGR63 1 0.249451641079 0.089736802707
+CG3RC1 HGR71 1 0.290272620344 0.072469005789
+CG3RC1 CG1T1 1 0.333196120584 0.170981810495
+CG3RC1 CG1T2 1 0.346782326036 0.134409982486
+CG3RC1 CG1N1 1 0.335868816739 0.177512086349
+CG3RC1 CG2D1 1 0.355468588538 0.109105371453
+CG3RC1 CG2D2 1 0.354577689820 0.105847757841
+CG3RC1 CG2D1O 1 0.355468588538 0.109105371453
+CG3RC1 CG2D2O 1 0.355468588538 0.109105371453
+CG3RC1 CG2DC1 1 0.355468588538 0.109105371453
+CG3RC1 CG2DC2 1 0.355468588538 0.109105371453
+CG3RC1 CG2DC3 1 0.354577689820 0.105847757841
+CG3RC1 CG25C1 1 0.355468588538 0.109105371453
+CG3RC1 CG25C2 1 0.355468588538 0.109105371453
+CG3RC1 CG251O 1 0.355468588538 0.109105371453
+CG3RC1 CG252O 1 0.355468588538 0.109105371453
+CG3RC1 CG2N1 1 0.347450500075 0.138767581228
+CG3RC1 CG2N2 1 0.347450500075 0.138767581228
+CG3RC1 CG2O1 1 0.347450500075 0.138767581228
+CG3RC1 CG2O2 1 0.320723538531 0.130979917850
+CG3RC1 CG2O3 1 0.347450500075 0.110698234855
+CG3RC1 CG2O4 1 0.329632525712 0.102486650838
+CG3RC1 CG2O5 1 0.347450500075 0.125520000000
+CG3RC1 CG2O6 1 0.347450500075 0.110698234855
+CG3RC1 CG2O7 1 0.308518226092 0.100764063435
+CG3RC1 CG2R51 1 0.356359487256 0.093557084179
+CG3RC1 CG2R52 1 0.365268474438 0.059170695450
+CG3RC1 CG2R53 1 0.365268474438 0.059170695450
+CG3RC1 CG2R57 1 0.356359487256 0.093557084179
+CG3RC1 CG2R61 1 0.346773417049 0.110698234855
+CG3RC1 CG2R62 1 0.338541512893 0.125520000000
+CG3RC1 CG2R63 1 0.338541512893 0.132309697301
+CG3RC1 CG2R64 1 0.356359487256 0.083680000000
+CG3RC1 CG2R66 1 0.338541512893 0.110698234855
+CG3RC1 CG2R67 1 0.346773417049 0.110698234855
+CG3RC1 CG2RC0 1 0.334977918021 0.131646486622
+CG3RC1 CG2R71 1 0.346987232741 0.108300154755
+CG3RC1 CG2RC7 1 0.334977918021 0.131646486622
+CG3RC1 CG301 1 0.338541512893 0.041840000000
+CG3RC1 CG302 1 0.374177461619 0.059170695450
+CG3RC1 CG311 1 0.338541512893 0.041840000000
+CG3RC1 CG312 1 0.351904993665 0.085746484010
+CG3RC1 CG314 1 0.338541512893 0.041840000000
+CG3RC1 CG321 1 0.338541512893 0.041840000000
+CG3RC1 CG322 1 0.338541512893 0.102486650838
+CG3RC1 CG323 1 0.365268474438 0.138767581228
+CG3RC1 CG324 1 0.338541512893 0.041840000000
+CG3RC1 CG331 1 0.338541512893 0.041840000000
+CG3RC1 CG334 1 0.338541512893 0.041840000000
+CG3RC1 CG3C50 1 0.338541512893 0.041840000000
+CG3RC1 CG3C51 1 0.338541512893 0.041840000000
+CG3RC1 CG3C52 1 0.338541512893 0.041840000000
+CG3RC1 CG3C53 1 0.338541512893 0.041840000000
+CG3RC1 CG3C54 1 0.338541512893 0.041840000000
+CG3RC1 CG3C31 1 0.338541512893 0.041840000000
+CG3RC1 CG3C41 1 0.338541512893 0.041840000000
+CG3RC1 CG3RC1 1 0.338541512893 0.041840000000
+CG3RC1 CG3AM0 1 0.344777803920 0.110698234855
+CG3RC1 CG3AM1 1 0.345668702638 0.116852760686
+CG3RC1 CG3AM2 1 0.346559601357 0.118341390899
+CG3RC1 NG1T1 1 0.328741626994 0.177512086349
+CG3RC1 NG2D1 1 0.334087019303 0.187114168357
+CG3RC1 NG2S0 1 0.334087019303 0.004184000000
+CG3RC1 NG2S1 1 0.307360057758 0.187114168357
+CG3RC1 NG2S2 1 0.334087019303 0.187114168357
+CG3RC1 NG2S3 1 0.334087019303 0.187114168357
+CG3RC1 NG2O1 1 0.334087019303 0.187114168357
+CG3RC1 NG2P1 1 0.334087019303 0.187114168357
+CG3RC1 NG2R43 1 0.334087019303 0.187114168357
+CG3RC1 NG2R50 1 0.334087019303 0.187114168357
+CG3RC1 NG2R51 1 0.334087019303 0.187114168357
+CG3RC1 NG2R52 1 0.334087019303 0.187114168357
+CG3RC1 NG2R53 1 0.334087019303 0.187114168357
+CG3RC1 NG2R57 1 0.334087019303 0.187114168357
+CG3RC1 NG2R60 1 0.337650614175 0.102486650838
+CG3RC1 NG2R61 1 0.334087019303 0.187114168357
+CG3RC1 NG2R62 1 0.352795892384 0.093557084179
+CG3RC1 NG2R67 1 0.334087019303 0.187114168357
+CG3RC1 NG2RC0 1 0.334087019303 0.187114168357
+CG3RC1 NG301 1 0.347450500075 0.078275472531
+CG3RC1 NG311 1 0.347450500075 0.088756043175
+CG3RC1 NG321 1 0.346559601357 0.102486650838
+CG3RC1 NG331 1 0.345668702638 0.110698234855
+CG3RC1 NG3C51 1 0.334087019303 0.187114168357
+CG3RC1 NG3N1 1 0.351904993665 0.102486650838
+CG3RC1 NG3P0 1 0.334087019303 0.187114168357
+CG3RC1 NG3P1 1 0.334087019303 0.187114168357
+CG3RC1 NG3P2 1 0.334087019303 0.187114168357
+CG3RC1 NG3P3 1 0.334087019303 0.187114168357
+CG3RC1 OG2D1 1 0.293996576986 0.144938011577
+CG3RC1 OG2D2 1 0.320723538531 0.144938011577
+CG3RC1 OG2D3 1 0.293996576986 0.144938011577
+CG3RC1 OG2D4 1 0.320723538531 0.144938011577
+CG3RC1 OG2D5 1 0.320010819556 0.169954883425
+CG3RC1 OG2N1 1 0.320723538531 0.144938011577
+CG3RC1 OG2P1 1 0.320723538531 0.144938011577
+CG3RC1 OG2R50 1 0.320723538531 0.144938011577
+CG3RC1 OG3R60 1 0.316269044940 0.132309697301
+CG3RC1 OG301 1 0.316269044940 0.132309697301
+CG3RC1 OG302 1 0.316269044940 0.132309697301
+CG3RC1 OG303 1 0.316269044940 0.132309697301
+CG3RC1 OG304 1 0.316269044940 0.132309697301
+CG3RC1 OG311 1 0.326514380198 0.183381431383
+CG3RC1 OG312 1 0.325178032121 0.144938011577
+CG3RC1 OG3C31 1 0.316269044940 0.132309697301
+CG3RC1 OG3C51 1 0.316269044940 0.132309697301
+CG3RC1 OG3C61 1 0.316269044940 0.132309697301
+CG3RC1 SG2D1 1 0.351904993665 0.314496560236
+CG3RC1 SG2R50 1 0.347450500075 0.280671252536
+CG3RC1 SG311 1 0.347450500075 0.280671252536
+CG3RC1 SG301 1 0.345223253279 0.257919081884
+CG3RC1 SG302 1 0.365268474438 0.286840588481
+CG3RC1 SG3O1 1 0.356359487256 0.286840588481
+CG3RC1 SG3O2 1 0.347450500075 0.247528778125
+CG3RC1 SG3O3 1 0.347450500075 0.247528778125
+CG3RC1 FGA1 1 0.314487247504 0.153729976257
+CG3RC1 FGA2 1 0.314487247504 0.135577095411
+CG3RC1 FGA3 1 0.311814551349 0.130309939452
+CG3RC1 FGP1 1 0.311814551349 0.130309939452
+CG3RC1 FGR1 1 0.320723538531 0.144938011577
+CG3RC1 CLGA1 1 0.339432411611 0.245040988571
+CG3RC1 CLGA3 1 0.339432411611 0.232955260941
+CG3RC1 CLGR1 1 0.341214209048 0.236682781799
+CG3RC1 BRGA1 1 0.344777803920 0.289876023155
+CG3RC1 BRGA2 1 0.351904993665 0.304599797767
+CG3RC1 BRGA3 1 0.347450500075 0.307459952514
+CG3RC1 BRGR1 1 0.353686791102 0.271154190821
+CG3RC1 IGR1 1 0.364377575719 0.310293744700
+CG3RC1 PG0 1 0.360813980847 0.320014464673
+CG3RC1 PG1 1 0.360813980847 0.320014464673
+CG3RC1 PG2 1 0.360813980847 0.320014464673
+CG3RC1 ALG1 1 0.347450500075 0.337324864189
+CG3RC1 CC301 1 0.338541512893 0.041840000000
+CG3RC1 CC3062 1 0.338541512893 0.041840000000
+CG3RC1 CC311 1 0.338541512893 0.041840000000
+CG3RC1 CC3161 1 0.338541512893 0.041840000000
+CG3RC1 CC3162 1 0.338541512893 0.041840000000
+CG3RC1 CC3163 1 0.338541512893 0.041840000000
+CG3RC1 CC321 1 0.338541512893 0.041840000000
+CG3RC1 CC3261 1 0.338541512893 0.041840000000
+CG3RC1 CC3263 1 0.338541512893 0.041840000000
+CG3RC1 CC331 1 0.338541512893 0.041840000000
+CG3RC1 CC2O1 1 0.347450500075 0.138767581228
+CG3RC1 CC2O2 1 0.347450500075 0.110698234855
+CG3RC1 CC2O3 1 0.347450500075 0.125520000000
+CG3RC1 CC2O4 1 0.329632525712 0.102486650838
+CG3RC1 OC2D1 1 0.293996576986 0.144938011577
+CG3RC1 OC2D2 1 0.320723538531 0.144938011577
+CG3RC1 OC2D3 1 0.293996576986 0.144938011577
+CG3RC1 OC2D4 1 0.293996576986 0.144938011577
+CG3RC1 OC3C61 1 0.316269044940 0.132309697301
+CG3RC1 OC311 1 0.326514380198 0.183381431383
+CG3RC1 NC2D1 1 0.307360057758 0.187114168357
+CG3RC1 HCP1 1 0.189271432669 0.089736802707
+CG3RC1 HCA1 1 0.288651184677 0.088756043175
+CG3RC1 HCA2 1 0.288651184677 0.078275472531
+CG3RC1 HCA3 1 0.288651184677 0.064818249282
+CG3RC1 CC312 1 0.338541512893 0.041840000000
+CG3RC1 CC322 1 0.338541512893 0.041840000000
+CG3RC1 HCR1 1 0.240542653898 0.089736802707
+CG3RC1 HCA3M 1 0.288651184677 0.064818249282
+CG3RC1 CC321C 1 0.338541512893 0.041840000000
+CG3RC1 CC321D 1 0.338541512893 0.041840000000
+CG3RC1 CC311C 1 0.338541512893 0.041840000000
+CG3RC1 CC311D 1 0.338541512893 0.041840000000
+CG3RC1 OC301 1 0.316269044940 0.132309697301
+CG3RC1 OC302 1 0.316269044940 0.132309697301
+CG3RC1 HCP1M 1 0.189271432669 0.089736802707
+CG3RC1 OC311M 1 0.326514380198 0.183381431383
+CG3RC1 OC3C5M 1 0.316269044940 0.132309697301
+CG3RC1 CC322C 1 0.338541512893 0.041840000000
+CG3RC1 HCA2C2 1 0.285087589805 0.078275472531
+CG3RC1 CC312C 1 0.338541512893 0.041840000000
+CG3RC1 HCA1C2 1 0.288651184677 0.088756043175
+CG3RC1 OC3C51 1 0.316269044940 0.132309697301
+CG3RC1 CC3152 1 0.338541512893 0.041840000000
+CG3RC1 CC3051 1 0.338541512893 0.041840000000
+CG3RC1 CC3251 1 0.338541512893 0.041840000000
+CG3RC1 CC3151 1 0.338541512893 0.041840000000
+CG3RC1 CC3153 1 0.338541512893 0.041840000000
+CG3RC1 OC2DP 1 0.320723538531 0.144938011577
+CG3RC1 OC312 1 0.326959829558 0.163176000000
+CG3RC1 OC30P 1 0.326959829558 0.163176000000
+CG3RC1 PC 1 0.360813980847 0.320014464673
+CG3RC1 SC 1 0.356359487256 0.286840588481
+CG3RC1 CC312D 1 0.338541512893 0.041840000000
+CG3RC1 OC303 1 0.316269044940 0.132309697301
+CG3RC1 HN1 1 0.189271432669 0.089736802707
+CG3RC1 HN2 1 0.189271432669 0.089736802707
+CG3RC1 HN3 1 0.267269615442 0.089736802707
+CG3RC1 HN4 1 0.189271432669 0.089736802707
+CG3RC1 HN5 1 0.189271432669 0.089736802707
+CG3RC1 HN6 1 0.286869387241 0.062058748940
+CG3RC1 HN7 1 0.286869387241 0.062058748940
+CG3RC1 HN8 1 0.288651184677 0.070011711020
+CG3RC1 HN9 1 0.288651184677 0.064818249282
+CG3RC1 NN1 1 0.334087019303 0.187114168357
+CG3RC1 NN2 1 0.334087019303 0.187114168357
+CG3RC1 NN2B 1 0.334087019303 0.187114168357
+CG3RC1 NN2G 1 0.334087019303 0.187114168357
+CG3RC1 NN2U 1 0.334087019303 0.187114168357
+CG3RC1 NN3 1 0.334087019303 0.187114168357
+CG3RC1 NN3A 1 0.334087019303 0.187114168357
+CG3RC1 NN3G 1 0.334087019303 0.187114168357
+CG3RC1 NN4 1 0.334087019303 0.187114168357
+CG3RC1 NN6 1 0.334087019303 0.187114168357
+CG3RC1 ON1 1 0.320723538531 0.144938011577
+CG3RC1 ON1C 1 0.320723538531 0.144938011577
+CG3RC1 ON2 1 0.326959829558 0.163176000000
+CG3RC1 ON3 1 0.320723538531 0.144938011577
+CG3RC1 ON4 1 0.326959829558 0.163176000000
+CG3RC1 ON5 1 0.326959829558 0.163176000000
+CG3RC1 ON6 1 0.326959829558 0.163176000000
+CG3RC1 ON6B 1 0.326959829558 0.163176000000
+CG3RC1 CN1 1 0.338541512893 0.132309697301
+CG3RC1 CN1T 1 0.338541512893 0.132309697301
+CG3RC1 CN2 1 0.338541512893 0.132309697301
+CG3RC1 CN3 1 0.338541512893 0.125520000000
+CG3RC1 CN3T 1 0.338541512893 0.125520000000
+CG3RC1 CN4 1 0.338541512893 0.114583559030
+CG3RC1 CN5 1 0.338541512893 0.114583559030
+CG3RC1 CN5G 1 0.338541512893 0.114583559030
+CG3RC1 CN7 1 0.338541512893 0.041840000000
+CG3RC1 CN7B 1 0.338541512893 0.041840000000
+CG3RC1 CN8 1 0.338541512893 0.041840000000
+CG3RC1 CN8B 1 0.338541512893 0.041840000000
+CG3RC1 CN9 1 0.338541512893 0.041840000000
+CG3RC1 P 1 0.360813980847 0.320014464673
+CG3RC1 P2 1 0.360813980847 0.320014464673
+CG3RC1 HOL 1 0.189271432669 0.089736802707
+CG3RC1 HAL1 1 0.286869387241 0.062058748940
+CG3RC1 HAL2 1 0.288651184677 0.070011711020
+CG3RC1 HAL3 1 0.288651184677 0.064818249282
+CG3RC1 HBL 1 0.286869387241 0.062058748940
+CG3RC1 HCL 1 0.189271432669 0.089736802707
+CG3RC1 HL 1 0.231633666716 0.089736802707
+CG3RC1 HEL1 1 0.280633096214 0.073666921749
+CG3RC1 HEL2 1 0.281523994932 0.067464972838
+CG3RC1 CL 1 0.347450500075 0.110698234855
+CG3RC1 CCL 1 0.347450500075 0.110698234855
+CG3RC1 CTL1 1 0.338541512893 0.041840000000
+CG3RC1 CTL2 1 0.338541512893 0.041840000000
+CG3RC1 CTL3 1 0.338541512893 0.041840000000
+CG3RC1 CTL5 1 0.338541512893 0.041840000000
+CG3RC1 CEL1 1 0.355468588538 0.109105371453
+CG3RC1 CEL2 1 0.354577689820 0.105847757841
+CG3RC1 CRL1 1 0.338541512893 0.041840000000
+CG3RC1 CRL2 1 0.338541512893 0.041840000000
+CG3RC1 OBL 1 0.293996576986 0.144938011577
+CG3RC1 OCL 1 0.320723538531 0.144938011577
+CG3RC1 O2L 1 0.320723538531 0.144938011577
+CG3RC1 OHL 1 0.326959829558 0.163176000000
+CG3RC1 OSL 1 0.316269044940 0.132309697301
+CG3RC1 OSLP 1 0.316269044940 0.132309697301
+CG3RC1 NH3L 1 0.334087019303 0.187114168357
+CG3RC1 NTL 1 0.334087019303 0.187114168357
+CG3RC1 SL 1 0.356359487256 0.286840588481
+CG3RC1 PL 1 0.360813980847 0.320014464673
+CG3RC1 HCA1A 1 0.288651184677 0.088756043175
+CG3RC1 HCA2A 1 0.288651184677 0.078275472531
+CG3RC1 HCA3A 1 0.288651184677 0.064818249282
+CG3RC1 CC30A 1 0.338541512893 0.041840000000
+CG3RC1 CC31A 1 0.338541512893 0.041840000000
+CG3RC1 CC32A 1 0.338541512893 0.041840000000
+CG3RC1 CC33A 1 0.338541512893 0.041840000000
+CG3RC1 CC326A 1 0.338541512893 0.041840000000
+CG3RC1 HCA25A 1 0.285087589805 0.078275472531
+CG3RC1 CC325A 1 0.338541512893 0.041840000000
+CG3RC1 CC325B 1 0.338541512893 0.041840000000
+CG3RC1 OC305A 1 0.316269044940 0.132309697301
+CG3RC1 OC30A 1 0.316269044940 0.132309697301
+CG3RC1 CPA 1 0.329632525712 0.125520000000
+CG3RC1 CPB 1 0.329632525712 0.125520000000
+CG3RC1 CPM 1 0.329632525712 0.125520000000
+CG3RC1 CM 1 0.356359487256 0.138767581228
+CG3RC1 CST 1 0.308518226092 0.100764063435
+CG3RC1 NPH 1 0.334087019303 0.187114168357
+CG3RC1 OM 1 0.320723538531 0.144938011577
+CG3RC1 OST 1 0.320010819556 0.169954883425
+CG3RC1 FE 1 0.227179173126 0.000000000000
+CG3RC1 ON2B 1 0.326959829558 0.163176000000
+CG3RC1 SP 1 0.365268474438 0.280671252536
+NG2S0 C 1 0.342996006484 0.013876758123
+NG2S0 CA 1 0.342318923458 0.011069823485
+NG2S0 CC 1 0.342996006484 0.011069823485
+NG2S0 CD 1 0.342996006484 0.011069823485
+NG2S0 CE1 1 0.351014094947 0.010910537145
+NG2S0 CE2 1 0.350123196229 0.010584775784
+NG2S0 CP1 1 0.334087019303 0.004184000000
+NG2S0 CP2 1 0.334087019303 0.004184000000
+NG2S0 CP3 1 0.334087019303 0.004184000000
+NG2S0 CPH1 1 0.325178032121 0.009355708418
+NG2S0 CPH2 1 0.325178032121 0.009355708418
+NG2S0 CS 1 0.360813980847 0.013876758123
+NG2S0 CPT 1 0.330523424430 0.013164648662
+NG2S0 CY 1 0.342105107766 0.011304545493
+NG2S0 CAI 1 0.342105107766 0.011304545493
+NG2S0 CT 1 0.334087019303 0.004184000000
+NG2S0 CT1 1 0.334087019303 0.004184000000
+NG2S0 CT2 1 0.334087019303 0.004184000000
+NG2S0 CT2A 1 0.334087019303 0.004184000000
+NG2S0 CT3 1 0.334087019303 0.004184000000
+NG2S0 H 1 0.184816939078 0.008973680271
+NG2S0 HA 1 0.282414893650 0.006205874894
+NG2S0 HB1 1 0.282414893650 0.006205874894
+NG2S0 HB2 1 0.284196691087 0.007001171102
+NG2S0 HE1 1 0.276178602624 0.007366692175
+NG2S0 HE2 1 0.277069501342 0.006746497284
+NG2S0 HC 1 0.184816939078 0.008973680271
+NG2S0 HP 1 0.285818126754 0.007246900579
+NG2S0 HR1 1 0.244997147489 0.008973680271
+NG2S0 HR2 1 0.227179173126 0.008973680271
+NG2S0 HR3 1 0.295600194679 0.003695208746
+NG2S0 HS 1 0.204906705172 0.013230969730
+NG2S0 HA1 1 0.284196691087 0.008875604317
+NG2S0 HA2 1 0.284196691087 0.007714914802
+NG2S0 HA3 1 0.284196691087 0.006481824928
+NG2S0 N 1 0.329632525712 0.000418400000
+NG2S0 NC2 1 0.329632525712 0.018711416836
+NG2S0 NH1 1 0.302905564168 0.018711416836
+NG2S0 NH2 1 0.329632525712 0.018711416836
+NG2S0 NH3 1 0.329632525712 0.018711416836
+NG2S0 NP 1 0.329632525712 0.018711416836
+NG2S0 NR1 1 0.329632525712 0.018711416836
+NG2S0 NR2 1 0.329632525712 0.018711416836
+NG2S0 NR3 1 0.329632525712 0.018711416836
+NG2S0 NY 1 0.329632525712 0.018711416836
+NG2S0 O 1 0.289542083396 0.014493801158
+NG2S0 OB 1 0.289542083396 0.014493801158
+NG2S0 OC 1 0.316269044940 0.014493801158
+NG2S0 OH1 1 0.322505335967 0.016317600000
+NG2S0 OS 1 0.322505335967 0.016317600000
+NG2S0 S 1 0.342996006484 0.028067125254
+NG2S0 SM 1 0.340768759689 0.025791908188
+NG2S0 SS 1 0.360813980847 0.028684058848
+NG2S0 HT 1 0.184816939078 0.008973680271
+NG2S0 OT 1 0.322344974198 0.016317600000
+NG2S0 OX 1 0.316269044940 0.014493801158
+NG2S0 HX 1 0.184816939078 0.008973680271
+NG2S0 LIT 1 0.280410371535 0.002019619877
+NG2S0 SOD 1 0.290499799518 0.009061041035
+NG2S0 MG 1 0.270387760956 0.005124332542
+NG2S0 POT 1 0.321948524268 0.012341026991
+NG2S0 CAL 1 0.286602117626 0.014493801158
+NG2S0 RUB 1 0.334087019303 0.016204562321
+NG2S0 CES 1 0.351904993665 0.018237633180
+NG2S0 BAR 1 0.333196120584 0.016204562321
+NG2S0 ZN 1 0.261924223133 0.020920000000
+NG2S0 CAD 1 0.285711218908 0.014493801158
+NG2S0 CLA 1 0.367050271874 0.016204562321
+NG2S0 HGA1 1 0.284196691087 0.008875604317
+NG2S0 HGA2 1 0.284196691087 0.007827547253
+NG2S0 HGA3 1 0.284196691087 0.006481824928
+NG2S0 HGA4 1 0.276178602624 0.007366692175
+NG2S0 HGA5 1 0.277069501342 0.006746497284
+NG2S0 HGA6 1 0.282414893650 0.007001171102
+NG2S0 HGA7 1 0.280633096214 0.007246900579
+NG2S0 HGAAM0 1 0.278851298778 0.007001171102
+NG2S0 HGAAM1 1 0.278851298778 0.007001171102
+NG2S0 HGAAM2 1 0.277069501342 0.008368000000
+NG2S0 HGP1 1 0.184816939078 0.008973680271
+NG2S0 HGP2 1 0.184816939078 0.008973680271
+NG2S0 HGP3 1 0.204906705172 0.013230969730
+NG2S0 HGP4 1 0.184816939078 0.008973680271
+NG2S0 HGP5 1 0.227179173126 0.008973680271
+NG2S0 HGPAM1 1 0.242769900693 0.003969290919
+NG2S0 HGPAM2 1 0.242769900693 0.004184000000
+NG2S0 HGPAM3 1 0.242324451334 0.004583342361
+NG2S0 HGR51 1 0.285818126754 0.007246900579
+NG2S0 HGR52 1 0.244997147489 0.008973680271
+NG2S0 HGR53 1 0.227179173126 0.008973680271
+NG2S0 HGR61 1 0.285818126754 0.007246900579
+NG2S0 HGR62 1 0.262815121851 0.008973680271
+NG2S0 HGR63 1 0.244997147489 0.008973680271
+NG2S0 HGR71 1 0.285818126754 0.007246900579
+NG2S0 CG1T1 1 0.328741626994 0.017098181049
+NG2S0 CG1T2 1 0.342327832445 0.013440998249
+NG2S0 CG1N1 1 0.331414323148 0.017751208635
+NG2S0 CG2D1 1 0.351014094947 0.010910537145
+NG2S0 CG2D2 1 0.350123196229 0.010584775784
+NG2S0 CG2D1O 1 0.351014094947 0.010910537145
+NG2S0 CG2D2O 1 0.351014094947 0.010910537145
+NG2S0 CG2DC1 1 0.351014094947 0.010910537145
+NG2S0 CG2DC2 1 0.351014094947 0.010910537145
+NG2S0 CG2DC3 1 0.350123196229 0.010584775784
+NG2S0 CG25C1 1 0.351014094947 0.010910537145
+NG2S0 CG25C2 1 0.351014094947 0.010910537145
+NG2S0 CG251O 1 0.351014094947 0.010910537145
+NG2S0 CG252O 1 0.351014094947 0.010910537145
+NG2S0 CG2N1 1 0.342996006484 0.013876758123
+NG2S0 CG2N2 1 0.342996006484 0.013876758123
+NG2S0 CG2O1 1 0.342996006484 0.013876758123
+NG2S0 CG2O2 1 0.316269044940 0.013097991785
+NG2S0 CG2O3 1 0.342996006484 0.011069823485
+NG2S0 CG2O4 1 0.325178032121 0.010248665084
+NG2S0 CG2O5 1 0.342996006484 0.012552000000
+NG2S0 CG2O6 1 0.342996006484 0.011069823485
+NG2S0 CG2O7 1 0.304063732501 0.010076406344
+NG2S0 CG2R51 1 0.351904993665 0.009355708418
+NG2S0 CG2R52 1 0.360813980847 0.005917069545
+NG2S0 CG2R53 1 0.360813980847 0.005917069545
+NG2S0 CG2R57 1 0.351904993665 0.009355708418
+NG2S0 CG2R61 1 0.342318923458 0.011069823485
+NG2S0 CG2R62 1 0.334087019303 0.012552000000
+NG2S0 CG2R63 1 0.334087019303 0.013230969730
+NG2S0 CG2R64 1 0.351904993665 0.008368000000
+NG2S0 CG2R66 1 0.334087019303 0.011069823485
+NG2S0 CG2R67 1 0.342318923458 0.011069823485
+NG2S0 CG2RC0 1 0.330523424430 0.013164648662
+NG2S0 CG2R71 1 0.342532739151 0.010830015476
+NG2S0 CG2RC7 1 0.330523424430 0.013164648662
+NG2S0 CG301 1 0.334087019303 0.004184000000
+NG2S0 CG302 1 0.369722968028 0.005917069545
+NG2S0 CG311 1 0.334087019303 0.004184000000
+NG2S0 CG312 1 0.347450500075 0.008574648401
+NG2S0 CG314 1 0.334087019303 0.004184000000
+NG2S0 CG321 1 0.334087019303 0.004184000000
+NG2S0 CG322 1 0.334087019303 0.010248665084
+NG2S0 CG323 1 0.360813980847 0.013876758123
+NG2S0 CG324 1 0.334087019303 0.004184000000
+NG2S0 CG331 1 0.334087019303 0.004184000000
+NG2S0 CG334 1 0.334087019303 0.004184000000
+NG2S0 CG3C50 1 0.334087019303 0.004184000000
+NG2S0 CG3C51 1 0.334087019303 0.004184000000
+NG2S0 CG3C52 1 0.334087019303 0.004184000000
+NG2S0 CG3C53 1 0.334087019303 0.004184000000
+NG2S0 CG3C54 1 0.334087019303 0.004184000000
+NG2S0 CG3C31 1 0.334087019303 0.004184000000
+NG2S0 CG3C41 1 0.334087019303 0.004184000000
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+NG2S0 CG3AM0 1 0.340323310330 0.011069823485
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+NG2S0 NG1T1 1 0.324287133403 0.017751208635
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+NG2S0 NG2S0 1 0.329632525712 0.000418400000
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+NG2S0 NG2O1 1 0.329632525712 0.018711416836
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+NG2S0 NG2R57 1 0.329632525712 0.018711416836
+NG2S0 NG2R60 1 0.333196120584 0.010248665084
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+NG2S0 NG2R62 1 0.348341398793 0.009355708418
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+NG2S0 NG301 1 0.342996006484 0.007827547253
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+NG2S0 NG321 1 0.342105107766 0.010248665084
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+NG2S0 OG2D1 1 0.289542083396 0.014493801158
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+NG2S0 CLGA1 1 0.334977918021 0.024504098857
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+NG2S0 CLGR1 1 0.336759715457 0.023668278180
+NG2S0 BRGA1 1 0.340323310330 0.028987602315
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+NG2S0 IGR1 1 0.359923082129 0.031029374470
+NG2S0 PG0 1 0.356359487256 0.032001446467
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+NG2S0 ALG1 1 0.342996006484 0.033732486419
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+NG2S1 N 1 0.302905564168 0.018711416836
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+OG2D1 HGR63 1 0.204906705172 0.310857403193
+OG2D1 HGR71 1 0.245727684437 0.251040000000
+OG2D1 CG1T1 1 0.288651184677 0.592298365893
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+OG2D1 CG25C1 1 0.310923652631 0.377952093472
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+OG2D1 CG251O 1 0.310923652631 0.377952093472
+OG2D1 CG252O 1 0.310923652631 0.377952093472
+OG2D1 CG2N1 1 0.302905564168 0.480705002262
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+OG2D1 CG312 1 0.307360057758 0.297034533750
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+OG2D1 CG334 1 0.293996576986 0.144938011577
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+OG2D1 NG1T1 1 0.284196691087 0.614919905028
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+OG2D1 OG2D1 1 0.249451641079 0.502080000000
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+OG2D1 ON1 1 0.276178602624 0.502080000000
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+OG2D1 P 1 0.316269044940 1.108562623941
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+OG2D1 HOL 1 0.144726496762 0.310857403193
+OG2D1 HAL1 1 0.242324451334 0.214977812437
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+OG2D1 HBL 1 0.242324451334 0.214977812437
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+OG2D1 HL 1 0.187088730809 0.310857403193
+OG2D1 HEL1 1 0.236088160307 0.255189702614
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+OG2D1 CL 1 0.302905564168 0.383469934154
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+OG2D1 CTL1 1 0.293996576986 0.144938011577
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+OG2D1 CTL5 1 0.293996576986 0.144938011577
+OG2D1 CEL1 1 0.310923652631 0.377952093472
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+OG2D1 SL 1 0.311814551349 0.993644945843
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+OG2D1 CST 1 0.263973290185 0.349056954894
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+OG2D1 OM 1 0.276178602624 0.502080000000
+OG2D1 OST 1 0.275465883649 0.588740986173
+OG2D1 FE 1 0.182634237219 0.000000000000
+OG2D1 ON2B 1 0.282414893650 0.565258245152
+OG2D1 SP 1 0.320723538531 0.972273739232
+OG2D3 C 1 0.302905564168 0.480705002262
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+OG2D3 CAI 1 0.302014665450 0.391600943002
+OG2D3 CT 1 0.293996576986 0.144938011577
+OG2D3 CT1 1 0.293996576986 0.144938011577
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+OG2D3 CT2A 1 0.293996576986 0.144938011577
+OG2D3 CT3 1 0.293996576986 0.144938011577
+OG2D3 H 1 0.144726496762 0.310857403193
+OG2D3 HA 1 0.242324451334 0.214977812437
+OG2D3 HB1 1 0.242324451334 0.214977812437
+OG2D3 HB2 1 0.244106248770 0.242527681224
+OG2D3 HE1 1 0.236088160307 0.255189702614
+OG2D3 HE2 1 0.236979059025 0.233705521373
+OG2D3 HC 1 0.144726496762 0.310857403193
+OG2D3 HP 1 0.245727684437 0.251040000000
+OG2D3 HR1 1 0.204906705172 0.310857403193
+OG2D3 HR2 1 0.187088730809 0.310857403193
+OG2D3 HR3 1 0.255509752363 0.128005785869
+OG2D3 HS 1 0.164816262856 0.458334236120
+OG2D3 HA1 1 0.244106248770 0.307459952514
+OG2D3 HA2 1 0.244106248770 0.267252488258
+OG2D3 HA3 1 0.244106248770 0.224537002029
+OG2D3 N 1 0.289542083396 0.014493801158
+OG2D3 NC2 1 0.289542083396 0.648182492821
+OG2D3 NH1 1 0.262815121851 0.648182492821
+OG2D3 NH2 1 0.289542083396 0.648182492821
+OG2D3 NH3 1 0.289542083396 0.648182492821
+OG2D3 NP 1 0.289542083396 0.648182492821
+OG2D3 NR1 1 0.289542083396 0.648182492821
+OG2D3 NR2 1 0.289542083396 0.648182492821
+OG2D3 NR3 1 0.289542083396 0.648182492821
+OG2D3 NY 1 0.289542083396 0.648182492821
+OG2D3 O 1 0.249451641079 0.502080000000
+OG2D3 OB 1 0.249451641079 0.502080000000
+OG2D3 OC 1 0.276178602624 0.502080000000
+OG2D3 OH1 1 0.282414893650 0.565258245152
+OG2D3 OS 1 0.282414893650 0.565258245152
+OG2D3 S 1 0.302905564168 0.972273739232
+OG2D3 SM 1 0.300678317372 0.893457908130
+OG2D3 SS 1 0.320723538531 0.993644945843
+OG2D3 HT 1 0.144726496762 0.310857403193
+OG2D3 OT 1 0.282254531881 0.565258245152
+OG2D3 OX 1 0.276178602624 0.502080000000
+OG2D3 HX 1 0.144726496762 0.310857403193
+OG2D3 LIT 1 0.240319929218 0.069961684782
+OG2D3 SOD 1 0.250409357201 0.313883668846
+OG2D3 MG 1 0.230297318639 0.177512086349
+OG2D3 POT 1 0.281858081952 0.427505715330
+OG2D3 CAL 1 0.246511675309 0.502080000000
+OG2D3 RUB 1 0.293996576986 0.561342505072
+OG2D3 CES 1 0.311814551349 0.631770145543
+OG2D3 BAR 1 0.293105678268 0.561342505072
+OG2D3 ZN 1 0.221833780817 0.724690057887
+OG2D3 CAD 1 0.245620776591 0.502080000000
+OG2D3 CLA 1 0.326959829558 0.561342505072
+OG2D3 HGA1 1 0.244106248770 0.307459952514
+OG2D3 HGA2 1 0.244106248770 0.271154190821
+OG2D3 HGA3 1 0.244106248770 0.224537002029
+OG2D3 HGA4 1 0.236088160307 0.255189702614
+OG2D3 HGA5 1 0.236979059025 0.233705521373
+OG2D3 HGA6 1 0.242324451334 0.242527681224
+OG2D3 HGA7 1 0.240542653898 0.251040000000
+OG2D3 HGAAM0 1 0.238760856462 0.242527681224
+OG2D3 HGAAM1 1 0.238760856462 0.242527681224
+OG2D3 HGAAM2 1 0.236979059025 0.289876023155
+OG2D3 HGP1 1 0.144726496762 0.310857403193
+OG2D3 HGP2 1 0.144726496762 0.310857403193
+OG2D3 HGP3 1 0.164816262856 0.458334236120
+OG2D3 HGP4 1 0.144726496762 0.310857403193
+OG2D3 HGP5 1 0.187088730809 0.310857403193
+OG2D3 HGPAM1 1 0.202679458377 0.137500270836
+OG2D3 HGPAM2 1 0.202679458377 0.144938011577
+OG2D3 HGPAM3 1 0.202234009018 0.158771636762
+OG2D3 HGR51 1 0.245727684437 0.251040000000
+OG2D3 HGR52 1 0.204906705172 0.310857403193
+OG2D3 HGR53 1 0.187088730809 0.310857403193
+OG2D3 HGR61 1 0.245727684437 0.251040000000
+OG2D3 HGR62 1 0.222724679535 0.310857403193
+OG2D3 HGR63 1 0.204906705172 0.310857403193
+OG2D3 HGR71 1 0.245727684437 0.251040000000
+OG2D3 CG1T1 1 0.288651184677 0.592298365893
+OG2D3 CG1T2 1 0.302237390129 0.465609837422
+OG2D3 CG1N1 1 0.291323880832 0.614919905028
+OG2D3 CG2D1 1 0.310923652631 0.377952093472
+OG2D3 CG2D2 1 0.310032753913 0.366667388896
+OG2D3 CG2D1O 1 0.310923652631 0.377952093472
+OG2D3 CG2D2O 1 0.310923652631 0.377952093472
+OG2D3 CG2DC1 1 0.310923652631 0.377952093472
+OG2D3 CG2DC2 1 0.310923652631 0.377952093472
+OG2D3 CG2DC3 1 0.310032753913 0.366667388896
+OG2D3 CG25C1 1 0.310923652631 0.377952093472
+OG2D3 CG25C2 1 0.310923652631 0.377952093472
+OG2D3 CG251O 1 0.310923652631 0.377952093472
+OG2D3 CG252O 1 0.310923652631 0.377952093472
+OG2D3 CG2N1 1 0.302905564168 0.480705002262
+OG2D3 CG2N2 1 0.302905564168 0.480705002262
+OG2D3 CG2O1 1 0.302905564168 0.480705002262
+OG2D3 CG2O2 1 0.276178602624 0.453727744975
+OG2D3 CG2O3 1 0.302905564168 0.383469934154
+OG2D3 CG2O4 1 0.285087589805 0.355024172698
+OG2D3 CG2O5 1 0.302905564168 0.434814034732
+OG2D3 CG2O6 1 0.302905564168 0.383469934154
+OG2D3 CG2O7 1 0.263973290185 0.349056954894
+OG2D3 CG2R51 1 0.311814551349 0.324091246411
+OG2D3 CG2R52 1 0.320723538531 0.204973301676
+OG2D3 CG2R53 1 0.320723538531 0.204973301676
+OG2D3 CG2R57 1 0.311814551349 0.324091246411
+OG2D3 CG2R61 1 0.302228481142 0.383469934154
+OG2D3 CG2R62 1 0.293996576986 0.434814034732
+OG2D3 CG2R63 1 0.293996576986 0.458334236120
+OG2D3 CG2R64 1 0.311814551349 0.289876023155
+OG2D3 CG2R66 1 0.293996576986 0.383469934154
+OG2D3 CG2R67 1 0.302228481142 0.383469934154
+OG2D3 CG2RC0 1 0.290432982114 0.456036806936
+OG2D3 CG2R71 1 0.302442296834 0.375162741007
+OG2D3 CG2RC7 1 0.290432982114 0.456036806936
+OG2D3 CG301 1 0.293996576986 0.144938011577
+OG2D3 CG302 1 0.329632525712 0.204973301676
+OG2D3 CG311 1 0.293996576986 0.144938011577
+OG2D3 CG312 1 0.307360057758 0.297034533750
+OG2D3 CG314 1 0.293996576986 0.144938011577
+OG2D3 CG321 1 0.293996576986 0.144938011577
+OG2D3 CG322 1 0.293996576986 0.355024172698
+OG2D3 CG323 1 0.320723538531 0.480705002262
+OG2D3 CG324 1 0.293996576986 0.144938011577
+OG2D3 CG331 1 0.293996576986 0.144938011577
+OG2D3 CG334 1 0.293996576986 0.144938011577
+OG2D3 CG3C50 1 0.293996576986 0.144938011577
+OG2D3 CG3C51 1 0.293996576986 0.144938011577
+OG2D3 CG3C52 1 0.293996576986 0.144938011577
+OG2D3 CG3C53 1 0.293996576986 0.144938011577
+OG2D3 CG3C54 1 0.293996576986 0.144938011577
+OG2D3 CG3C31 1 0.293996576986 0.144938011577
+OG2D3 CG3C41 1 0.293996576986 0.144938011577
+OG2D3 CG3RC1 1 0.293996576986 0.144938011577
+OG2D3 CG3AM0 1 0.300232868013 0.383469934154
+OG2D3 CG3AM1 1 0.301123766731 0.404789837027
+OG2D3 CG3AM2 1 0.302014665450 0.409946603352
+OG2D3 NG1T1 1 0.284196691087 0.614919905028
+OG2D3 NG2D1 1 0.289542083396 0.648182492821
+OG2D3 NG2S0 1 0.289542083396 0.014493801158
+OG2D3 NG2S1 1 0.262815121851 0.648182492821
+OG2D3 NG2S2 1 0.289542083396 0.648182492821
+OG2D3 NG2S3 1 0.289542083396 0.648182492821
+OG2D3 NG2O1 1 0.289542083396 0.648182492821
+OG2D3 NG2P1 1 0.289542083396 0.648182492821
+OG2D3 NG2R43 1 0.289542083396 0.648182492821
+OG2D3 NG2R50 1 0.289542083396 0.648182492821
+OG2D3 NG2R51 1 0.289542083396 0.648182492821
+OG2D3 NG2R52 1 0.289542083396 0.648182492821
+OG2D3 NG2R53 1 0.289542083396 0.648182492821
+OG2D3 NG2R57 1 0.289542083396 0.648182492821
+OG2D3 NG2R60 1 0.293105678268 0.355024172698
+OG2D3 NG2R61 1 0.289542083396 0.648182492821
+OG2D3 NG2R62 1 0.308250956477 0.324091246411
+OG2D3 NG2R67 1 0.289542083396 0.648182492821
+OG2D3 NG2RC0 1 0.289542083396 0.648182492821
+OG2D3 NG301 1 0.302905564168 0.271154190821
+OG2D3 NG311 1 0.302905564168 0.307459952514
+OG2D3 NG321 1 0.302014665450 0.355024172698
+OG2D3 NG331 1 0.301123766731 0.383469934154
+OG2D3 NG3C51 1 0.289542083396 0.648182492821
+OG2D3 NG3N1 1 0.307360057758 0.355024172698
+OG2D3 NG3P0 1 0.289542083396 0.648182492821
+OG2D3 NG3P1 1 0.289542083396 0.648182492821
+OG2D3 NG3P2 1 0.289542083396 0.648182492821
+OG2D3 NG3P3 1 0.289542083396 0.648182492821
+OG2D3 OG2D1 1 0.249451641079 0.502080000000
+OG2D3 OG2D2 1 0.276178602624 0.502080000000
+OG2D3 OG2D3 1 0.249451641079 0.502080000000
+OG2D3 OG2D4 1 0.276178602624 0.502080000000
+OG2D3 OG2D5 1 0.275465883649 0.588740986173
+OG2D3 OG2N1 1 0.276178602624 0.502080000000
+OG2D3 OG2P1 1 0.276178602624 0.502080000000
+OG2D3 OG2R50 1 0.276178602624 0.502080000000
+OG2D3 OG3R60 1 0.271724109033 0.458334236120
+OG2D3 OG301 1 0.271724109033 0.458334236120
+OG2D3 OG302 1 0.271724109033 0.458334236120
+OG2D3 OG303 1 0.271724109033 0.458334236120
+OG2D3 OG304 1 0.271724109033 0.458334236120
+OG2D3 OG311 1 0.281969444291 0.635251912639
+OG2D3 OG312 1 0.280633096214 0.502080000000
+OG2D3 OG3C31 1 0.271724109033 0.458334236120
+OG2D3 OG3C51 1 0.271724109033 0.458334236120
+OG2D3 OG3C61 1 0.271724109033 0.458334236120
+OG2D3 SG2D1 1 0.307360057758 1.089448042267
+OG2D3 SG2R50 1 0.302905564168 0.972273739232
+OG2D3 SG311 1 0.302905564168 0.972273739232
+OG2D3 SG301 1 0.300678317372 0.893457908130
+OG2D3 SG302 1 0.320723538531 0.993644945843
+OG2D3 SG3O1 1 0.311814551349 0.993644945843
+OG2D3 SG3O2 1 0.302905564168 0.857464840095
+OG2D3 SG3O3 1 0.302905564168 0.857464840095
+OG2D3 FGA1 1 0.269942311597 0.532536259047
+OG2D3 FGA2 1 0.269942311597 0.469652835188
+OG2D3 FGA3 1 0.267269615442 0.451406871724
+OG2D3 FGP1 1 0.267269615442 0.451406871724
+OG2D3 FGR1 1 0.276178602624 0.502080000000
+OG2D3 CLGA1 1 0.294887475704 0.848846884285
+OG2D3 CLGA3 1 0.294887475704 0.806980695680
+OG2D3 CLGR1 1 0.296669273141 0.819893206704
+OG2D3 BRGA1 1 0.300232868013 1.004160000000
+OG2D3 BRGA2 1 0.307360057758 1.055164651417
+OG2D3 BRGA3 1 0.302905564168 1.065072518094
+OG2D3 BRGR1 1 0.309141855195 0.939305670376
+OG2D3 IGR1 1 0.319832639812 1.074889062183
+OG2D3 PG0 1 0.316269044940 1.108562623941
+OG2D3 PG1 1 0.316269044940 1.108562623941
+OG2D3 PG2 1 0.316269044940 1.108562623941
+OG2D3 ALG1 1 0.302905564168 1.168527606863
+OG2D3 CC301 1 0.293996576986 0.144938011577
+OG2D3 CC3062 1 0.293996576986 0.144938011577
+OG2D3 CC311 1 0.293996576986 0.144938011577
+OG2D3 CC3161 1 0.293996576986 0.144938011577
+OG2D3 CC3162 1 0.293996576986 0.144938011577
+OG2D3 CC3163 1 0.293996576986 0.144938011577
+OG2D3 CC321 1 0.293996576986 0.144938011577
+OG2D3 CC3261 1 0.293996576986 0.144938011577
+OG2D3 CC3263 1 0.293996576986 0.144938011577
+OG2D3 CC331 1 0.293996576986 0.144938011577
+OG2D3 CC2O1 1 0.302905564168 0.480705002262
+OG2D3 CC2O2 1 0.302905564168 0.383469934154
+OG2D3 CC2O3 1 0.302905564168 0.434814034732
+OG2D3 CC2O4 1 0.285087589805 0.355024172698
+OG2D3 OC2D1 1 0.249451641079 0.502080000000
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+OG2D3 OC2D3 1 0.249451641079 0.502080000000
+OG2D3 OC2D4 1 0.249451641079 0.502080000000
+OG2D3 OC3C61 1 0.271724109033 0.458334236120
+OG2D3 OC311 1 0.281969444291 0.635251912639
+OG2D3 NC2D1 1 0.262815121851 0.648182492821
+OG2D3 HCP1 1 0.144726496762 0.310857403193
+OG2D3 HCA1 1 0.244106248770 0.307459952514
+OG2D3 HCA2 1 0.244106248770 0.271154190821
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+OG2D3 CC312 1 0.293996576986 0.144938011577
+OG2D3 CC322 1 0.293996576986 0.144938011577
+OG2D3 HCR1 1 0.195997717991 0.310857403193
+OG2D3 HCA3M 1 0.244106248770 0.224537002029
+OG2D3 CC321C 1 0.293996576986 0.144938011577
+OG2D3 CC321D 1 0.293996576986 0.144938011577
+OG2D3 CC311C 1 0.293996576986 0.144938011577
+OG2D3 CC311D 1 0.293996576986 0.144938011577
+OG2D3 OC301 1 0.271724109033 0.458334236120
+OG2D3 OC302 1 0.271724109033 0.458334236120
+OG2D3 HCP1M 1 0.144726496762 0.310857403193
+OG2D3 OC311M 1 0.281969444291 0.635251912639
+OG2D3 OC3C5M 1 0.271724109033 0.458334236120
+OG2D3 CC322C 1 0.293996576986 0.144938011577
+OG2D3 HCA2C2 1 0.240542653898 0.271154190821
+OG2D3 CC312C 1 0.293996576986 0.144938011577
+OG2D3 HCA1C2 1 0.244106248770 0.307459952514
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+OG2D3 CC3152 1 0.293996576986 0.144938011577
+OG2D3 CC3051 1 0.293996576986 0.144938011577
+OG2D3 CC3251 1 0.293996576986 0.144938011577
+OG2D3 CC3151 1 0.293996576986 0.144938011577
+OG2D3 CC3153 1 0.293996576986 0.144938011577
+OG2D3 OC2DP 1 0.276178602624 0.502080000000
+OG2D3 OC312 1 0.282414893650 0.565258245152
+OG2D3 OC30P 1 0.282414893650 0.565258245152
+OG2D3 PC 1 0.316269044940 1.108562623941
+OG2D3 SC 1 0.311814551349 0.993644945843
+OG2D3 CC312D 1 0.293996576986 0.144938011577
+OG2D3 OC303 1 0.271724109033 0.458334236120
+OG2D3 HN1 1 0.144726496762 0.310857403193
+OG2D3 HN2 1 0.144726496762 0.310857403193
+OG2D3 HN3 1 0.222724679535 0.310857403193
+OG2D3 HN4 1 0.144726496762 0.310857403193
+OG2D3 HN5 1 0.144726496762 0.310857403193
+OG2D3 HN6 1 0.242324451334 0.214977812437
+OG2D3 HN7 1 0.242324451334 0.214977812437
+OG2D3 HN8 1 0.244106248770 0.242527681224
+OG2D3 HN9 1 0.244106248770 0.224537002029
+OG2D3 NN1 1 0.289542083396 0.648182492821
+OG2D3 NN2 1 0.289542083396 0.648182492821
+OG2D3 NN2B 1 0.289542083396 0.648182492821
+OG2D3 NN2G 1 0.289542083396 0.648182492821
+OG2D3 NN2U 1 0.289542083396 0.648182492821
+OG2D3 NN3 1 0.289542083396 0.648182492821
+OG2D3 NN3A 1 0.289542083396 0.648182492821
+OG2D3 NN3G 1 0.289542083396 0.648182492821
+OG2D3 NN4 1 0.289542083396 0.648182492821
+OG2D3 NN6 1 0.289542083396 0.648182492821
+OG2D3 ON1 1 0.276178602624 0.502080000000
+OG2D3 ON1C 1 0.276178602624 0.502080000000
+OG2D3 ON2 1 0.282414893650 0.565258245152
+OG2D3 ON3 1 0.276178602624 0.502080000000
+OG2D3 ON4 1 0.282414893650 0.565258245152
+OG2D3 ON5 1 0.282414893650 0.565258245152
+OG2D3 ON6 1 0.282414893650 0.565258245152
+OG2D3 ON6B 1 0.282414893650 0.565258245152
+OG2D3 CN1 1 0.293996576986 0.458334236120
+OG2D3 CN1T 1 0.293996576986 0.458334236120
+OG2D3 CN2 1 0.293996576986 0.458334236120
+OG2D3 CN3 1 0.293996576986 0.434814034732
+OG2D3 CN3T 1 0.293996576986 0.434814034732
+OG2D3 CN4 1 0.293996576986 0.396929091904
+OG2D3 CN5 1 0.293996576986 0.396929091904
+OG2D3 CN5G 1 0.293996576986 0.396929091904
+OG2D3 CN7 1 0.293996576986 0.144938011577
+OG2D3 CN7B 1 0.293996576986 0.144938011577
+OG2D3 CN8 1 0.293996576986 0.144938011577
+OG2D3 CN8B 1 0.293996576986 0.144938011577
+OG2D3 CN9 1 0.293996576986 0.144938011577
+OG2D3 P 1 0.316269044940 1.108562623941
+OG2D3 P2 1 0.316269044940 1.108562623941
+OG2D3 HOL 1 0.144726496762 0.310857403193
+OG2D3 HAL1 1 0.242324451334 0.214977812437
+OG2D3 HAL2 1 0.244106248770 0.242527681224
+OG2D3 HAL3 1 0.244106248770 0.224537002029
+OG2D3 HBL 1 0.242324451334 0.214977812437
+OG2D3 HCL 1 0.144726496762 0.310857403193
+OG2D3 HL 1 0.187088730809 0.310857403193
+OG2D3 HEL1 1 0.236088160307 0.255189702614
+OG2D3 HEL2 1 0.236979059025 0.233705521373
+OG2D3 CL 1 0.302905564168 0.383469934154
+OG2D3 CCL 1 0.302905564168 0.383469934154
+OG2D3 CTL1 1 0.293996576986 0.144938011577
+OG2D3 CTL2 1 0.293996576986 0.144938011577
+OG2D3 CTL3 1 0.293996576986 0.144938011577
+OG2D3 CTL5 1 0.293996576986 0.144938011577
+OG2D3 CEL1 1 0.310923652631 0.377952093472
+OG2D3 CEL2 1 0.310032753913 0.366667388896
+OG2D3 CRL1 1 0.293996576986 0.144938011577
+OG2D3 CRL2 1 0.293996576986 0.144938011577
+OG2D3 OBL 1 0.249451641079 0.502080000000
+OG2D3 OCL 1 0.276178602624 0.502080000000
+OG2D3 O2L 1 0.276178602624 0.502080000000
+OG2D3 OHL 1 0.282414893650 0.565258245152
+OG2D3 OSL 1 0.271724109033 0.458334236120
+OG2D3 OSLP 1 0.271724109033 0.458334236120
+OG2D3 NH3L 1 0.289542083396 0.648182492821
+OG2D3 NTL 1 0.289542083396 0.648182492821
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+OC2D3 CG1N1 1 0.291323880832 0.614919905028
+OC2D3 CG2D1 1 0.310923652631 0.377952093472
+OC2D3 CG2D2 1 0.310032753913 0.366667388896
+OC2D3 CG2D1O 1 0.310923652631 0.377952093472
+OC2D3 CG2D2O 1 0.310923652631 0.377952093472
+OC2D3 CG2DC1 1 0.310923652631 0.377952093472
+OC2D3 CG2DC2 1 0.310923652631 0.377952093472
+OC2D3 CG2DC3 1 0.310032753913 0.366667388896
+OC2D3 CG25C1 1 0.310923652631 0.377952093472
+OC2D3 CG25C2 1 0.310923652631 0.377952093472
+OC2D3 CG251O 1 0.310923652631 0.377952093472
+OC2D3 CG252O 1 0.310923652631 0.377952093472
+OC2D3 CG2N1 1 0.302905564168 0.480705002262
+OC2D3 CG2N2 1 0.302905564168 0.480705002262
+OC2D3 CG2O1 1 0.302905564168 0.480705002262
+OC2D3 CG2O2 1 0.276178602624 0.453727744975
+OC2D3 CG2O3 1 0.302905564168 0.383469934154
+OC2D3 CG2O4 1 0.285087589805 0.355024172698
+OC2D3 CG2O5 1 0.302905564168 0.434814034732
+OC2D3 CG2O6 1 0.302905564168 0.383469934154
+OC2D3 CG2O7 1 0.263973290185 0.349056954894
+OC2D3 CG2R51 1 0.311814551349 0.324091246411
+OC2D3 CG2R52 1 0.320723538531 0.204973301676
+OC2D3 CG2R53 1 0.320723538531 0.204973301676
+OC2D3 CG2R57 1 0.311814551349 0.324091246411
+OC2D3 CG2R61 1 0.302228481142 0.383469934154
+OC2D3 CG2R62 1 0.293996576986 0.434814034732
+OC2D3 CG2R63 1 0.293996576986 0.458334236120
+OC2D3 CG2R64 1 0.311814551349 0.289876023155
+OC2D3 CG2R66 1 0.293996576986 0.383469934154
+OC2D3 CG2R67 1 0.302228481142 0.383469934154
+OC2D3 CG2RC0 1 0.290432982114 0.456036806936
+OC2D3 CG2R71 1 0.302442296834 0.375162741007
+OC2D3 CG2RC7 1 0.290432982114 0.456036806936
+OC2D3 CG301 1 0.293996576986 0.144938011577
+OC2D3 CG302 1 0.329632525712 0.204973301676
+OC2D3 CG311 1 0.293996576986 0.144938011577
+OC2D3 CG312 1 0.307360057758 0.297034533750
+OC2D3 CG314 1 0.293996576986 0.144938011577
+OC2D3 CG321 1 0.293996576986 0.144938011577
+OC2D3 CG322 1 0.293996576986 0.355024172698
+OC2D3 CG323 1 0.320723538531 0.480705002262
+OC2D3 CG324 1 0.293996576986 0.144938011577
+OC2D3 CG331 1 0.293996576986 0.144938011577
+OC2D3 CG334 1 0.293996576986 0.144938011577
+OC2D3 CG3C50 1 0.293996576986 0.144938011577
+OC2D3 CG3C51 1 0.293996576986 0.144938011577
+OC2D3 CG3C52 1 0.293996576986 0.144938011577
+OC2D3 CG3C53 1 0.293996576986 0.144938011577
+OC2D3 CG3C54 1 0.293996576986 0.144938011577
+OC2D3 CG3C31 1 0.293996576986 0.144938011577
+OC2D3 CG3C41 1 0.293996576986 0.144938011577
+OC2D3 CG3RC1 1 0.293996576986 0.144938011577
+OC2D3 CG3AM0 1 0.300232868013 0.383469934154
+OC2D3 CG3AM1 1 0.301123766731 0.404789837027
+OC2D3 CG3AM2 1 0.302014665450 0.409946603352
+OC2D3 NG1T1 1 0.284196691087 0.614919905028
+OC2D3 NG2D1 1 0.289542083396 0.648182492821
+OC2D3 NG2S0 1 0.289542083396 0.014493801158
+OC2D3 NG2S1 1 0.262815121851 0.648182492821
+OC2D3 NG2S2 1 0.289542083396 0.648182492821
+OC2D3 NG2S3 1 0.289542083396 0.648182492821
+OC2D3 NG2O1 1 0.289542083396 0.648182492821
+OC2D3 NG2P1 1 0.289542083396 0.648182492821
+OC2D3 NG2R43 1 0.289542083396 0.648182492821
+OC2D3 NG2R50 1 0.289542083396 0.648182492821
+OC2D3 NG2R51 1 0.289542083396 0.648182492821
+OC2D3 NG2R52 1 0.289542083396 0.648182492821
+OC2D3 NG2R53 1 0.289542083396 0.648182492821
+OC2D3 NG2R57 1 0.289542083396 0.648182492821
+OC2D3 NG2R60 1 0.293105678268 0.355024172698
+OC2D3 NG2R61 1 0.289542083396 0.648182492821
+OC2D3 NG2R62 1 0.308250956477 0.324091246411
+OC2D3 NG2R67 1 0.289542083396 0.648182492821
+OC2D3 NG2RC0 1 0.289542083396 0.648182492821
+OC2D3 NG301 1 0.302905564168 0.271154190821
+OC2D3 NG311 1 0.302905564168 0.307459952514
+OC2D3 NG321 1 0.302014665450 0.355024172698
+OC2D3 NG331 1 0.301123766731 0.383469934154
+OC2D3 NG3C51 1 0.289542083396 0.648182492821
+OC2D3 NG3N1 1 0.307360057758 0.355024172698
+OC2D3 NG3P0 1 0.289542083396 0.648182492821
+OC2D3 NG3P1 1 0.289542083396 0.648182492821
+OC2D3 NG3P2 1 0.289542083396 0.648182492821
+OC2D3 NG3P3 1 0.289542083396 0.648182492821
+OC2D3 OG2D1 1 0.249451641079 0.502080000000
+OC2D3 OG2D2 1 0.276178602624 0.502080000000
+OC2D3 OG2D3 1 0.249451641079 0.502080000000
+OC2D3 OG2D4 1 0.276178602624 0.502080000000
+OC2D3 OG2D5 1 0.275465883649 0.588740986173
+OC2D3 OG2N1 1 0.276178602624 0.502080000000
+OC2D3 OG2P1 1 0.276178602624 0.502080000000
+OC2D3 OG2R50 1 0.276178602624 0.502080000000
+OC2D3 OG3R60 1 0.271724109033 0.458334236120
+OC2D3 OG301 1 0.271724109033 0.458334236120
+OC2D3 OG302 1 0.271724109033 0.458334236120
+OC2D3 OG303 1 0.271724109033 0.458334236120
+OC2D3 OG304 1 0.271724109033 0.458334236120
+OC2D3 OG311 1 0.281969444291 0.635251912639
+OC2D3 OG312 1 0.280633096214 0.502080000000
+OC2D3 OG3C31 1 0.271724109033 0.458334236120
+OC2D3 OG3C51 1 0.271724109033 0.458334236120
+OC2D3 OG3C61 1 0.271724109033 0.458334236120
+OC2D3 SG2D1 1 0.307360057758 1.089448042267
+OC2D3 SG2R50 1 0.302905564168 0.972273739232
+OC2D3 SG311 1 0.302905564168 0.972273739232
+OC2D3 SG301 1 0.300678317372 0.893457908130
+OC2D3 SG302 1 0.320723538531 0.993644945843
+OC2D3 SG3O1 1 0.311814551349 0.993644945843
+OC2D3 SG3O2 1 0.302905564168 0.857464840095
+OC2D3 SG3O3 1 0.302905564168 0.857464840095
+OC2D3 FGA1 1 0.269942311597 0.532536259047
+OC2D3 FGA2 1 0.269942311597 0.469652835188
+OC2D3 FGA3 1 0.267269615442 0.451406871724
+OC2D3 FGP1 1 0.267269615442 0.451406871724
+OC2D3 FGR1 1 0.276178602624 0.502080000000
+OC2D3 CLGA1 1 0.294887475704 0.848846884285
+OC2D3 CLGA3 1 0.294887475704 0.806980695680
+OC2D3 CLGR1 1 0.296669273141 0.819893206704
+OC2D3 BRGA1 1 0.300232868013 1.004160000000
+OC2D3 BRGA2 1 0.307360057758 1.055164651417
+OC2D3 BRGA3 1 0.302905564168 1.065072518094
+OC2D3 BRGR1 1 0.309141855195 0.939305670376
+OC2D3 IGR1 1 0.319832639812 1.074889062183
+OC2D3 PG0 1 0.316269044940 1.108562623941
+OC2D3 PG1 1 0.316269044940 1.108562623941
+OC2D3 PG2 1 0.316269044940 1.108562623941
+OC2D3 ALG1 1 0.302905564168 1.168527606863
+OC2D3 CC301 1 0.293996576986 0.144938011577
+OC2D3 CC3062 1 0.293996576986 0.144938011577
+OC2D3 CC311 1 0.293996576986 0.144938011577
+OC2D3 CC3161 1 0.293996576986 0.144938011577
+OC2D3 CC3162 1 0.293996576986 0.144938011577
+OC2D3 CC3163 1 0.293996576986 0.144938011577
+OC2D3 CC321 1 0.293996576986 0.144938011577
+OC2D3 CC3261 1 0.293996576986 0.144938011577
+OC2D3 CC3263 1 0.293996576986 0.144938011577
+OC2D3 CC331 1 0.293996576986 0.144938011577
+OC2D3 CC2O1 1 0.302905564168 0.480705002262
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+OC2D3 CC2O3 1 0.302905564168 0.434814034732
+OC2D3 CC2O4 1 0.285087589805 0.355024172698
+OC2D3 OC2D1 1 0.249451641079 0.502080000000
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+OC2D3 OC2D3 1 0.249451641079 0.502080000000
+OC2D3 OC2D4 1 0.249451641079 0.502080000000
+OC2D3 OC3C61 1 0.271724109033 0.458334236120
+OC2D3 OC311 1 0.281969444291 0.635251912639
+OC2D3 NC2D1 1 0.262815121851 0.648182492821
+OC2D3 HCP1 1 0.144726496762 0.310857403193
+OC2D3 HCA1 1 0.244106248770 0.307459952514
+OC2D3 HCA2 1 0.244106248770 0.271154190821
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+OC2D3 CC312 1 0.293996576986 0.144938011577
+OC2D3 CC322 1 0.293996576986 0.144938011577
+OC2D3 HCR1 1 0.195997717991 0.310857403193
+OC2D3 HCA3M 1 0.244106248770 0.224537002029
+OC2D3 CC321C 1 0.293996576986 0.144938011577
+OC2D3 CC321D 1 0.293996576986 0.144938011577
+OC2D3 CC311C 1 0.293996576986 0.144938011577
+OC2D3 CC311D 1 0.293996576986 0.144938011577
+OC2D3 OC301 1 0.271724109033 0.458334236120
+OC2D3 OC302 1 0.271724109033 0.458334236120
+OC2D3 HCP1M 1 0.144726496762 0.310857403193
+OC2D3 OC311M 1 0.281969444291 0.635251912639
+OC2D3 OC3C5M 1 0.271724109033 0.458334236120
+OC2D3 CC322C 1 0.293996576986 0.144938011577
+OC2D3 HCA2C2 1 0.240542653898 0.271154190821
+OC2D3 CC312C 1 0.293996576986 0.144938011577
+OC2D3 HCA1C2 1 0.244106248770 0.307459952514
+OC2D3 OC3C51 1 0.271724109033 0.458334236120
+OC2D3 CC3152 1 0.293996576986 0.144938011577
+OC2D3 CC3051 1 0.293996576986 0.144938011577
+OC2D3 CC3251 1 0.293996576986 0.144938011577
+OC2D3 CC3151 1 0.293996576986 0.144938011577
+OC2D3 CC3153 1 0.293996576986 0.144938011577
+OC2D3 OC2DP 1 0.276178602624 0.502080000000
+OC2D3 OC312 1 0.282414893650 0.565258245152
+OC2D3 OC30P 1 0.282414893650 0.565258245152
+OC2D3 PC 1 0.316269044940 1.108562623941
+OC2D3 SC 1 0.311814551349 0.993644945843
+OC2D3 CC312D 1 0.293996576986 0.144938011577
+OC2D3 OC303 1 0.271724109033 0.458334236120
+OC2D3 HN1 1 0.144726496762 0.310857403193
+OC2D3 HN2 1 0.144726496762 0.310857403193
+OC2D3 HN3 1 0.222724679535 0.310857403193
+OC2D3 HN4 1 0.144726496762 0.310857403193
+OC2D3 HN5 1 0.144726496762 0.310857403193
+OC2D3 HN6 1 0.242324451334 0.214977812437
+OC2D3 HN7 1 0.242324451334 0.214977812437
+OC2D3 HN8 1 0.244106248770 0.242527681224
+OC2D3 HN9 1 0.244106248770 0.224537002029
+OC2D3 NN1 1 0.289542083396 0.648182492821
+OC2D3 NN2 1 0.289542083396 0.648182492821
+OC2D3 NN2B 1 0.289542083396 0.648182492821
+OC2D3 NN2G 1 0.289542083396 0.648182492821
+OC2D3 NN2U 1 0.289542083396 0.648182492821
+OC2D3 NN3 1 0.289542083396 0.648182492821
+OC2D3 NN3A 1 0.289542083396 0.648182492821
+OC2D3 NN3G 1 0.289542083396 0.648182492821
+OC2D3 NN4 1 0.289542083396 0.648182492821
+OC2D3 NN6 1 0.289542083396 0.648182492821
+OC2D3 ON1 1 0.276178602624 0.502080000000
+OC2D3 ON1C 1 0.276178602624 0.502080000000
+OC2D3 ON2 1 0.282414893650 0.565258245152
+OC2D3 ON3 1 0.276178602624 0.502080000000
+OC2D3 ON4 1 0.282414893650 0.565258245152
+OC2D3 ON5 1 0.282414893650 0.565258245152
+OC2D3 ON6 1 0.282414893650 0.565258245152
+OC2D3 ON6B 1 0.282414893650 0.565258245152
+OC2D3 CN1 1 0.293996576986 0.458334236120
+OC2D3 CN1T 1 0.293996576986 0.458334236120
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+OC2D3 CN3 1 0.293996576986 0.434814034732
+OC2D3 CN3T 1 0.293996576986 0.434814034732
+OC2D3 CN4 1 0.293996576986 0.396929091904
+OC2D3 CN5 1 0.293996576986 0.396929091904
+OC2D3 CN5G 1 0.293996576986 0.396929091904
+OC2D3 CN7 1 0.293996576986 0.144938011577
+OC2D3 CN7B 1 0.293996576986 0.144938011577
+OC2D3 CN8 1 0.293996576986 0.144938011577
+OC2D3 CN8B 1 0.293996576986 0.144938011577
+OC2D3 CN9 1 0.293996576986 0.144938011577
+OC2D3 P 1 0.316269044940 1.108562623941
+OC2D3 P2 1 0.316269044940 1.108562623941
+OC2D3 HOL 1 0.144726496762 0.310857403193
+OC2D3 HAL1 1 0.242324451334 0.214977812437
+OC2D3 HAL2 1 0.244106248770 0.242527681224
+OC2D3 HAL3 1 0.244106248770 0.224537002029
+OC2D3 HBL 1 0.242324451334 0.214977812437
+OC2D3 HCL 1 0.144726496762 0.310857403193
+OC2D3 HL 1 0.187088730809 0.310857403193
+OC2D3 HEL1 1 0.236088160307 0.255189702614
+OC2D3 HEL2 1 0.236979059025 0.233705521373
+OC2D3 CL 1 0.302905564168 0.383469934154
+OC2D3 CCL 1 0.302905564168 0.383469934154
+OC2D3 CTL1 1 0.293996576986 0.144938011577
+OC2D3 CTL2 1 0.293996576986 0.144938011577
+OC2D3 CTL3 1 0.293996576986 0.144938011577
+OC2D3 CTL5 1 0.293996576986 0.144938011577
+OC2D3 CEL1 1 0.310923652631 0.377952093472
+OC2D3 CEL2 1 0.310032753913 0.366667388896
+OC2D3 CRL1 1 0.293996576986 0.144938011577
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+OC2D3 OBL 1 0.249451641079 0.502080000000
+OC2D3 OCL 1 0.276178602624 0.502080000000
+OC2D3 O2L 1 0.276178602624 0.502080000000
+OC2D3 OHL 1 0.282414893650 0.565258245152
+OC2D3 OSL 1 0.271724109033 0.458334236120
+OC2D3 OSLP 1 0.271724109033 0.458334236120
+OC2D3 NH3L 1 0.289542083396 0.648182492821
+OC2D3 NTL 1 0.289542083396 0.648182492821
+OC2D3 SL 1 0.311814551349 0.993644945843
+OC2D3 PL 1 0.316269044940 1.108562623941
+OC2D3 HCA1A 1 0.244106248770 0.307459952514
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+OC2D3 HCA3A 1 0.244106248770 0.224537002029
+OC2D3 CC30A 1 0.293996576986 0.144938011577
+OC2D3 CC31A 1 0.293996576986 0.144938011577
+OC2D3 CC32A 1 0.293996576986 0.144938011577
+OC2D3 CC33A 1 0.293996576986 0.144938011577
+OC2D3 CC326A 1 0.293996576986 0.144938011577
+OC2D3 HCA25A 1 0.240542653898 0.271154190821
+OC2D3 CC325A 1 0.293996576986 0.144938011577
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+OC2D3 OC305A 1 0.271724109033 0.458334236120
+OC2D3 OC30A 1 0.271724109033 0.458334236120
+OC2D3 CPA 1 0.285087589805 0.434814034732
+OC2D3 CPB 1 0.285087589805 0.434814034732
+OC2D3 CPM 1 0.285087589805 0.434814034732
+OC2D3 CM 1 0.311814551349 0.480705002262
+OC2D3 CST 1 0.263973290185 0.349056954894
+OC2D3 NPH 1 0.289542083396 0.648182492821
+OC2D3 OM 1 0.276178602624 0.502080000000
+OC2D3 OST 1 0.275465883649 0.588740986173
+OC2D3 FE 1 0.182634237219 0.000000000000
+OC2D3 ON2B 1 0.282414893650 0.565258245152
+OC2D3 SP 1 0.320723538531 0.972273739232
+OC2D4 C 1 0.302905564168 0.480705002262
+OC2D4 CA 1 0.302228481142 0.383469934154
+OC2D4 CC 1 0.302905564168 0.383469934154
+OC2D4 CD 1 0.302905564168 0.383469934154
+OC2D4 CE1 1 0.310923652631 0.377952093472
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+OC2D4 CPH1 1 0.285087589805 0.324091246411
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+OC2D4 CS 1 0.320723538531 0.480705002262
+OC2D4 CPT 1 0.290432982114 0.456036806936
+OC2D4 CY 1 0.302014665450 0.391600943002
+OC2D4 CAI 1 0.302014665450 0.391600943002
+OC2D4 CT 1 0.293996576986 0.144938011577
+OC2D4 CT1 1 0.293996576986 0.144938011577
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+OC2D4 CT2A 1 0.293996576986 0.144938011577
+OC2D4 CT3 1 0.293996576986 0.144938011577
+OC2D4 H 1 0.144726496762 0.310857403193
+OC2D4 HA 1 0.242324451334 0.214977812437
+OC2D4 HB1 1 0.242324451334 0.214977812437
+OC2D4 HB2 1 0.244106248770 0.242527681224
+OC2D4 HE1 1 0.236088160307 0.255189702614
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+OC2D4 HC 1 0.144726496762 0.310857403193
+OC2D4 HP 1 0.245727684437 0.251040000000
+OC2D4 HR1 1 0.204906705172 0.310857403193
+OC2D4 HR2 1 0.187088730809 0.310857403193
+OC2D4 HR3 1 0.255509752363 0.128005785869
+OC2D4 HS 1 0.164816262856 0.458334236120
+OC2D4 HA1 1 0.244106248770 0.307459952514
+OC2D4 HA2 1 0.244106248770 0.267252488258
+OC2D4 HA3 1 0.244106248770 0.224537002029
+OC2D4 N 1 0.289542083396 0.014493801158
+OC2D4 NC2 1 0.289542083396 0.648182492821
+OC2D4 NH1 1 0.262815121851 0.648182492821
+OC2D4 NH2 1 0.289542083396 0.648182492821
+OC2D4 NH3 1 0.289542083396 0.648182492821
+OC2D4 NP 1 0.289542083396 0.648182492821
+OC2D4 NR1 1 0.289542083396 0.648182492821
+OC2D4 NR2 1 0.289542083396 0.648182492821
+OC2D4 NR3 1 0.289542083396 0.648182492821
+OC2D4 NY 1 0.289542083396 0.648182492821
+OC2D4 O 1 0.249451641079 0.502080000000
+OC2D4 OB 1 0.249451641079 0.502080000000
+OC2D4 OC 1 0.276178602624 0.502080000000
+OC2D4 OH1 1 0.282414893650 0.565258245152
+OC2D4 OS 1 0.282414893650 0.565258245152
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+NC2D1 CE1 1 0.324287133403 0.487934054561
+NC2D1 CE2 1 0.323396234685 0.473365563598
+NC2D1 CP1 1 0.307360057758 0.187114168357
+NC2D1 CP2 1 0.307360057758 0.187114168357
+NC2D1 CP3 1 0.307360057758 0.187114168357
+NC2D1 CPH1 1 0.298451070577 0.418400000000
+NC2D1 CPH2 1 0.298451070577 0.418400000000
+NC2D1 CS 1 0.334087019303 0.620587489400
+NC2D1 CPT 1 0.303796462886 0.588740986173
+NC2D1 CY 1 0.315378146222 0.505554643535
+NC2D1 CAI 1 0.315378146222 0.505554643535
+NC2D1 CT 1 0.307360057758 0.187114168357
+NC2D1 CT1 1 0.307360057758 0.187114168357
+NC2D1 CT2 1 0.307360057758 0.187114168357
+NC2D1 CT2A 1 0.307360057758 0.187114168357
+NC2D1 CT3 1 0.307360057758 0.187114168357
+NC2D1 H 1 0.158089977534 0.401315181871
+NC2D1 HA 1 0.255687932106 0.277535162457
+NC2D1 HB1 1 0.255687932106 0.277535162457
+NC2D1 HB2 1 0.257469729543 0.313101890125
+NC2D1 HE1 1 0.249451641079 0.329448489449
+NC2D1 HE2 1 0.250342539797 0.301712530731
+NC2D1 HC 1 0.158089977534 0.401315181871
+NC2D1 HP 1 0.259091165210 0.324091246411
+NC2D1 HR1 1 0.218270185944 0.401315181871
+NC2D1 HR2 1 0.200452211582 0.401315181871
+NC2D1 HR3 1 0.268873233135 0.165254758963
+NC2D1 HS 1 0.178179743628 0.591706954497
+NC2D1 HA1 1 0.257469729543 0.396929091904
+NC2D1 HA2 1 0.257469729543 0.345021478752
+NC2D1 HA3 1 0.257469729543 0.289876023155
+NC2D1 N 1 0.302905564168 0.018711416836
+NC2D1 NC2 1 0.302905564168 0.836800000000
+NC2D1 NH1 1 0.276178602624 0.836800000000
+NC2D1 NH2 1 0.302905564168 0.836800000000
+NC2D1 NH3 1 0.302905564168 0.836800000000
+NC2D1 NP 1 0.302905564168 0.836800000000
+NC2D1 NR1 1 0.302905564168 0.836800000000
+NC2D1 NR2 1 0.302905564168 0.836800000000
+NC2D1 NR3 1 0.302905564168 0.836800000000
+NC2D1 NY 1 0.302905564168 0.836800000000
+NC2D1 O 1 0.262815121851 0.648182492821
+NC2D1 OB 1 0.262815121851 0.648182492821
+NC2D1 OC 1 0.289542083396 0.648182492821
+NC2D1 OH1 1 0.295778374423 0.729745256593
+NC2D1 OS 1 0.295778374423 0.729745256593
+NC2D1 S 1 0.316269044940 1.255200000000
+NC2D1 SM 1 0.314041798144 1.153449199575
+NC2D1 SS 1 0.334087019303 1.282790109098
+NC2D1 HT 1 0.158089977534 0.401315181871
+NC2D1 OT 1 0.295618012653 0.729745256593
+NC2D1 OX 1 0.289542083396 0.648182492821
+NC2D1 HX 1 0.158089977534 0.401315181871
+NC2D1 LIT 1 0.253683409990 0.090320146678
+NC2D1 SOD 1 0.263772837973 0.405222074029
+NC2D1 MG 1 0.243660799411 0.229167118060
+NC2D1 POT 1 0.295221562724 0.551907505294
+NC2D1 CAL 1 0.259875156082 0.648182492821
+NC2D1 RUB 1 0.307360057758 0.724690057887
+NC2D1 CES 1 0.325178032121 0.815611750774
+NC2D1 BAR 1 0.306469159040 0.724690057887
+NC2D1 ZN 1 0.235197261589 0.935570841786
+NC2D1 CAD 1 0.258984257363 0.648182492821
+NC2D1 CLA 1 0.340323310330 0.724690057887
+NC2D1 HGA1 1 0.257469729543 0.396929091904
+NC2D1 HGA2 1 0.257469729543 0.350058555102
+NC2D1 HGA3 1 0.257469729543 0.289876023155
+NC2D1 HGA4 1 0.249451641079 0.329448489449
+NC2D1 HGA5 1 0.250342539797 0.301712530731
+NC2D1 HGA6 1 0.255687932106 0.313101890125
+NC2D1 HGA7 1 0.253906134670 0.324091246411
+NC2D1 HGAAM0 1 0.252124337234 0.313101890125
+NC2D1 HGAAM1 1 0.252124337234 0.313101890125
+NC2D1 HGAAM2 1 0.250342539797 0.374228336714
+NC2D1 HGP1 1 0.158089977534 0.401315181871
+NC2D1 HGP2 1 0.158089977534 0.401315181871
+NC2D1 HGP3 1 0.178179743628 0.591706954497
+NC2D1 HGP4 1 0.158089977534 0.401315181871
+NC2D1 HGP5 1 0.200452211582 0.401315181871
+NC2D1 HGPAM1 1 0.216042939149 0.177512086349
+NC2D1 HGPAM2 1 0.216042939149 0.187114168357
+NC2D1 HGPAM3 1 0.215597489790 0.204973301676
+NC2D1 HGR51 1 0.259091165210 0.324091246411
+NC2D1 HGR52 1 0.218270185944 0.401315181871
+NC2D1 HGR53 1 0.200452211582 0.401315181871
+NC2D1 HGR61 1 0.259091165210 0.324091246411
+NC2D1 HGR62 1 0.236088160307 0.401315181871
+NC2D1 HGR63 1 0.218270185944 0.401315181871
+NC2D1 HGR71 1 0.259091165210 0.324091246411
+NC2D1 CG1T1 1 0.302014665450 0.764653902364
+NC2D1 CG1T2 1 0.315600870901 0.601099715388
+NC2D1 CG1N1 1 0.304687361604 0.793858183809
+NC2D1 CG2D1 1 0.324287133403 0.487934054561
+NC2D1 CG2D2 1 0.323396234685 0.473365563598
+NC2D1 CG2D1O 1 0.324287133403 0.487934054561
+NC2D1 CG2D2O 1 0.324287133403 0.487934054561
+NC2D1 CG2DC1 1 0.324287133403 0.487934054561
+NC2D1 CG2DC2 1 0.324287133403 0.487934054561
+NC2D1 CG2DC3 1 0.323396234685 0.473365563598
+NC2D1 CG25C1 1 0.324287133403 0.487934054561
+NC2D1 CG25C2 1 0.324287133403 0.487934054561
+NC2D1 CG251O 1 0.324287133403 0.487934054561
+NC2D1 CG252O 1 0.324287133403 0.487934054561
+NC2D1 CG2N1 1 0.316269044940 0.620587489400
+NC2D1 CG2N2 1 0.316269044940 0.620587489400
+NC2D1 CG2O1 1 0.316269044940 0.620587489400
+NC2D1 CG2O2 1 0.289542083396 0.585760000000
+NC2D1 CG2O3 1 0.316269044940 0.495057556250
+NC2D1 CG2O4 1 0.298451070577 0.458334236120
+NC2D1 CG2O5 1 0.316269044940 0.561342505072
+NC2D1 CG2O6 1 0.316269044940 0.495057556250
+NC2D1 CG2O7 1 0.277336770957 0.450630591061
+NC2D1 CG2R51 1 0.325178032121 0.418400000000
+NC2D1 CG2R52 1 0.334087019303 0.264619394603
+NC2D1 CG2R53 1 0.334087019303 0.264619394603
+NC2D1 CG2R57 1 0.325178032121 0.418400000000
+NC2D1 CG2R61 1 0.315591961914 0.495057556250
+NC2D1 CG2R62 1 0.307360057758 0.561342505072
+NC2D1 CG2R63 1 0.307360057758 0.591706954497
+NC2D1 CG2R64 1 0.325178032121 0.374228336714
+NC2D1 CG2R66 1 0.307360057758 0.495057556250
+NC2D1 CG2R67 1 0.315591961914 0.495057556250
+NC2D1 CG2RC0 1 0.303796462886 0.588740986173
+NC2D1 CG2R71 1 0.315805777606 0.484333016013
+NC2D1 CG2RC7 1 0.303796462886 0.588740986173
+NC2D1 CG301 1 0.307360057758 0.187114168357
+NC2D1 CG302 1 0.342996006484 0.264619394603
+NC2D1 CG311 1 0.307360057758 0.187114168357
+NC2D1 CG312 1 0.320723538531 0.383469934154
+NC2D1 CG314 1 0.307360057758 0.187114168357
+NC2D1 CG321 1 0.307360057758 0.187114168357
+NC2D1 CG322 1 0.307360057758 0.458334236120
+NC2D1 CG323 1 0.334087019303 0.620587489400
+NC2D1 CG324 1 0.307360057758 0.187114168357
+NC2D1 CG331 1 0.307360057758 0.187114168357
+NC2D1 CG334 1 0.307360057758 0.187114168357
+NC2D1 CG3C50 1 0.307360057758 0.187114168357
+NC2D1 CG3C51 1 0.307360057758 0.187114168357
+NC2D1 CG3C52 1 0.307360057758 0.187114168357
+NC2D1 CG3C53 1 0.307360057758 0.187114168357
+NC2D1 CG3C54 1 0.307360057758 0.187114168357
+NC2D1 CG3C31 1 0.307360057758 0.187114168357
+NC2D1 CG3C41 1 0.307360057758 0.187114168357
+NC2D1 CG3RC1 1 0.307360057758 0.187114168357
+NC2D1 CG3AM0 1 0.313596348785 0.495057556250
+NC2D1 CG3AM1 1 0.314487247504 0.522581432506
+NC2D1 CG3AM2 1 0.315378146222 0.529238789206
+NC2D1 NG1T1 1 0.297560171859 0.793858183809
+NC2D1 NG2D1 1 0.302905564168 0.836800000000
+NC2D1 NG2S0 1 0.302905564168 0.018711416836
+NC2D1 NG2S1 1 0.276178602624 0.836800000000
+NC2D1 NG2S2 1 0.302905564168 0.836800000000
+NC2D1 NG2S3 1 0.302905564168 0.836800000000
+NC2D1 NG2O1 1 0.302905564168 0.836800000000
+NC2D1 NG2P1 1 0.302905564168 0.836800000000
+NC2D1 NG2R43 1 0.302905564168 0.836800000000
+NC2D1 NG2R50 1 0.302905564168 0.836800000000
+NC2D1 NG2R51 1 0.302905564168 0.836800000000
+NC2D1 NG2R52 1 0.302905564168 0.836800000000
+NC2D1 NG2R53 1 0.302905564168 0.836800000000
+NC2D1 NG2R57 1 0.302905564168 0.836800000000
+NC2D1 NG2R60 1 0.306469159040 0.458334236120
+NC2D1 NG2R61 1 0.302905564168 0.836800000000
+NC2D1 NG2R62 1 0.321614437249 0.418400000000
+NC2D1 NG2R67 1 0.302905564168 0.836800000000
+NC2D1 NG2RC0 1 0.302905564168 0.836800000000
+NC2D1 NG301 1 0.316269044940 0.350058555102
+NC2D1 NG311 1 0.316269044940 0.396929091904
+NC2D1 NG321 1 0.315378146222 0.458334236120
+NC2D1 NG331 1 0.314487247504 0.495057556250
+NC2D1 NG3C51 1 0.302905564168 0.836800000000
+NC2D1 NG3N1 1 0.320723538531 0.458334236120
+NC2D1 NG3P0 1 0.302905564168 0.836800000000
+NC2D1 NG3P1 1 0.302905564168 0.836800000000
+NC2D1 NG3P2 1 0.302905564168 0.836800000000
+NC2D1 NG3P3 1 0.302905564168 0.836800000000
+NC2D1 OG2D1 1 0.262815121851 0.648182492821
+NC2D1 OG2D2 1 0.289542083396 0.648182492821
+NC2D1 OG2D3 1 0.262815121851 0.648182492821
+NC2D1 OG2D4 1 0.289542083396 0.648182492821
+NC2D1 OG2D5 1 0.288829364421 0.760061344893
+NC2D1 OG2N1 1 0.289542083396 0.648182492821
+NC2D1 OG2P1 1 0.289542083396 0.648182492821
+NC2D1 OG2R50 1 0.289542083396 0.648182492821
+NC2D1 OG3R60 1 0.285087589805 0.591706954497
+NC2D1 OG301 1 0.285087589805 0.591706954497
+NC2D1 OG302 1 0.285087589805 0.591706954497
+NC2D1 OG303 1 0.285087589805 0.591706954497
+NC2D1 OG304 1 0.285087589805 0.591706954497
+NC2D1 OG311 1 0.295332925064 0.820106692766
+NC2D1 OG312 1 0.293996576986 0.648182492821
+NC2D1 OG3C31 1 0.285087589805 0.591706954497
+NC2D1 OG3C51 1 0.285087589805 0.591706954497
+NC2D1 OG3C61 1 0.285087589805 0.591706954497
+NC2D1 SG2D1 1 0.320723538531 1.406471374753
+NC2D1 SG2R50 1 0.316269044940 1.255200000000
+NC2D1 SG311 1 0.316269044940 1.255200000000
+NC2D1 SG301 1 0.314041798144 1.153449199575
+NC2D1 SG302 1 0.334087019303 1.282790109098
+NC2D1 SG3O1 1 0.325178032121 1.282790109098
+NC2D1 SG3O2 1 0.316269044940 1.106982348549
+NC2D1 SG3O3 1 0.316269044940 1.106982348549
+NC2D1 FGA1 1 0.283305792369 0.687501354180
+NC2D1 FGA2 1 0.283305792369 0.606319203061
+NC2D1 FGA3 1 0.280633096214 0.582763765517
+NC2D1 FGP1 1 0.280633096214 0.582763765517
+NC2D1 FGR1 1 0.289542083396 0.648182492821
+NC2D1 CLGA1 1 0.308250956477 1.095856615438
+NC2D1 CLGA3 1 0.308250956477 1.041807598360
+NC2D1 CLGR1 1 0.310032753913 1.058477578412
+NC2D1 BRGA1 1 0.313596348785 1.296364985643
+NC2D1 BRGA2 1 0.320723538531 1.362211707482
+NC2D1 BRGA3 1 0.316269044940 1.375002708361
+NC2D1 BRGR1 1 0.322505335967 1.212638406121
+NC2D1 IGR1 1 0.333196120584 1.387675812285
+NC2D1 PG0 1 0.329632525712 1.431148193584
+NC2D1 PG1 1 0.329632525712 1.431148193584
+NC2D1 PG2 1 0.329632525712 1.431148193584
+NC2D1 ALG1 1 0.316269044940 1.508562653654
+NC2D1 CC301 1 0.307360057758 0.187114168357
+NC2D1 CC3062 1 0.307360057758 0.187114168357
+NC2D1 CC311 1 0.307360057758 0.187114168357
+NC2D1 CC3161 1 0.307360057758 0.187114168357
+NC2D1 CC3162 1 0.307360057758 0.187114168357
+NC2D1 CC3163 1 0.307360057758 0.187114168357
+NC2D1 CC321 1 0.307360057758 0.187114168357
+NC2D1 CC3261 1 0.307360057758 0.187114168357
+NC2D1 CC3263 1 0.307360057758 0.187114168357
+NC2D1 CC331 1 0.307360057758 0.187114168357
+NC2D1 CC2O1 1 0.316269044940 0.620587489400
+NC2D1 CC2O2 1 0.316269044940 0.495057556250
+NC2D1 CC2O3 1 0.316269044940 0.561342505072
+NC2D1 CC2O4 1 0.298451070577 0.458334236120
+NC2D1 OC2D1 1 0.262815121851 0.648182492821
+NC2D1 OC2D2 1 0.289542083396 0.648182492821
+NC2D1 OC2D3 1 0.262815121851 0.648182492821
+NC2D1 OC2D4 1 0.262815121851 0.648182492821
+NC2D1 OC3C61 1 0.285087589805 0.591706954497
+NC2D1 OC311 1 0.295332925064 0.820106692766
+NC2D1 NC2D1 1 0.276178602624 0.836800000000
+NC2D1 HCP1 1 0.158089977534 0.401315181871
+NC2D1 HCA1 1 0.257469729543 0.396929091904
+NC2D1 HCA2 1 0.257469729543 0.350058555102
+NC2D1 HCA3 1 0.257469729543 0.289876023155
+NC2D1 CC312 1 0.307360057758 0.187114168357
+NC2D1 CC322 1 0.307360057758 0.187114168357
+NC2D1 HCR1 1 0.209361198763 0.401315181871
+NC2D1 HCA3M 1 0.257469729543 0.289876023155
+NC2D1 CC321C 1 0.307360057758 0.187114168357
+NC2D1 CC321D 1 0.307360057758 0.187114168357
+NC2D1 CC311C 1 0.307360057758 0.187114168357
+NC2D1 CC311D 1 0.307360057758 0.187114168357
+NC2D1 OC301 1 0.285087589805 0.591706954497
+NC2D1 OC302 1 0.285087589805 0.591706954497
+NC2D1 HCP1M 1 0.158089977534 0.401315181871
+NC2D1 OC311M 1 0.295332925064 0.820106692766
+NC2D1 OC3C5M 1 0.285087589805 0.591706954497
+NC2D1 CC322C 1 0.307360057758 0.187114168357
+NC2D1 HCA2C2 1 0.253906134670 0.350058555102
+NC2D1 CC312C 1 0.307360057758 0.187114168357
+NC2D1 HCA1C2 1 0.257469729543 0.396929091904
+NC2D1 OC3C51 1 0.285087589805 0.591706954497
+NC2D1 CC3152 1 0.307360057758 0.187114168357
+NC2D1 CC3051 1 0.307360057758 0.187114168357
+NC2D1 CC3251 1 0.307360057758 0.187114168357
+NC2D1 CC3151 1 0.307360057758 0.187114168357
+NC2D1 CC3153 1 0.307360057758 0.187114168357
+NC2D1 OC2DP 1 0.289542083396 0.648182492821
+NC2D1 OC312 1 0.295778374423 0.729745256593
+NC2D1 OC30P 1 0.295778374423 0.729745256593
+NC2D1 PC 1 0.329632525712 1.431148193584
+NC2D1 SC 1 0.325178032121 1.282790109098
+NC2D1 CC312D 1 0.307360057758 0.187114168357
+NC2D1 OC303 1 0.285087589805 0.591706954497
+NC2D1 HN1 1 0.158089977534 0.401315181871
+NC2D1 HN2 1 0.158089977534 0.401315181871
+NC2D1 HN3 1 0.236088160307 0.401315181871
+NC2D1 HN4 1 0.158089977534 0.401315181871
+NC2D1 HN5 1 0.158089977534 0.401315181871
+NC2D1 HN6 1 0.255687932106 0.277535162457
+NC2D1 HN7 1 0.255687932106 0.277535162457
+NC2D1 HN8 1 0.257469729543 0.313101890125
+NC2D1 HN9 1 0.257469729543 0.289876023155
+NC2D1 NN1 1 0.302905564168 0.836800000000
+NC2D1 NN2 1 0.302905564168 0.836800000000
+NC2D1 NN2B 1 0.302905564168 0.836800000000
+NC2D1 NN2G 1 0.302905564168 0.836800000000
+NC2D1 NN2U 1 0.302905564168 0.836800000000
+NC2D1 NN3 1 0.302905564168 0.836800000000
+NC2D1 NN3A 1 0.302905564168 0.836800000000
+NC2D1 NN3G 1 0.302905564168 0.836800000000
+NC2D1 NN4 1 0.302905564168 0.836800000000
+NC2D1 NN6 1 0.302905564168 0.836800000000
+NC2D1 ON1 1 0.289542083396 0.648182492821
+NC2D1 ON1C 1 0.289542083396 0.648182492821
+NC2D1 ON2 1 0.295778374423 0.729745256593
+NC2D1 ON3 1 0.289542083396 0.648182492821
+NC2D1 ON4 1 0.295778374423 0.729745256593
+NC2D1 ON5 1 0.295778374423 0.729745256593
+NC2D1 ON6 1 0.295778374423 0.729745256593
+NC2D1 ON6B 1 0.295778374423 0.729745256593
+NC2D1 CN1 1 0.307360057758 0.591706954497
+NC2D1 CN1T 1 0.307360057758 0.591706954497
+NC2D1 CN2 1 0.307360057758 0.591706954497
+NC2D1 CN3 1 0.307360057758 0.561342505072
+NC2D1 CN3T 1 0.307360057758 0.561342505072
+NC2D1 CN4 1 0.307360057758 0.512433254190
+NC2D1 CN5 1 0.307360057758 0.512433254190
+NC2D1 CN5G 1 0.307360057758 0.512433254190
+NC2D1 CN7 1 0.307360057758 0.187114168357
+NC2D1 CN7B 1 0.307360057758 0.187114168357
+NC2D1 CN8 1 0.307360057758 0.187114168357
+NC2D1 CN8B 1 0.307360057758 0.187114168357
+NC2D1 CN9 1 0.307360057758 0.187114168357
+NC2D1 P 1 0.329632525712 1.431148193584
+NC2D1 P2 1 0.329632525712 1.431148193584
+NC2D1 HOL 1 0.158089977534 0.401315181871
+NC2D1 HAL1 1 0.255687932106 0.277535162457
+NC2D1 HAL2 1 0.257469729543 0.313101890125
+NC2D1 HAL3 1 0.257469729543 0.289876023155
+NC2D1 HBL 1 0.255687932106 0.277535162457
+NC2D1 HCL 1 0.158089977534 0.401315181871
+NC2D1 HL 1 0.200452211582 0.401315181871
+NC2D1 HEL1 1 0.249451641079 0.329448489449
+NC2D1 HEL2 1 0.250342539797 0.301712530731
+NC2D1 CL 1 0.316269044940 0.495057556250
+NC2D1 CCL 1 0.316269044940 0.495057556250
+NC2D1 CTL1 1 0.307360057758 0.187114168357
+NC2D1 CTL2 1 0.307360057758 0.187114168357
+NC2D1 CTL3 1 0.307360057758 0.187114168357
+NC2D1 CTL5 1 0.307360057758 0.187114168357
+NC2D1 CEL1 1 0.324287133403 0.487934054561
+NC2D1 CEL2 1 0.323396234685 0.473365563598
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+NC2D1 OHL 1 0.295778374423 0.729745256593
+NC2D1 OSL 1 0.285087589805 0.591706954497
+NC2D1 OSLP 1 0.285087589805 0.591706954497
+NC2D1 NH3L 1 0.302905564168 0.836800000000
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+NC2D1 SL 1 0.325178032121 1.282790109098
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+CC322 CN8 1 0.338541512893 0.041840000000
+CC322 CN8B 1 0.338541512893 0.041840000000
+CC322 CN9 1 0.338541512893 0.041840000000
+CC322 P 1 0.360813980847 0.320014464673
+CC322 P2 1 0.360813980847 0.320014464673
+CC322 HOL 1 0.189271432669 0.089736802707
+CC322 HAL1 1 0.286869387241 0.062058748940
+CC322 HAL2 1 0.288651184677 0.070011711020
+CC322 HAL3 1 0.288651184677 0.064818249282
+CC322 HBL 1 0.286869387241 0.062058748940
+CC322 HCL 1 0.189271432669 0.089736802707
+CC322 HL 1 0.231633666716 0.089736802707
+CC322 HEL1 1 0.280633096214 0.073666921749
+CC322 HEL2 1 0.281523994932 0.067464972838
+CC322 CL 1 0.347450500075 0.110698234855
+CC322 CCL 1 0.347450500075 0.110698234855
+CC322 CTL1 1 0.338541512893 0.041840000000
+CC322 CTL2 1 0.338541512893 0.041840000000
+CC322 CTL3 1 0.338541512893 0.041840000000
+CC322 CTL5 1 0.338541512893 0.041840000000
+CC322 CEL1 1 0.355468588538 0.109105371453
+CC322 CEL2 1 0.354577689820 0.105847757841
+CC322 CRL1 1 0.338541512893 0.041840000000
+CC322 CRL2 1 0.338541512893 0.041840000000
+CC322 OBL 1 0.293996576986 0.144938011577
+CC322 OCL 1 0.320723538531 0.144938011577
+CC322 O2L 1 0.320723538531 0.144938011577
+CC322 OHL 1 0.326959829558 0.163176000000
+CC322 OSL 1 0.316269044940 0.132309697301
+CC322 OSLP 1 0.316269044940 0.132309697301
+CC322 NH3L 1 0.334087019303 0.187114168357
+CC322 NTL 1 0.334087019303 0.187114168357
+CC322 SL 1 0.356359487256 0.286840588481
+CC322 PL 1 0.360813980847 0.320014464673
+CC322 HCA1A 1 0.288651184677 0.088756043175
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+CC322 CC30A 1 0.338541512893 0.041840000000
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+CC322 CC32A 1 0.338541512893 0.041840000000
+CC322 CC33A 1 0.338541512893 0.041840000000
+CC322 CC326A 1 0.338541512893 0.041840000000
+CC322 HCA25A 1 0.285087589805 0.078275472531
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+CC322 OC305A 1 0.316269044940 0.132309697301
+CC322 OC30A 1 0.316269044940 0.132309697301
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+CC322 CPB 1 0.329632525712 0.125520000000
+CC322 CPM 1 0.329632525712 0.125520000000
+CC322 CM 1 0.356359487256 0.138767581228
+CC322 CST 1 0.308518226092 0.100764063435
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+CC322 OM 1 0.320723538531 0.144938011577
+CC322 OST 1 0.320010819556 0.169954883425
+CC322 FE 1 0.227179173126 0.000000000000
+CC322 ON2B 1 0.326959829558 0.163176000000
+CC322 SP 1 0.365268474438 0.280671252536
+CC321C C 1 0.347450500075 0.138767581228
+CC321C CA 1 0.346773417049 0.110698234855
+CC321C CC 1 0.347450500075 0.110698234855
+CC321C CD 1 0.347450500075 0.110698234855
+CC321C CE1 1 0.355468588538 0.109105371453
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+CC321C CP1 1 0.338541512893 0.041840000000
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+CC321C CPH1 1 0.329632525712 0.093557084179
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+CC321C CS 1 0.365268474438 0.138767581228
+CC321C CPT 1 0.334977918021 0.131646486622
+CC321C CY 1 0.346559601357 0.113045454929
+CC321C CAI 1 0.346559601357 0.113045454929
+CC321C CT 1 0.338541512893 0.041840000000
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+CC321C CT2A 1 0.338541512893 0.041840000000
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+CC321C H 1 0.189271432669 0.089736802707
+CC321C HA 1 0.286869387241 0.062058748940
+CC321C HB1 1 0.286869387241 0.062058748940
+CC321C HB2 1 0.288651184677 0.070011711020
+CC321C HE1 1 0.280633096214 0.073666921749
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+CC321C HC 1 0.189271432669 0.089736802707
+CC321C HP 1 0.290272620344 0.072469005789
+CC321C HR1 1 0.249451641079 0.089736802707
+CC321C HR2 1 0.231633666716 0.089736802707
+CC321C HR3 1 0.300054688270 0.036952087465
+CC321C HS 1 0.209361198763 0.132309697301
+CC321C HA1 1 0.288651184677 0.088756043175
+CC321C HA2 1 0.288651184677 0.077149148019
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+CC321C N 1 0.334087019303 0.004184000000
+CC321C NC2 1 0.334087019303 0.187114168357
+CC321C NH1 1 0.307360057758 0.187114168357
+CC321C NH2 1 0.334087019303 0.187114168357
+CC321C NH3 1 0.334087019303 0.187114168357
+CC321C NP 1 0.334087019303 0.187114168357
+CC321C NR1 1 0.334087019303 0.187114168357
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+CC321C NY 1 0.334087019303 0.187114168357
+CC321C O 1 0.293996576986 0.144938011577
+CC321C OB 1 0.293996576986 0.144938011577
+CC321C OC 1 0.320723538531 0.144938011577
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+CC321C OS 1 0.326959829558 0.163176000000
+CC321C S 1 0.347450500075 0.280671252536
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+CC321C OT 1 0.326799467788 0.163176000000
+CC321C OX 1 0.320723538531 0.144938011577
+CC321C HX 1 0.189271432669 0.089736802707
+CC321C LIT 1 0.284864865125 0.020196198771
+CC321C SOD 1 0.294954293108 0.090610410351
+CC321C MG 1 0.274842254546 0.051243325419
+CC321C POT 1 0.326403017859 0.123410269913
+CC321C CAL 1 0.291056611216 0.144938011577
+CC321C RUB 1 0.338541512893 0.162045623205
+CC321C CES 1 0.356359487256 0.182376331798
+CC321C BAR 1 0.337650614175 0.162045623205
+CC321C ZN 1 0.266378716724 0.209200000000
+CC321C CAD 1 0.290165712498 0.144938011577
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+CC321C HGA1 1 0.288651184677 0.088756043175
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+CC321C HGA6 1 0.286869387241 0.070011711020
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+CC321C HGR63 1 0.249451641079 0.089736802707
+CC321C HGR71 1 0.290272620344 0.072469005789
+CC321C CG1T1 1 0.333196120584 0.170981810495
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+CC321C CG251O 1 0.355468588538 0.109105371453
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+CC321C NG2S0 1 0.334087019303 0.004184000000
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+CC321C NG301 1 0.347450500075 0.078275472531
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+CC321C NN1 1 0.334087019303 0.187114168357
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+CC321C NN2U 1 0.334087019303 0.187114168357
+CC321C NN3 1 0.334087019303 0.187114168357
+CC321C NN3A 1 0.334087019303 0.187114168357
+CC321C NN3G 1 0.334087019303 0.187114168357
+CC321C NN4 1 0.334087019303 0.187114168357
+CC321C NN6 1 0.334087019303 0.187114168357
+CC321C ON1 1 0.320723538531 0.144938011577
+CC321C ON1C 1 0.320723538531 0.144938011577
+CC321C ON2 1 0.326959829558 0.163176000000
+CC321C ON3 1 0.320723538531 0.144938011577
+CC321C ON4 1 0.326959829558 0.163176000000
+CC321C ON5 1 0.326959829558 0.163176000000
+CC321C ON6 1 0.326959829558 0.163176000000
+CC321C ON6B 1 0.326959829558 0.163176000000
+CC321C CN1 1 0.338541512893 0.132309697301
+CC321C CN1T 1 0.338541512893 0.132309697301
+CC321C CN2 1 0.338541512893 0.132309697301
+CC321C CN3 1 0.338541512893 0.125520000000
+CC321C CN3T 1 0.338541512893 0.125520000000
+CC321C CN4 1 0.338541512893 0.114583559030
+CC321C CN5 1 0.338541512893 0.114583559030
+CC321C CN5G 1 0.338541512893 0.114583559030
+CC321C CN7 1 0.338541512893 0.041840000000
+CC321C CN7B 1 0.338541512893 0.041840000000
+CC321C CN8 1 0.338541512893 0.041840000000
+CC321C CN8B 1 0.338541512893 0.041840000000
+CC321C CN9 1 0.338541512893 0.041840000000
+CC321C P 1 0.360813980847 0.320014464673
+CC321C P2 1 0.360813980847 0.320014464673
+CC321C HOL 1 0.189271432669 0.089736802707
+CC321C HAL1 1 0.286869387241 0.062058748940
+CC321C HAL2 1 0.288651184677 0.070011711020
+CC321C HAL3 1 0.288651184677 0.064818249282
+CC321C HBL 1 0.286869387241 0.062058748940
+CC321C HCL 1 0.189271432669 0.089736802707
+CC321C HL 1 0.231633666716 0.089736802707
+CC321C HEL1 1 0.280633096214 0.073666921749
+CC321C HEL2 1 0.281523994932 0.067464972838
+CC321C CL 1 0.347450500075 0.110698234855
+CC321C CCL 1 0.347450500075 0.110698234855
+CC321C CTL1 1 0.338541512893 0.041840000000
+CC321C CTL2 1 0.338541512893 0.041840000000
+CC321C CTL3 1 0.338541512893 0.041840000000
+CC321C CTL5 1 0.338541512893 0.041840000000
+CC321C CEL1 1 0.355468588538 0.109105371453
+CC321C CEL2 1 0.354577689820 0.105847757841
+CC321C CRL1 1 0.338541512893 0.041840000000
+CC321C CRL2 1 0.338541512893 0.041840000000
+CC321C OBL 1 0.293996576986 0.144938011577
+CC321C OCL 1 0.320723538531 0.144938011577
+CC321C O2L 1 0.320723538531 0.144938011577
+CC321C OHL 1 0.326959829558 0.163176000000
+CC321C OSL 1 0.316269044940 0.132309697301
+CC321C OSLP 1 0.316269044940 0.132309697301
+CC321C NH3L 1 0.334087019303 0.187114168357
+CC321C NTL 1 0.334087019303 0.187114168357
+CC321C SL 1 0.356359487256 0.286840588481
+CC321C PL 1 0.360813980847 0.320014464673
+CC321C HCA1A 1 0.288651184677 0.088756043175
+CC321C HCA2A 1 0.288651184677 0.078275472531
+CC321C HCA3A 1 0.288651184677 0.064818249282
+CC321C CC30A 1 0.338541512893 0.041840000000
+CC321C CC31A 1 0.338541512893 0.041840000000
+CC321C CC32A 1 0.338541512893 0.041840000000
+CC321C CC33A 1 0.338541512893 0.041840000000
+CC321C CC326A 1 0.338541512893 0.041840000000
+CC321C HCA25A 1 0.285087589805 0.078275472531
+CC321C CC325A 1 0.338541512893 0.041840000000
+CC321C CC325B 1 0.338541512893 0.041840000000
+CC321C OC305A 1 0.316269044940 0.132309697301
+CC321C OC30A 1 0.316269044940 0.132309697301
+CC321C CPA 1 0.329632525712 0.125520000000
+CC321C CPB 1 0.329632525712 0.125520000000
+CC321C CPM 1 0.329632525712 0.125520000000
+CC321C CM 1 0.356359487256 0.138767581228
+CC321C CST 1 0.308518226092 0.100764063435
+CC321C NPH 1 0.334087019303 0.187114168357
+CC321C OM 1 0.320723538531 0.144938011577
+CC321C OST 1 0.320010819556 0.169954883425
+CC321C FE 1 0.227179173126 0.000000000000
+CC321C ON2B 1 0.326959829558 0.163176000000
+CC321C SP 1 0.365268474438 0.280671252536
+CC321D C 1 0.347450500075 0.138767581228
+CC321D CA 1 0.346773417049 0.110698234855
+CC321D CC 1 0.347450500075 0.110698234855
+CC321D CD 1 0.347450500075 0.110698234855
+CC321D CE1 1 0.355468588538 0.109105371453
+CC321D CE2 1 0.354577689820 0.105847757841
+CC321D CP1 1 0.338541512893 0.041840000000
+CC321D CP2 1 0.338541512893 0.041840000000
+CC321D CP3 1 0.338541512893 0.041840000000
+CC321D CPH1 1 0.329632525712 0.093557084179
+CC321D CPH2 1 0.329632525712 0.093557084179
+CC321D CS 1 0.365268474438 0.138767581228
+CC321D CPT 1 0.334977918021 0.131646486622
+CC321D CY 1 0.346559601357 0.113045454929
+CC321D CAI 1 0.346559601357 0.113045454929
+CC321D CT 1 0.338541512893 0.041840000000
+CC321D CT1 1 0.338541512893 0.041840000000
+CC321D CT2 1 0.338541512893 0.041840000000
+CC321D CT2A 1 0.338541512893 0.041840000000
+CC321D CT3 1 0.338541512893 0.041840000000
+CC321D H 1 0.189271432669 0.089736802707
+CC321D HA 1 0.286869387241 0.062058748940
+CC321D HB1 1 0.286869387241 0.062058748940
+CC321D HB2 1 0.288651184677 0.070011711020
+CC321D HE1 1 0.280633096214 0.073666921749
+CC321D HE2 1 0.281523994932 0.067464972838
+CC321D HC 1 0.189271432669 0.089736802707
+CC321D HP 1 0.290272620344 0.072469005789
+CC321D HR1 1 0.249451641079 0.089736802707
+CC321D HR2 1 0.231633666716 0.089736802707
+CC321D HR3 1 0.300054688270 0.036952087465
+CC321D HS 1 0.209361198763 0.132309697301
+CC321D HA1 1 0.288651184677 0.088756043175
+CC321D HA2 1 0.288651184677 0.077149148019
+CC321D HA3 1 0.288651184677 0.064818249282
+CC321D N 1 0.334087019303 0.004184000000
+CC321D NC2 1 0.334087019303 0.187114168357
+CC321D NH1 1 0.307360057758 0.187114168357
+CC321D NH2 1 0.334087019303 0.187114168357
+CC321D NH3 1 0.334087019303 0.187114168357
+CC321D NP 1 0.334087019303 0.187114168357
+CC321D NR1 1 0.334087019303 0.187114168357
+CC321D NR2 1 0.334087019303 0.187114168357
+CC321D NR3 1 0.334087019303 0.187114168357
+CC321D NY 1 0.334087019303 0.187114168357
+CC321D O 1 0.293996576986 0.144938011577
+CC321D OB 1 0.293996576986 0.144938011577
+CC321D OC 1 0.320723538531 0.144938011577
+CC321D OH1 1 0.326959829558 0.163176000000
+CC321D OS 1 0.326959829558 0.163176000000
+CC321D S 1 0.347450500075 0.280671252536
+CC321D SM 1 0.345223253279 0.257919081884
+CC321D SS 1 0.365268474438 0.286840588481
+CC321D HT 1 0.189271432669 0.089736802707
+CC321D OT 1 0.326799467788 0.163176000000
+CC321D OX 1 0.320723538531 0.144938011577
+CC321D HX 1 0.189271432669 0.089736802707
+CC321D LIT 1 0.284864865125 0.020196198771
+CC321D SOD 1 0.294954293108 0.090610410351
+CC321D MG 1 0.274842254546 0.051243325419
+CC321D POT 1 0.326403017859 0.123410269913
+CC321D CAL 1 0.291056611216 0.144938011577
+CC321D RUB 1 0.338541512893 0.162045623205
+CC321D CES 1 0.356359487256 0.182376331798
+CC321D BAR 1 0.337650614175 0.162045623205
+CC321D ZN 1 0.266378716724 0.209200000000
+CC321D CAD 1 0.290165712498 0.144938011577
+CC321D CLA 1 0.371504765465 0.162045623205
+CC321D HGA1 1 0.288651184677 0.088756043175
+CC321D HGA2 1 0.288651184677 0.078275472531
+CC321D HGA3 1 0.288651184677 0.064818249282
+CC321D HGA4 1 0.280633096214 0.073666921749
+CC321D HGA5 1 0.281523994932 0.067464972838
+CC321D HGA6 1 0.286869387241 0.070011711020
+CC321D HGA7 1 0.285087589805 0.072469005789
+CC321D HGAAM0 1 0.283305792369 0.070011711020
+CC321D HGAAM1 1 0.283305792369 0.070011711020
+CC321D HGAAM2 1 0.281523994932 0.083680000000
+CC321D HGP1 1 0.189271432669 0.089736802707
+CC321D HGP2 1 0.189271432669 0.089736802707
+CC321D HGP3 1 0.209361198763 0.132309697301
+CC321D HGP4 1 0.189271432669 0.089736802707
+CC321D HGP5 1 0.231633666716 0.089736802707
+CC321D HGPAM1 1 0.247224394284 0.039692909190
+CC321D HGPAM2 1 0.247224394284 0.041840000000
+CC321D HGPAM3 1 0.246778944925 0.045833423612
+CC321D HGR51 1 0.290272620344 0.072469005789
+CC321D HGR52 1 0.249451641079 0.089736802707
+CC321D HGR53 1 0.231633666716 0.089736802707
+CC321D HGR61 1 0.290272620344 0.072469005789
+CC321D HGR62 1 0.267269615442 0.089736802707
+CC321D HGR63 1 0.249451641079 0.089736802707
+CC321D HGR71 1 0.290272620344 0.072469005789
+CC321D CG1T1 1 0.333196120584 0.170981810495
+CC321D CG1T2 1 0.346782326036 0.134409982486
+CC321D CG1N1 1 0.335868816739 0.177512086349
+CC321D CG2D1 1 0.355468588538 0.109105371453
+CC321D CG2D2 1 0.354577689820 0.105847757841
+CC321D CG2D1O 1 0.355468588538 0.109105371453
+CC321D CG2D2O 1 0.355468588538 0.109105371453
+CC321D CG2DC1 1 0.355468588538 0.109105371453
+CC321D CG2DC2 1 0.355468588538 0.109105371453
+CC321D CG2DC3 1 0.354577689820 0.105847757841
+CC321D CG25C1 1 0.355468588538 0.109105371453
+CC321D CG25C2 1 0.355468588538 0.109105371453
+CC321D CG251O 1 0.355468588538 0.109105371453
+CC321D CG252O 1 0.355468588538 0.109105371453
+CC321D CG2N1 1 0.347450500075 0.138767581228
+CC321D CG2N2 1 0.347450500075 0.138767581228
+CC321D CG2O1 1 0.347450500075 0.138767581228
+CC321D CG2O2 1 0.320723538531 0.130979917850
+CC321D CG2O3 1 0.347450500075 0.110698234855
+CC321D CG2O4 1 0.329632525712 0.102486650838
+CC321D CG2O5 1 0.347450500075 0.125520000000
+CC321D CG2O6 1 0.347450500075 0.110698234855
+CC321D CG2O7 1 0.308518226092 0.100764063435
+CC321D CG2R51 1 0.356359487256 0.093557084179
+CC321D CG2R52 1 0.365268474438 0.059170695450
+CC321D CG2R53 1 0.365268474438 0.059170695450
+CC321D CG2R57 1 0.356359487256 0.093557084179
+CC321D CG2R61 1 0.346773417049 0.110698234855
+CC321D CG2R62 1 0.338541512893 0.125520000000
+CC321D CG2R63 1 0.338541512893 0.132309697301
+CC321D CG2R64 1 0.356359487256 0.083680000000
+CC321D CG2R66 1 0.338541512893 0.110698234855
+CC321D CG2R67 1 0.346773417049 0.110698234855
+CC321D CG2RC0 1 0.334977918021 0.131646486622
+CC321D CG2R71 1 0.346987232741 0.108300154755
+CC321D CG2RC7 1 0.334977918021 0.131646486622
+CC321D CG301 1 0.338541512893 0.041840000000
+CC321D CG302 1 0.374177461619 0.059170695450
+CC321D CG311 1 0.338541512893 0.041840000000
+CC321D CG312 1 0.351904993665 0.085746484010
+CC321D CG314 1 0.338541512893 0.041840000000
+CC321D CG321 1 0.338541512893 0.041840000000
+CC321D CG322 1 0.338541512893 0.102486650838
+CC321D CG323 1 0.365268474438 0.138767581228
+CC321D CG324 1 0.338541512893 0.041840000000
+CC321D CG331 1 0.338541512893 0.041840000000
+CC321D CG334 1 0.338541512893 0.041840000000
+CC321D CG3C50 1 0.338541512893 0.041840000000
+CC321D CG3C51 1 0.338541512893 0.041840000000
+CC321D CG3C52 1 0.338541512893 0.041840000000
+CC321D CG3C53 1 0.338541512893 0.041840000000
+CC321D CG3C54 1 0.338541512893 0.041840000000
+CC321D CG3C31 1 0.338541512893 0.041840000000
+CC321D CG3C41 1 0.338541512893 0.041840000000
+CC321D CG3RC1 1 0.338541512893 0.041840000000
+CC321D CG3AM0 1 0.344777803920 0.110698234855
+CC321D CG3AM1 1 0.345668702638 0.116852760686
+CC321D CG3AM2 1 0.346559601357 0.118341390899
+CC321D NG1T1 1 0.328741626994 0.177512086349
+CC321D NG2D1 1 0.334087019303 0.187114168357
+CC321D NG2S0 1 0.334087019303 0.004184000000
+CC321D NG2S1 1 0.307360057758 0.187114168357
+CC321D NG2S2 1 0.334087019303 0.187114168357
+CC321D NG2S3 1 0.334087019303 0.187114168357
+CC321D NG2O1 1 0.334087019303 0.187114168357
+CC321D NG2P1 1 0.334087019303 0.187114168357
+CC321D NG2R43 1 0.334087019303 0.187114168357
+CC321D NG2R50 1 0.334087019303 0.187114168357
+CC321D NG2R51 1 0.334087019303 0.187114168357
+CC321D NG2R52 1 0.334087019303 0.187114168357
+CC321D NG2R53 1 0.334087019303 0.187114168357
+CC321D NG2R57 1 0.334087019303 0.187114168357
+CC321D NG2R60 1 0.337650614175 0.102486650838
+CC321D NG2R61 1 0.334087019303 0.187114168357
+CC321D NG2R62 1 0.352795892384 0.093557084179
+CC321D NG2R67 1 0.334087019303 0.187114168357
+CC321D NG2RC0 1 0.334087019303 0.187114168357
+CC321D NG301 1 0.347450500075 0.078275472531
+CC321D NG311 1 0.347450500075 0.088756043175
+CC321D NG321 1 0.346559601357 0.102486650838
+CC321D NG331 1 0.345668702638 0.110698234855
+CC321D NG3C51 1 0.334087019303 0.187114168357
+CC321D NG3N1 1 0.351904993665 0.102486650838
+CC321D NG3P0 1 0.334087019303 0.187114168357
+CC321D NG3P1 1 0.334087019303 0.187114168357
+CC321D NG3P2 1 0.334087019303 0.187114168357
+CC321D NG3P3 1 0.334087019303 0.187114168357
+CC321D OG2D1 1 0.293996576986 0.144938011577
+CC321D OG2D2 1 0.320723538531 0.144938011577
+CC321D OG2D3 1 0.293996576986 0.144938011577
+CC321D OG2D4 1 0.320723538531 0.144938011577
+CC321D OG2D5 1 0.320010819556 0.169954883425
+CC321D OG2N1 1 0.320723538531 0.144938011577
+CC321D OG2P1 1 0.320723538531 0.144938011577
+CC321D OG2R50 1 0.320723538531 0.144938011577
+CC321D OG3R60 1 0.316269044940 0.132309697301
+CC321D OG301 1 0.316269044940 0.132309697301
+CC321D OG302 1 0.316269044940 0.132309697301
+CC321D OG303 1 0.316269044940 0.132309697301
+CC321D OG304 1 0.316269044940 0.132309697301
+CC321D OG311 1 0.326514380198 0.183381431383
+CC321D OG312 1 0.325178032121 0.144938011577
+CC321D OG3C31 1 0.316269044940 0.132309697301
+CC321D OG3C51 1 0.316269044940 0.132309697301
+CC321D OG3C61 1 0.316269044940 0.132309697301
+CC321D SG2D1 1 0.351904993665 0.314496560236
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+CC321D SG311 1 0.347450500075 0.280671252536
+CC321D SG301 1 0.345223253279 0.257919081884
+CC321D SG302 1 0.365268474438 0.286840588481
+CC321D SG3O1 1 0.356359487256 0.286840588481
+CC321D SG3O2 1 0.347450500075 0.247528778125
+CC321D SG3O3 1 0.347450500075 0.247528778125
+CC321D FGA1 1 0.314487247504 0.153729976257
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+CC321D FGA3 1 0.311814551349 0.130309939452
+CC321D FGP1 1 0.311814551349 0.130309939452
+CC321D FGR1 1 0.320723538531 0.144938011577
+CC321D CLGA1 1 0.339432411611 0.245040988571
+CC321D CLGA3 1 0.339432411611 0.232955260941
+CC321D CLGR1 1 0.341214209048 0.236682781799
+CC321D BRGA1 1 0.344777803920 0.289876023155
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+CC321D BRGA3 1 0.347450500075 0.307459952514
+CC321D BRGR1 1 0.353686791102 0.271154190821
+CC321D IGR1 1 0.364377575719 0.310293744700
+CC321D PG0 1 0.360813980847 0.320014464673
+CC321D PG1 1 0.360813980847 0.320014464673
+CC321D PG2 1 0.360813980847 0.320014464673
+CC321D ALG1 1 0.347450500075 0.337324864189
+CC321D CC301 1 0.338541512893 0.041840000000
+CC321D CC3062 1 0.338541512893 0.041840000000
+CC321D CC311 1 0.338541512893 0.041840000000
+CC321D CC3161 1 0.338541512893 0.041840000000
+CC321D CC3162 1 0.338541512893 0.041840000000
+CC321D CC3163 1 0.338541512893 0.041840000000
+CC321D CC321 1 0.338541512893 0.041840000000
+CC321D CC3261 1 0.338541512893 0.041840000000
+CC321D CC3263 1 0.338541512893 0.041840000000
+CC321D CC331 1 0.338541512893 0.041840000000
+CC321D CC2O1 1 0.347450500075 0.138767581228
+CC321D CC2O2 1 0.347450500075 0.110698234855
+CC321D CC2O3 1 0.347450500075 0.125520000000
+CC321D CC2O4 1 0.329632525712 0.102486650838
+CC321D OC2D1 1 0.293996576986 0.144938011577
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+CC321D OC2D3 1 0.293996576986 0.144938011577
+CC321D OC2D4 1 0.293996576986 0.144938011577
+CC321D OC3C61 1 0.316269044940 0.132309697301
+CC321D OC311 1 0.326514380198 0.183381431383
+CC321D NC2D1 1 0.307360057758 0.187114168357
+CC321D HCP1 1 0.189271432669 0.089736802707
+CC321D HCA1 1 0.288651184677 0.088756043175
+CC321D HCA2 1 0.288651184677 0.078275472531
+CC321D HCA3 1 0.288651184677 0.064818249282
+CC321D CC312 1 0.338541512893 0.041840000000
+CC321D CC322 1 0.338541512893 0.041840000000
+CC321D HCR1 1 0.240542653898 0.089736802707
+CC321D HCA3M 1 0.288651184677 0.064818249282
+CC321D CC321C 1 0.338541512893 0.041840000000
+CC321D CC321D 1 0.338541512893 0.041840000000
+CC321D CC311C 1 0.338541512893 0.041840000000
+CC321D CC311D 1 0.338541512893 0.041840000000
+CC321D OC301 1 0.316269044940 0.132309697301
+CC321D OC302 1 0.316269044940 0.132309697301
+CC321D HCP1M 1 0.189271432669 0.089736802707
+CC321D OC311M 1 0.326514380198 0.183381431383
+CC321D OC3C5M 1 0.316269044940 0.132309697301
+CC321D CC322C 1 0.338541512893 0.041840000000
+CC321D HCA2C2 1 0.285087589805 0.078275472531
+CC321D CC312C 1 0.338541512893 0.041840000000
+CC321D HCA1C2 1 0.288651184677 0.088756043175
+CC321D OC3C51 1 0.316269044940 0.132309697301
+CC321D CC3152 1 0.338541512893 0.041840000000
+CC321D CC3051 1 0.338541512893 0.041840000000
+CC321D CC3251 1 0.338541512893 0.041840000000
+CC321D CC3151 1 0.338541512893 0.041840000000
+CC321D CC3153 1 0.338541512893 0.041840000000
+CC321D OC2DP 1 0.320723538531 0.144938011577
+CC321D OC312 1 0.326959829558 0.163176000000
+CC321D OC30P 1 0.326959829558 0.163176000000
+CC321D PC 1 0.360813980847 0.320014464673
+CC321D SC 1 0.356359487256 0.286840588481
+CC321D CC312D 1 0.338541512893 0.041840000000
+CC321D OC303 1 0.316269044940 0.132309697301
+CC321D HN1 1 0.189271432669 0.089736802707
+CC321D HN2 1 0.189271432669 0.089736802707
+CC321D HN3 1 0.267269615442 0.089736802707
+CC321D HN4 1 0.189271432669 0.089736802707
+CC321D HN5 1 0.189271432669 0.089736802707
+CC321D HN6 1 0.286869387241 0.062058748940
+CC321D HN7 1 0.286869387241 0.062058748940
+CC321D HN8 1 0.288651184677 0.070011711020
+CC321D HN9 1 0.288651184677 0.064818249282
+CC321D NN1 1 0.334087019303 0.187114168357
+CC321D NN2 1 0.334087019303 0.187114168357
+CC321D NN2B 1 0.334087019303 0.187114168357
+CC321D NN2G 1 0.334087019303 0.187114168357
+CC321D NN2U 1 0.334087019303 0.187114168357
+CC321D NN3 1 0.334087019303 0.187114168357
+CC321D NN3A 1 0.334087019303 0.187114168357
+CC321D NN3G 1 0.334087019303 0.187114168357
+CC321D NN4 1 0.334087019303 0.187114168357
+CC321D NN6 1 0.334087019303 0.187114168357
+CC321D ON1 1 0.320723538531 0.144938011577
+CC321D ON1C 1 0.320723538531 0.144938011577
+CC321D ON2 1 0.326959829558 0.163176000000
+CC321D ON3 1 0.320723538531 0.144938011577
+CC321D ON4 1 0.326959829558 0.163176000000
+CC321D ON5 1 0.326959829558 0.163176000000
+CC321D ON6 1 0.326959829558 0.163176000000
+CC321D ON6B 1 0.326959829558 0.163176000000
+CC321D CN1 1 0.338541512893 0.132309697301
+CC321D CN1T 1 0.338541512893 0.132309697301
+CC321D CN2 1 0.338541512893 0.132309697301
+CC321D CN3 1 0.338541512893 0.125520000000
+CC321D CN3T 1 0.338541512893 0.125520000000
+CC321D CN4 1 0.338541512893 0.114583559030
+CC321D CN5 1 0.338541512893 0.114583559030
+CC321D CN5G 1 0.338541512893 0.114583559030
+CC321D CN7 1 0.338541512893 0.041840000000
+CC321D CN7B 1 0.338541512893 0.041840000000
+CC321D CN8 1 0.338541512893 0.041840000000
+CC321D CN8B 1 0.338541512893 0.041840000000
+CC321D CN9 1 0.338541512893 0.041840000000
+CC321D P 1 0.360813980847 0.320014464673
+CC321D P2 1 0.360813980847 0.320014464673
+CC321D HOL 1 0.189271432669 0.089736802707
+CC321D HAL1 1 0.286869387241 0.062058748940
+CC321D HAL2 1 0.288651184677 0.070011711020
+CC321D HAL3 1 0.288651184677 0.064818249282
+CC321D HBL 1 0.286869387241 0.062058748940
+CC321D HCL 1 0.189271432669 0.089736802707
+CC321D HL 1 0.231633666716 0.089736802707
+CC321D HEL1 1 0.280633096214 0.073666921749
+CC321D HEL2 1 0.281523994932 0.067464972838
+CC321D CL 1 0.347450500075 0.110698234855
+CC321D CCL 1 0.347450500075 0.110698234855
+CC321D CTL1 1 0.338541512893 0.041840000000
+CC321D CTL2 1 0.338541512893 0.041840000000
+CC321D CTL3 1 0.338541512893 0.041840000000
+CC321D CTL5 1 0.338541512893 0.041840000000
+CC321D CEL1 1 0.355468588538 0.109105371453
+CC321D CEL2 1 0.354577689820 0.105847757841
+CC321D CRL1 1 0.338541512893 0.041840000000
+CC321D CRL2 1 0.338541512893 0.041840000000
+CC321D OBL 1 0.293996576986 0.144938011577
+CC321D OCL 1 0.320723538531 0.144938011577
+CC321D O2L 1 0.320723538531 0.144938011577
+CC321D OHL 1 0.326959829558 0.163176000000
+CC321D OSL 1 0.316269044940 0.132309697301
+CC321D OSLP 1 0.316269044940 0.132309697301
+CC321D NH3L 1 0.334087019303 0.187114168357
+CC321D NTL 1 0.334087019303 0.187114168357
+CC321D SL 1 0.356359487256 0.286840588481
+CC321D PL 1 0.360813980847 0.320014464673
+CC321D HCA1A 1 0.288651184677 0.088756043175
+CC321D HCA2A 1 0.288651184677 0.078275472531
+CC321D HCA3A 1 0.288651184677 0.064818249282
+CC321D CC30A 1 0.338541512893 0.041840000000
+CC321D CC31A 1 0.338541512893 0.041840000000
+CC321D CC32A 1 0.338541512893 0.041840000000
+CC321D CC33A 1 0.338541512893 0.041840000000
+CC321D CC326A 1 0.338541512893 0.041840000000
+CC321D HCA25A 1 0.285087589805 0.078275472531
+CC321D CC325A 1 0.338541512893 0.041840000000
+CC321D CC325B 1 0.338541512893 0.041840000000
+CC321D OC305A 1 0.316269044940 0.132309697301
+CC321D OC30A 1 0.316269044940 0.132309697301
+CC321D CPA 1 0.329632525712 0.125520000000
+CC321D CPB 1 0.329632525712 0.125520000000
+CC321D CPM 1 0.329632525712 0.125520000000
+CC321D CM 1 0.356359487256 0.138767581228
+CC321D CST 1 0.308518226092 0.100764063435
+CC321D NPH 1 0.334087019303 0.187114168357
+CC321D OM 1 0.320723538531 0.144938011577
+CC321D OST 1 0.320010819556 0.169954883425
+CC321D FE 1 0.227179173126 0.000000000000
+CC321D ON2B 1 0.326959829558 0.163176000000
+CC321D SP 1 0.365268474438 0.280671252536
+CC311C C 1 0.347450500075 0.138767581228
+CC311C CA 1 0.346773417049 0.110698234855
+CC311C CC 1 0.347450500075 0.110698234855
+CC311C CD 1 0.347450500075 0.110698234855
+CC311C CE1 1 0.355468588538 0.109105371453
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+CC311C CP1 1 0.338541512893 0.041840000000
+CC311C CP2 1 0.338541512893 0.041840000000
+CC311C CP3 1 0.338541512893 0.041840000000
+CC311C CPH1 1 0.329632525712 0.093557084179
+CC311C CPH2 1 0.329632525712 0.093557084179
+CC311C CS 1 0.365268474438 0.138767581228
+CC311C CPT 1 0.334977918021 0.131646486622
+CC311C CY 1 0.346559601357 0.113045454929
+CC311C CAI 1 0.346559601357 0.113045454929
+CC311C CT 1 0.338541512893 0.041840000000
+CC311C CT1 1 0.338541512893 0.041840000000
+CC311C CT2 1 0.338541512893 0.041840000000
+CC311C CT2A 1 0.338541512893 0.041840000000
+CC311C CT3 1 0.338541512893 0.041840000000
+CC311C H 1 0.189271432669 0.089736802707
+CC311C HA 1 0.286869387241 0.062058748940
+CC311C HB1 1 0.286869387241 0.062058748940
+CC311C HB2 1 0.288651184677 0.070011711020
+CC311C HE1 1 0.280633096214 0.073666921749
+CC311C HE2 1 0.281523994932 0.067464972838
+CC311C HC 1 0.189271432669 0.089736802707
+CC311C HP 1 0.290272620344 0.072469005789
+CC311C HR1 1 0.249451641079 0.089736802707
+CC311C HR2 1 0.231633666716 0.089736802707
+CC311C HR3 1 0.300054688270 0.036952087465
+CC311C HS 1 0.209361198763 0.132309697301
+CC311C HA1 1 0.288651184677 0.088756043175
+CC311C HA2 1 0.288651184677 0.077149148019
+CC311C HA3 1 0.288651184677 0.064818249282
+CC311C N 1 0.334087019303 0.004184000000
+CC311C NC2 1 0.334087019303 0.187114168357
+CC311C NH1 1 0.307360057758 0.187114168357
+CC311C NH2 1 0.334087019303 0.187114168357
+CC311C NH3 1 0.334087019303 0.187114168357
+CC311C NP 1 0.334087019303 0.187114168357
+CC311C NR1 1 0.334087019303 0.187114168357
+CC311C NR2 1 0.334087019303 0.187114168357
+CC311C NR3 1 0.334087019303 0.187114168357
+CC311C NY 1 0.334087019303 0.187114168357
+CC311C O 1 0.293996576986 0.144938011577
+CC311C OB 1 0.293996576986 0.144938011577
+CC311C OC 1 0.320723538531 0.144938011577
+CC311C OH1 1 0.326959829558 0.163176000000
+CC311C OS 1 0.326959829558 0.163176000000
+CC311C S 1 0.347450500075 0.280671252536
+CC311C SM 1 0.345223253279 0.257919081884
+CC311C SS 1 0.365268474438 0.286840588481
+CC311C HT 1 0.189271432669 0.089736802707
+CC311C OT 1 0.326799467788 0.163176000000
+CC311C OX 1 0.320723538531 0.144938011577
+CC311C HX 1 0.189271432669 0.089736802707
+CC311C LIT 1 0.284864865125 0.020196198771
+CC311C SOD 1 0.294954293108 0.090610410351
+CC311C MG 1 0.274842254546 0.051243325419
+CC311C POT 1 0.326403017859 0.123410269913
+CC311C CAL 1 0.291056611216 0.144938011577
+CC311C RUB 1 0.338541512893 0.162045623205
+CC311C CES 1 0.356359487256 0.182376331798
+CC311C BAR 1 0.337650614175 0.162045623205
+CC311C ZN 1 0.266378716724 0.209200000000
+CC311C CAD 1 0.290165712498 0.144938011577
+CC311C CLA 1 0.371504765465 0.162045623205
+CC311C HGA1 1 0.288651184677 0.088756043175
+CC311C HGA2 1 0.288651184677 0.078275472531
+CC311C HGA3 1 0.288651184677 0.064818249282
+CC311C HGA4 1 0.280633096214 0.073666921749
+CC311C HGA5 1 0.281523994932 0.067464972838
+CC311C HGA6 1 0.286869387241 0.070011711020
+CC311C HGA7 1 0.285087589805 0.072469005789
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+CC311C HGAAM1 1 0.283305792369 0.070011711020
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+CC311C HGP1 1 0.189271432669 0.089736802707
+CC311C HGP2 1 0.189271432669 0.089736802707
+CC311C HGP3 1 0.209361198763 0.132309697301
+CC311C HGP4 1 0.189271432669 0.089736802707
+CC311C HGP5 1 0.231633666716 0.089736802707
+CC311C HGPAM1 1 0.247224394284 0.039692909190
+CC311C HGPAM2 1 0.247224394284 0.041840000000
+CC311C HGPAM3 1 0.246778944925 0.045833423612
+CC311C HGR51 1 0.290272620344 0.072469005789
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+CC311C HGR53 1 0.231633666716 0.089736802707
+CC311C HGR61 1 0.290272620344 0.072469005789
+CC311C HGR62 1 0.267269615442 0.089736802707
+CC311C HGR63 1 0.249451641079 0.089736802707
+CC311C HGR71 1 0.290272620344 0.072469005789
+CC311C CG1T1 1 0.333196120584 0.170981810495
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+CC311C CG2D1O 1 0.355468588538 0.109105371453
+CC311C CG2D2O 1 0.355468588538 0.109105371453
+CC311C CG2DC1 1 0.355468588538 0.109105371453
+CC311C CG2DC2 1 0.355468588538 0.109105371453
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+CC311C CG25C1 1 0.355468588538 0.109105371453
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+CC311C CG251O 1 0.355468588538 0.109105371453
+CC311C CG252O 1 0.355468588538 0.109105371453
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+CC311C CG2N2 1 0.347450500075 0.138767581228
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+CC311C CG2R53 1 0.365268474438 0.059170695450
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+CC311C CG2R64 1 0.356359487256 0.083680000000
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+CC311C CG302 1 0.374177461619 0.059170695450
+CC311C CG311 1 0.338541512893 0.041840000000
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+CC311C CG321 1 0.338541512893 0.041840000000
+CC311C CG322 1 0.338541512893 0.102486650838
+CC311C CG323 1 0.365268474438 0.138767581228
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+CC311C CG331 1 0.338541512893 0.041840000000
+CC311C CG334 1 0.338541512893 0.041840000000
+CC311C CG3C50 1 0.338541512893 0.041840000000
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+CC311C CG3C52 1 0.338541512893 0.041840000000
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+CC311C NG1T1 1 0.328741626994 0.177512086349
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+CC311C NG2S0 1 0.334087019303 0.004184000000
+CC311C NG2S1 1 0.307360057758 0.187114168357
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+CC311C NG2O1 1 0.334087019303 0.187114168357
+CC311C NG2P1 1 0.334087019303 0.187114168357
+CC311C NG2R43 1 0.334087019303 0.187114168357
+CC311C NG2R50 1 0.334087019303 0.187114168357
+CC311C NG2R51 1 0.334087019303 0.187114168357
+CC311C NG2R52 1 0.334087019303 0.187114168357
+CC311C NG2R53 1 0.334087019303 0.187114168357
+CC311C NG2R57 1 0.334087019303 0.187114168357
+CC311C NG2R60 1 0.337650614175 0.102486650838
+CC311C NG2R61 1 0.334087019303 0.187114168357
+CC311C NG2R62 1 0.352795892384 0.093557084179
+CC311C NG2R67 1 0.334087019303 0.187114168357
+CC311C NG2RC0 1 0.334087019303 0.187114168357
+CC311C NG301 1 0.347450500075 0.078275472531
+CC311C NG311 1 0.347450500075 0.088756043175
+CC311C NG321 1 0.346559601357 0.102486650838
+CC311C NG331 1 0.345668702638 0.110698234855
+CC311C NG3C51 1 0.334087019303 0.187114168357
+CC311C NG3N1 1 0.351904993665 0.102486650838
+CC311C NG3P0 1 0.334087019303 0.187114168357
+CC311C NG3P1 1 0.334087019303 0.187114168357
+CC311C NG3P2 1 0.334087019303 0.187114168357
+CC311C NG3P3 1 0.334087019303 0.187114168357
+CC311C OG2D1 1 0.293996576986 0.144938011577
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+CC311C OG2D5 1 0.320010819556 0.169954883425
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+CC311C OG2P1 1 0.320723538531 0.144938011577
+CC311C OG2R50 1 0.320723538531 0.144938011577
+CC311C OG3R60 1 0.316269044940 0.132309697301
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+CC311C OG302 1 0.316269044940 0.132309697301
+CC311C OG303 1 0.316269044940 0.132309697301
+CC311C OG304 1 0.316269044940 0.132309697301
+CC311C OG311 1 0.326514380198 0.183381431383
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+CC311C SG2D1 1 0.351904993665 0.314496560236
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+CC311C FGA1 1 0.314487247504 0.153729976257
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+CC311C CLGA1 1 0.339432411611 0.245040988571
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+CC311C CLGR1 1 0.341214209048 0.236682781799
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+CC311C IGR1 1 0.364377575719 0.310293744700
+CC311C PG0 1 0.360813980847 0.320014464673
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+CC311C PG2 1 0.360813980847 0.320014464673
+CC311C ALG1 1 0.347450500075 0.337324864189
+CC311C CC301 1 0.338541512893 0.041840000000
+CC311C CC3062 1 0.338541512893 0.041840000000
+CC311C CC311 1 0.338541512893 0.041840000000
+CC311C CC3161 1 0.338541512893 0.041840000000
+CC311C CC3162 1 0.338541512893 0.041840000000
+CC311C CC3163 1 0.338541512893 0.041840000000
+CC311C CC321 1 0.338541512893 0.041840000000
+CC311C CC3261 1 0.338541512893 0.041840000000
+CC311C CC3263 1 0.338541512893 0.041840000000
+CC311C CC331 1 0.338541512893 0.041840000000
+CC311C CC2O1 1 0.347450500075 0.138767581228
+CC311C CC2O2 1 0.347450500075 0.110698234855
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+CC311C OC2D4 1 0.293996576986 0.144938011577
+CC311C OC3C61 1 0.316269044940 0.132309697301
+CC311C OC311 1 0.326514380198 0.183381431383
+CC311C NC2D1 1 0.307360057758 0.187114168357
+CC311C HCP1 1 0.189271432669 0.089736802707
+CC311C HCA1 1 0.288651184677 0.088756043175
+CC311C HCA2 1 0.288651184677 0.078275472531
+CC311C HCA3 1 0.288651184677 0.064818249282
+CC311C CC312 1 0.338541512893 0.041840000000
+CC311C CC322 1 0.338541512893 0.041840000000
+CC311C HCR1 1 0.240542653898 0.089736802707
+CC311C HCA3M 1 0.288651184677 0.064818249282
+CC311C CC321C 1 0.338541512893 0.041840000000
+CC311C CC321D 1 0.338541512893 0.041840000000
+CC311C CC311C 1 0.338541512893 0.041840000000
+CC311C CC311D 1 0.338541512893 0.041840000000
+CC311C OC301 1 0.316269044940 0.132309697301
+CC311C OC302 1 0.316269044940 0.132309697301
+CC311C HCP1M 1 0.189271432669 0.089736802707
+CC311C OC311M 1 0.326514380198 0.183381431383
+CC311C OC3C5M 1 0.316269044940 0.132309697301
+CC311C CC322C 1 0.338541512893 0.041840000000
+CC311C HCA2C2 1 0.285087589805 0.078275472531
+CC311C CC312C 1 0.338541512893 0.041840000000
+CC311C HCA1C2 1 0.288651184677 0.088756043175
+CC311C OC3C51 1 0.316269044940 0.132309697301
+CC311C CC3152 1 0.338541512893 0.041840000000
+CC311C CC3051 1 0.338541512893 0.041840000000
+CC311C CC3251 1 0.338541512893 0.041840000000
+CC311C CC3151 1 0.338541512893 0.041840000000
+CC311C CC3153 1 0.338541512893 0.041840000000
+CC311C OC2DP 1 0.320723538531 0.144938011577
+CC311C OC312 1 0.326959829558 0.163176000000
+CC311C OC30P 1 0.326959829558 0.163176000000
+CC311C PC 1 0.360813980847 0.320014464673
+CC311C SC 1 0.356359487256 0.286840588481
+CC311C CC312D 1 0.338541512893 0.041840000000
+CC311C OC303 1 0.316269044940 0.132309697301
+CC311C HN1 1 0.189271432669 0.089736802707
+CC311C HN2 1 0.189271432669 0.089736802707
+CC311C HN3 1 0.267269615442 0.089736802707
+CC311C HN4 1 0.189271432669 0.089736802707
+CC311C HN5 1 0.189271432669 0.089736802707
+CC311C HN6 1 0.286869387241 0.062058748940
+CC311C HN7 1 0.286869387241 0.062058748940
+CC311C HN8 1 0.288651184677 0.070011711020
+CC311C HN9 1 0.288651184677 0.064818249282
+CC311C NN1 1 0.334087019303 0.187114168357
+CC311C NN2 1 0.334087019303 0.187114168357
+CC311C NN2B 1 0.334087019303 0.187114168357
+CC311C NN2G 1 0.334087019303 0.187114168357
+CC311C NN2U 1 0.334087019303 0.187114168357
+CC311C NN3 1 0.334087019303 0.187114168357
+CC311C NN3A 1 0.334087019303 0.187114168357
+CC311C NN3G 1 0.334087019303 0.187114168357
+CC311C NN4 1 0.334087019303 0.187114168357
+CC311C NN6 1 0.334087019303 0.187114168357
+CC311C ON1 1 0.320723538531 0.144938011577
+CC311C ON1C 1 0.320723538531 0.144938011577
+CC311C ON2 1 0.326959829558 0.163176000000
+CC311C ON3 1 0.320723538531 0.144938011577
+CC311C ON4 1 0.326959829558 0.163176000000
+CC311C ON5 1 0.326959829558 0.163176000000
+CC311C ON6 1 0.326959829558 0.163176000000
+CC311C ON6B 1 0.326959829558 0.163176000000
+CC311C CN1 1 0.338541512893 0.132309697301
+CC311C CN1T 1 0.338541512893 0.132309697301
+CC311C CN2 1 0.338541512893 0.132309697301
+CC311C CN3 1 0.338541512893 0.125520000000
+CC311C CN3T 1 0.338541512893 0.125520000000
+CC311C CN4 1 0.338541512893 0.114583559030
+CC311C CN5 1 0.338541512893 0.114583559030
+CC311C CN5G 1 0.338541512893 0.114583559030
+CC311C CN7 1 0.338541512893 0.041840000000
+CC311C CN7B 1 0.338541512893 0.041840000000
+CC311C CN8 1 0.338541512893 0.041840000000
+CC311C CN8B 1 0.338541512893 0.041840000000
+CC311C CN9 1 0.338541512893 0.041840000000
+CC311C P 1 0.360813980847 0.320014464673
+CC311C P2 1 0.360813980847 0.320014464673
+CC311C HOL 1 0.189271432669 0.089736802707
+CC311C HAL1 1 0.286869387241 0.062058748940
+CC311C HAL2 1 0.288651184677 0.070011711020
+CC311C HAL3 1 0.288651184677 0.064818249282
+CC311C HBL 1 0.286869387241 0.062058748940
+CC311C HCL 1 0.189271432669 0.089736802707
+CC311C HL 1 0.231633666716 0.089736802707
+CC311C HEL1 1 0.280633096214 0.073666921749
+CC311C HEL2 1 0.281523994932 0.067464972838
+CC311C CL 1 0.347450500075 0.110698234855
+CC311C CCL 1 0.347450500075 0.110698234855
+CC311C CTL1 1 0.338541512893 0.041840000000
+CC311C CTL2 1 0.338541512893 0.041840000000
+CC311C CTL3 1 0.338541512893 0.041840000000
+CC311C CTL5 1 0.338541512893 0.041840000000
+CC311C CEL1 1 0.355468588538 0.109105371453
+CC311C CEL2 1 0.354577689820 0.105847757841
+CC311C CRL1 1 0.338541512893 0.041840000000
+CC311C CRL2 1 0.338541512893 0.041840000000
+CC311C OBL 1 0.293996576986 0.144938011577
+CC311C OCL 1 0.320723538531 0.144938011577
+CC311C O2L 1 0.320723538531 0.144938011577
+CC311C OHL 1 0.326959829558 0.163176000000
+CC311C OSL 1 0.316269044940 0.132309697301
+CC311C OSLP 1 0.316269044940 0.132309697301
+CC311C NH3L 1 0.334087019303 0.187114168357
+CC311C NTL 1 0.334087019303 0.187114168357
+CC311C SL 1 0.356359487256 0.286840588481
+CC311C PL 1 0.360813980847 0.320014464673
+CC311C HCA1A 1 0.288651184677 0.088756043175
+CC311C HCA2A 1 0.288651184677 0.078275472531
+CC311C HCA3A 1 0.288651184677 0.064818249282
+CC311C CC30A 1 0.338541512893 0.041840000000
+CC311C CC31A 1 0.338541512893 0.041840000000
+CC311C CC32A 1 0.338541512893 0.041840000000
+CC311C CC33A 1 0.338541512893 0.041840000000
+CC311C CC326A 1 0.338541512893 0.041840000000
+CC311C HCA25A 1 0.285087589805 0.078275472531
+CC311C CC325A 1 0.338541512893 0.041840000000
+CC311C CC325B 1 0.338541512893 0.041840000000
+CC311C OC305A 1 0.316269044940 0.132309697301
+CC311C OC30A 1 0.316269044940 0.132309697301
+CC311C CPA 1 0.329632525712 0.125520000000
+CC311C CPB 1 0.329632525712 0.125520000000
+CC311C CPM 1 0.329632525712 0.125520000000
+CC311C CM 1 0.356359487256 0.138767581228
+CC311C CST 1 0.308518226092 0.100764063435
+CC311C NPH 1 0.334087019303 0.187114168357
+CC311C OM 1 0.320723538531 0.144938011577
+CC311C OST 1 0.320010819556 0.169954883425
+CC311C FE 1 0.227179173126 0.000000000000
+CC311C ON2B 1 0.326959829558 0.163176000000
+CC311C SP 1 0.365268474438 0.280671252536
+CC311D C 1 0.347450500075 0.138767581228
+CC311D CA 1 0.346773417049 0.110698234855
+CC311D CC 1 0.347450500075 0.110698234855
+CC311D CD 1 0.347450500075 0.110698234855
+CC311D CE1 1 0.355468588538 0.109105371453
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+CC311D CP1 1 0.338541512893 0.041840000000
+CC311D CP2 1 0.338541512893 0.041840000000
+CC311D CP3 1 0.338541512893 0.041840000000
+CC311D CPH1 1 0.329632525712 0.093557084179
+CC311D CPH2 1 0.329632525712 0.093557084179
+CC311D CS 1 0.365268474438 0.138767581228
+CC311D CPT 1 0.334977918021 0.131646486622
+CC311D CY 1 0.346559601357 0.113045454929
+CC311D CAI 1 0.346559601357 0.113045454929
+CC311D CT 1 0.338541512893 0.041840000000
+CC311D CT1 1 0.338541512893 0.041840000000
+CC311D CT2 1 0.338541512893 0.041840000000
+CC311D CT2A 1 0.338541512893 0.041840000000
+CC311D CT3 1 0.338541512893 0.041840000000
+CC311D H 1 0.189271432669 0.089736802707
+CC311D HA 1 0.286869387241 0.062058748940
+CC311D HB1 1 0.286869387241 0.062058748940
+CC311D HB2 1 0.288651184677 0.070011711020
+CC311D HE1 1 0.280633096214 0.073666921749
+CC311D HE2 1 0.281523994932 0.067464972838
+CC311D HC 1 0.189271432669 0.089736802707
+CC311D HP 1 0.290272620344 0.072469005789
+CC311D HR1 1 0.249451641079 0.089736802707
+CC311D HR2 1 0.231633666716 0.089736802707
+CC311D HR3 1 0.300054688270 0.036952087465
+CC311D HS 1 0.209361198763 0.132309697301
+CC311D HA1 1 0.288651184677 0.088756043175
+CC311D HA2 1 0.288651184677 0.077149148019
+CC311D HA3 1 0.288651184677 0.064818249282
+CC311D N 1 0.334087019303 0.004184000000
+CC311D NC2 1 0.334087019303 0.187114168357
+CC311D NH1 1 0.307360057758 0.187114168357
+CC311D NH2 1 0.334087019303 0.187114168357
+CC311D NH3 1 0.334087019303 0.187114168357
+CC311D NP 1 0.334087019303 0.187114168357
+CC311D NR1 1 0.334087019303 0.187114168357
+CC311D NR2 1 0.334087019303 0.187114168357
+CC311D NR3 1 0.334087019303 0.187114168357
+CC311D NY 1 0.334087019303 0.187114168357
+CC311D O 1 0.293996576986 0.144938011577
+CC311D OB 1 0.293996576986 0.144938011577
+CC311D OC 1 0.320723538531 0.144938011577
+CC311D OH1 1 0.326959829558 0.163176000000
+CC311D OS 1 0.326959829558 0.163176000000
+CC311D S 1 0.347450500075 0.280671252536
+CC311D SM 1 0.345223253279 0.257919081884
+CC311D SS 1 0.365268474438 0.286840588481
+CC311D HT 1 0.189271432669 0.089736802707
+CC311D OT 1 0.326799467788 0.163176000000
+CC311D OX 1 0.320723538531 0.144938011577
+CC311D HX 1 0.189271432669 0.089736802707
+CC311D LIT 1 0.284864865125 0.020196198771
+CC311D SOD 1 0.294954293108 0.090610410351
+CC311D MG 1 0.274842254546 0.051243325419
+CC311D POT 1 0.326403017859 0.123410269913
+CC311D CAL 1 0.291056611216 0.144938011577
+CC311D RUB 1 0.338541512893 0.162045623205
+CC311D CES 1 0.356359487256 0.182376331798
+CC311D BAR 1 0.337650614175 0.162045623205
+CC311D ZN 1 0.266378716724 0.209200000000
+CC311D CAD 1 0.290165712498 0.144938011577
+CC311D CLA 1 0.371504765465 0.162045623205
+CC311D HGA1 1 0.288651184677 0.088756043175
+CC311D HGA2 1 0.288651184677 0.078275472531
+CC311D HGA3 1 0.288651184677 0.064818249282
+CC311D HGA4 1 0.280633096214 0.073666921749
+CC311D HGA5 1 0.281523994932 0.067464972838
+CC311D HGA6 1 0.286869387241 0.070011711020
+CC311D HGA7 1 0.285087589805 0.072469005789
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+CC311D HGAAM1 1 0.283305792369 0.070011711020
+CC311D HGAAM2 1 0.281523994932 0.083680000000
+CC311D HGP1 1 0.189271432669 0.089736802707
+CC311D HGP2 1 0.189271432669 0.089736802707
+CC311D HGP3 1 0.209361198763 0.132309697301
+CC311D HGP4 1 0.189271432669 0.089736802707
+CC311D HGP5 1 0.231633666716 0.089736802707
+CC311D HGPAM1 1 0.247224394284 0.039692909190
+CC311D HGPAM2 1 0.247224394284 0.041840000000
+CC311D HGPAM3 1 0.246778944925 0.045833423612
+CC311D HGR51 1 0.290272620344 0.072469005789
+CC311D HGR52 1 0.249451641079 0.089736802707
+CC311D HGR53 1 0.231633666716 0.089736802707
+CC311D HGR61 1 0.290272620344 0.072469005789
+CC311D HGR62 1 0.267269615442 0.089736802707
+CC311D HGR63 1 0.249451641079 0.089736802707
+CC311D HGR71 1 0.290272620344 0.072469005789
+CC311D CG1T1 1 0.333196120584 0.170981810495
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+CC311D CG2D1O 1 0.355468588538 0.109105371453
+CC311D CG2D2O 1 0.355468588538 0.109105371453
+CC311D CG2DC1 1 0.355468588538 0.109105371453
+CC311D CG2DC2 1 0.355468588538 0.109105371453
+CC311D CG2DC3 1 0.354577689820 0.105847757841
+CC311D CG25C1 1 0.355468588538 0.109105371453
+CC311D CG25C2 1 0.355468588538 0.109105371453
+CC311D CG251O 1 0.355468588538 0.109105371453
+CC311D CG252O 1 0.355468588538 0.109105371453
+CC311D CG2N1 1 0.347450500075 0.138767581228
+CC311D CG2N2 1 0.347450500075 0.138767581228
+CC311D CG2O1 1 0.347450500075 0.138767581228
+CC311D CG2O2 1 0.320723538531 0.130979917850
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+CC311D CG2O4 1 0.329632525712 0.102486650838
+CC311D CG2O5 1 0.347450500075 0.125520000000
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+CC311D CG2O7 1 0.308518226092 0.100764063435
+CC311D CG2R51 1 0.356359487256 0.093557084179
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+CC311D CG2R53 1 0.365268474438 0.059170695450
+CC311D CG2R57 1 0.356359487256 0.093557084179
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+CC311D CG2R64 1 0.356359487256 0.083680000000
+CC311D CG2R66 1 0.338541512893 0.110698234855
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+CC311D CG301 1 0.338541512893 0.041840000000
+CC311D CG302 1 0.374177461619 0.059170695450
+CC311D CG311 1 0.338541512893 0.041840000000
+CC311D CG312 1 0.351904993665 0.085746484010
+CC311D CG314 1 0.338541512893 0.041840000000
+CC311D CG321 1 0.338541512893 0.041840000000
+CC311D CG322 1 0.338541512893 0.102486650838
+CC311D CG323 1 0.365268474438 0.138767581228
+CC311D CG324 1 0.338541512893 0.041840000000
+CC311D CG331 1 0.338541512893 0.041840000000
+CC311D CG334 1 0.338541512893 0.041840000000
+CC311D CG3C50 1 0.338541512893 0.041840000000
+CC311D CG3C51 1 0.338541512893 0.041840000000
+CC311D CG3C52 1 0.338541512893 0.041840000000
+CC311D CG3C53 1 0.338541512893 0.041840000000
+CC311D CG3C54 1 0.338541512893 0.041840000000
+CC311D CG3C31 1 0.338541512893 0.041840000000
+CC311D CG3C41 1 0.338541512893 0.041840000000
+CC311D CG3RC1 1 0.338541512893 0.041840000000
+CC311D CG3AM0 1 0.344777803920 0.110698234855
+CC311D CG3AM1 1 0.345668702638 0.116852760686
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+CC311D NG1T1 1 0.328741626994 0.177512086349
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+CC311D NG2S0 1 0.334087019303 0.004184000000
+CC311D NG2S1 1 0.307360057758 0.187114168357
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+CC311D NG2S3 1 0.334087019303 0.187114168357
+CC311D NG2O1 1 0.334087019303 0.187114168357
+CC311D NG2P1 1 0.334087019303 0.187114168357
+CC311D NG2R43 1 0.334087019303 0.187114168357
+CC311D NG2R50 1 0.334087019303 0.187114168357
+CC311D NG2R51 1 0.334087019303 0.187114168357
+CC311D NG2R52 1 0.334087019303 0.187114168357
+CC311D NG2R53 1 0.334087019303 0.187114168357
+CC311D NG2R57 1 0.334087019303 0.187114168357
+CC311D NG2R60 1 0.337650614175 0.102486650838
+CC311D NG2R61 1 0.334087019303 0.187114168357
+CC311D NG2R62 1 0.352795892384 0.093557084179
+CC311D NG2R67 1 0.334087019303 0.187114168357
+CC311D NG2RC0 1 0.334087019303 0.187114168357
+CC311D NG301 1 0.347450500075 0.078275472531
+CC311D NG311 1 0.347450500075 0.088756043175
+CC311D NG321 1 0.346559601357 0.102486650838
+CC311D NG331 1 0.345668702638 0.110698234855
+CC311D NG3C51 1 0.334087019303 0.187114168357
+CC311D NG3N1 1 0.351904993665 0.102486650838
+CC311D NG3P0 1 0.334087019303 0.187114168357
+CC311D NG3P1 1 0.334087019303 0.187114168357
+CC311D NG3P2 1 0.334087019303 0.187114168357
+CC311D NG3P3 1 0.334087019303 0.187114168357
+CC311D OG2D1 1 0.293996576986 0.144938011577
+CC311D OG2D2 1 0.320723538531 0.144938011577
+CC311D OG2D3 1 0.293996576986 0.144938011577
+CC311D OG2D4 1 0.320723538531 0.144938011577
+CC311D OG2D5 1 0.320010819556 0.169954883425
+CC311D OG2N1 1 0.320723538531 0.144938011577
+CC311D OG2P1 1 0.320723538531 0.144938011577
+CC311D OG2R50 1 0.320723538531 0.144938011577
+CC311D OG3R60 1 0.316269044940 0.132309697301
+CC311D OG301 1 0.316269044940 0.132309697301
+CC311D OG302 1 0.316269044940 0.132309697301
+CC311D OG303 1 0.316269044940 0.132309697301
+CC311D OG304 1 0.316269044940 0.132309697301
+CC311D OG311 1 0.326514380198 0.183381431383
+CC311D OG312 1 0.325178032121 0.144938011577
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+CC311D OG3C51 1 0.316269044940 0.132309697301
+CC311D OG3C61 1 0.316269044940 0.132309697301
+CC311D SG2D1 1 0.351904993665 0.314496560236
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+CC311D SG311 1 0.347450500075 0.280671252536
+CC311D SG301 1 0.345223253279 0.257919081884
+CC311D SG302 1 0.365268474438 0.286840588481
+CC311D SG3O1 1 0.356359487256 0.286840588481
+CC311D SG3O2 1 0.347450500075 0.247528778125
+CC311D SG3O3 1 0.347450500075 0.247528778125
+CC311D FGA1 1 0.314487247504 0.153729976257
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+CC311D FGA3 1 0.311814551349 0.130309939452
+CC311D FGP1 1 0.311814551349 0.130309939452
+CC311D FGR1 1 0.320723538531 0.144938011577
+CC311D CLGA1 1 0.339432411611 0.245040988571
+CC311D CLGA3 1 0.339432411611 0.232955260941
+CC311D CLGR1 1 0.341214209048 0.236682781799
+CC311D BRGA1 1 0.344777803920 0.289876023155
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+CC311D BRGR1 1 0.353686791102 0.271154190821
+CC311D IGR1 1 0.364377575719 0.310293744700
+CC311D PG0 1 0.360813980847 0.320014464673
+CC311D PG1 1 0.360813980847 0.320014464673
+CC311D PG2 1 0.360813980847 0.320014464673
+CC311D ALG1 1 0.347450500075 0.337324864189
+CC311D CC301 1 0.338541512893 0.041840000000
+CC311D CC3062 1 0.338541512893 0.041840000000
+CC311D CC311 1 0.338541512893 0.041840000000
+CC311D CC3161 1 0.338541512893 0.041840000000
+CC311D CC3162 1 0.338541512893 0.041840000000
+CC311D CC3163 1 0.338541512893 0.041840000000
+CC311D CC321 1 0.338541512893 0.041840000000
+CC311D CC3261 1 0.338541512893 0.041840000000
+CC311D CC3263 1 0.338541512893 0.041840000000
+CC311D CC331 1 0.338541512893 0.041840000000
+CC311D CC2O1 1 0.347450500075 0.138767581228
+CC311D CC2O2 1 0.347450500075 0.110698234855
+CC311D CC2O3 1 0.347450500075 0.125520000000
+CC311D CC2O4 1 0.329632525712 0.102486650838
+CC311D OC2D1 1 0.293996576986 0.144938011577
+CC311D OC2D2 1 0.320723538531 0.144938011577
+CC311D OC2D3 1 0.293996576986 0.144938011577
+CC311D OC2D4 1 0.293996576986 0.144938011577
+CC311D OC3C61 1 0.316269044940 0.132309697301
+CC311D OC311 1 0.326514380198 0.183381431383
+CC311D NC2D1 1 0.307360057758 0.187114168357
+CC311D HCP1 1 0.189271432669 0.089736802707
+CC311D HCA1 1 0.288651184677 0.088756043175
+CC311D HCA2 1 0.288651184677 0.078275472531
+CC311D HCA3 1 0.288651184677 0.064818249282
+CC311D CC312 1 0.338541512893 0.041840000000
+CC311D CC322 1 0.338541512893 0.041840000000
+CC311D HCR1 1 0.240542653898 0.089736802707
+CC311D HCA3M 1 0.288651184677 0.064818249282
+CC311D CC321C 1 0.338541512893 0.041840000000
+CC311D CC321D 1 0.338541512893 0.041840000000
+CC311D CC311C 1 0.338541512893 0.041840000000
+CC311D CC311D 1 0.338541512893 0.041840000000
+CC311D OC301 1 0.316269044940 0.132309697301
+CC311D OC302 1 0.316269044940 0.132309697301
+CC311D HCP1M 1 0.189271432669 0.089736802707
+CC311D OC311M 1 0.326514380198 0.183381431383
+CC311D OC3C5M 1 0.316269044940 0.132309697301
+CC311D CC322C 1 0.338541512893 0.041840000000
+CC311D HCA2C2 1 0.285087589805 0.078275472531
+CC311D CC312C 1 0.338541512893 0.041840000000
+CC311D HCA1C2 1 0.288651184677 0.088756043175
+CC311D OC3C51 1 0.316269044940 0.132309697301
+CC311D CC3152 1 0.338541512893 0.041840000000
+CC311D CC3051 1 0.338541512893 0.041840000000
+CC311D CC3251 1 0.338541512893 0.041840000000
+CC311D CC3151 1 0.338541512893 0.041840000000
+CC311D CC3153 1 0.338541512893 0.041840000000
+CC311D OC2DP 1 0.320723538531 0.144938011577
+CC311D OC312 1 0.326959829558 0.163176000000
+CC311D OC30P 1 0.326959829558 0.163176000000
+CC311D PC 1 0.360813980847 0.320014464673
+CC311D SC 1 0.356359487256 0.286840588481
+CC311D CC312D 1 0.338541512893 0.041840000000
+CC311D OC303 1 0.316269044940 0.132309697301
+CC311D HN1 1 0.189271432669 0.089736802707
+CC311D HN2 1 0.189271432669 0.089736802707
+CC311D HN3 1 0.267269615442 0.089736802707
+CC311D HN4 1 0.189271432669 0.089736802707
+CC311D HN5 1 0.189271432669 0.089736802707
+CC311D HN6 1 0.286869387241 0.062058748940
+CC311D HN7 1 0.286869387241 0.062058748940
+CC311D HN8 1 0.288651184677 0.070011711020
+CC311D HN9 1 0.288651184677 0.064818249282
+CC311D NN1 1 0.334087019303 0.187114168357
+CC311D NN2 1 0.334087019303 0.187114168357
+CC311D NN2B 1 0.334087019303 0.187114168357
+CC311D NN2G 1 0.334087019303 0.187114168357
+CC311D NN2U 1 0.334087019303 0.187114168357
+CC311D NN3 1 0.334087019303 0.187114168357
+CC311D NN3A 1 0.334087019303 0.187114168357
+CC311D NN3G 1 0.334087019303 0.187114168357
+CC311D NN4 1 0.334087019303 0.187114168357
+CC311D NN6 1 0.334087019303 0.187114168357
+CC311D ON1 1 0.320723538531 0.144938011577
+CC311D ON1C 1 0.320723538531 0.144938011577
+CC311D ON2 1 0.326959829558 0.163176000000
+CC311D ON3 1 0.320723538531 0.144938011577
+CC311D ON4 1 0.326959829558 0.163176000000
+CC311D ON5 1 0.326959829558 0.163176000000
+CC311D ON6 1 0.326959829558 0.163176000000
+CC311D ON6B 1 0.326959829558 0.163176000000
+CC311D CN1 1 0.338541512893 0.132309697301
+CC311D CN1T 1 0.338541512893 0.132309697301
+CC311D CN2 1 0.338541512893 0.132309697301
+CC311D CN3 1 0.338541512893 0.125520000000
+CC311D CN3T 1 0.338541512893 0.125520000000
+CC311D CN4 1 0.338541512893 0.114583559030
+CC311D CN5 1 0.338541512893 0.114583559030
+CC311D CN5G 1 0.338541512893 0.114583559030
+CC311D CN7 1 0.338541512893 0.041840000000
+CC311D CN7B 1 0.338541512893 0.041840000000
+CC311D CN8 1 0.338541512893 0.041840000000
+CC311D CN8B 1 0.338541512893 0.041840000000
+CC311D CN9 1 0.338541512893 0.041840000000
+CC311D P 1 0.360813980847 0.320014464673
+CC311D P2 1 0.360813980847 0.320014464673
+CC311D HOL 1 0.189271432669 0.089736802707
+CC311D HAL1 1 0.286869387241 0.062058748940
+CC311D HAL2 1 0.288651184677 0.070011711020
+CC311D HAL3 1 0.288651184677 0.064818249282
+CC311D HBL 1 0.286869387241 0.062058748940
+CC311D HCL 1 0.189271432669 0.089736802707
+CC311D HL 1 0.231633666716 0.089736802707
+CC311D HEL1 1 0.280633096214 0.073666921749
+CC311D HEL2 1 0.281523994932 0.067464972838
+CC311D CL 1 0.347450500075 0.110698234855
+CC311D CCL 1 0.347450500075 0.110698234855
+CC311D CTL1 1 0.338541512893 0.041840000000
+CC311D CTL2 1 0.338541512893 0.041840000000
+CC311D CTL3 1 0.338541512893 0.041840000000
+CC311D CTL5 1 0.338541512893 0.041840000000
+CC311D CEL1 1 0.355468588538 0.109105371453
+CC311D CEL2 1 0.354577689820 0.105847757841
+CC311D CRL1 1 0.338541512893 0.041840000000
+CC311D CRL2 1 0.338541512893 0.041840000000
+CC311D OBL 1 0.293996576986 0.144938011577
+CC311D OCL 1 0.320723538531 0.144938011577
+CC311D O2L 1 0.320723538531 0.144938011577
+CC311D OHL 1 0.326959829558 0.163176000000
+CC311D OSL 1 0.316269044940 0.132309697301
+CC311D OSLP 1 0.316269044940 0.132309697301
+CC311D NH3L 1 0.334087019303 0.187114168357
+CC311D NTL 1 0.334087019303 0.187114168357
+CC311D SL 1 0.356359487256 0.286840588481
+CC311D PL 1 0.360813980847 0.320014464673
+CC311D HCA1A 1 0.288651184677 0.088756043175
+CC311D HCA2A 1 0.288651184677 0.078275472531
+CC311D HCA3A 1 0.288651184677 0.064818249282
+CC311D CC30A 1 0.338541512893 0.041840000000
+CC311D CC31A 1 0.338541512893 0.041840000000
+CC311D CC32A 1 0.338541512893 0.041840000000
+CC311D CC33A 1 0.338541512893 0.041840000000
+CC311D CC326A 1 0.338541512893 0.041840000000
+CC311D HCA25A 1 0.285087589805 0.078275472531
+CC311D CC325A 1 0.338541512893 0.041840000000
+CC311D CC325B 1 0.338541512893 0.041840000000
+CC311D OC305A 1 0.316269044940 0.132309697301
+CC311D OC30A 1 0.316269044940 0.132309697301
+CC311D CPA 1 0.329632525712 0.125520000000
+CC311D CPB 1 0.329632525712 0.125520000000
+CC311D CPM 1 0.329632525712 0.125520000000
+CC311D CM 1 0.356359487256 0.138767581228
+CC311D CST 1 0.308518226092 0.100764063435
+CC311D NPH 1 0.334087019303 0.187114168357
+CC311D OM 1 0.320723538531 0.144938011577
+CC311D OST 1 0.320010819556 0.169954883425
+CC311D FE 1 0.227179173126 0.000000000000
+CC311D ON2B 1 0.326959829558 0.163176000000
+CC311D SP 1 0.365268474438 0.280671252536
+CC322C C 1 0.347450500075 0.138767581228
+CC322C CA 1 0.346773417049 0.110698234855
+CC322C CC 1 0.347450500075 0.110698234855
+CC322C CD 1 0.347450500075 0.110698234855
+CC322C CE1 1 0.355468588538 0.109105371453
+CC322C CE2 1 0.354577689820 0.105847757841
+CC322C CP1 1 0.338541512893 0.041840000000
+CC322C CP2 1 0.338541512893 0.041840000000
+CC322C CP3 1 0.338541512893 0.041840000000
+CC322C CPH1 1 0.329632525712 0.093557084179
+CC322C CPH2 1 0.329632525712 0.093557084179
+CC322C CS 1 0.365268474438 0.138767581228
+CC322C CPT 1 0.334977918021 0.131646486622
+CC322C CY 1 0.346559601357 0.113045454929
+CC322C CAI 1 0.346559601357 0.113045454929
+CC322C CT 1 0.338541512893 0.041840000000
+CC322C CT1 1 0.338541512893 0.041840000000
+CC322C CT2 1 0.338541512893 0.041840000000
+CC322C CT2A 1 0.338541512893 0.041840000000
+CC322C CT3 1 0.338541512893 0.041840000000
+CC322C H 1 0.189271432669 0.089736802707
+CC322C HA 1 0.286869387241 0.062058748940
+CC322C HB1 1 0.286869387241 0.062058748940
+CC322C HB2 1 0.288651184677 0.070011711020
+CC322C HE1 1 0.280633096214 0.073666921749
+CC322C HE2 1 0.281523994932 0.067464972838
+CC322C HC 1 0.189271432669 0.089736802707
+CC322C HP 1 0.290272620344 0.072469005789
+CC322C HR1 1 0.249451641079 0.089736802707
+CC322C HR2 1 0.231633666716 0.089736802707
+CC322C HR3 1 0.300054688270 0.036952087465
+CC322C HS 1 0.209361198763 0.132309697301
+CC322C HA1 1 0.288651184677 0.088756043175
+CC322C HA2 1 0.288651184677 0.077149148019
+CC322C HA3 1 0.288651184677 0.064818249282
+CC322C N 1 0.334087019303 0.004184000000
+CC322C NC2 1 0.334087019303 0.187114168357
+CC322C NH1 1 0.307360057758 0.187114168357
+CC322C NH2 1 0.334087019303 0.187114168357
+CC322C NH3 1 0.334087019303 0.187114168357
+CC322C NP 1 0.334087019303 0.187114168357
+CC322C NR1 1 0.334087019303 0.187114168357
+CC322C NR2 1 0.334087019303 0.187114168357
+CC322C NR3 1 0.334087019303 0.187114168357
+CC322C NY 1 0.334087019303 0.187114168357
+CC322C O 1 0.293996576986 0.144938011577
+CC322C OB 1 0.293996576986 0.144938011577
+CC322C OC 1 0.320723538531 0.144938011577
+CC322C OH1 1 0.326959829558 0.163176000000
+CC322C OS 1 0.326959829558 0.163176000000
+CC322C S 1 0.347450500075 0.280671252536
+CC322C SM 1 0.345223253279 0.257919081884
+CC322C SS 1 0.365268474438 0.286840588481
+CC322C HT 1 0.189271432669 0.089736802707
+CC322C OT 1 0.326799467788 0.163176000000
+CC322C OX 1 0.320723538531 0.144938011577
+CC322C HX 1 0.189271432669 0.089736802707
+CC322C LIT 1 0.284864865125 0.020196198771
+CC322C SOD 1 0.294954293108 0.090610410351
+CC322C MG 1 0.274842254546 0.051243325419
+CC322C POT 1 0.326403017859 0.123410269913
+CC322C CAL 1 0.291056611216 0.144938011577
+CC322C RUB 1 0.338541512893 0.162045623205
+CC322C CES 1 0.356359487256 0.182376331798
+CC322C BAR 1 0.337650614175 0.162045623205
+CC322C ZN 1 0.266378716724 0.209200000000
+CC322C CAD 1 0.290165712498 0.144938011577
+CC322C CLA 1 0.371504765465 0.162045623205
+CC322C HGA1 1 0.288651184677 0.088756043175
+CC322C HGA2 1 0.288651184677 0.078275472531
+CC322C HGA3 1 0.288651184677 0.064818249282
+CC322C HGA4 1 0.280633096214 0.073666921749
+CC322C HGA5 1 0.281523994932 0.067464972838
+CC322C HGA6 1 0.286869387241 0.070011711020
+CC322C HGA7 1 0.285087589805 0.072469005789
+CC322C HGAAM0 1 0.283305792369 0.070011711020
+CC322C HGAAM1 1 0.283305792369 0.070011711020
+CC322C HGAAM2 1 0.281523994932 0.083680000000
+CC322C HGP1 1 0.189271432669 0.089736802707
+CC322C HGP2 1 0.189271432669 0.089736802707
+CC322C HGP3 1 0.209361198763 0.132309697301
+CC322C HGP4 1 0.189271432669 0.089736802707
+CC322C HGP5 1 0.231633666716 0.089736802707
+CC322C HGPAM1 1 0.247224394284 0.039692909190
+CC322C HGPAM2 1 0.247224394284 0.041840000000
+CC322C HGPAM3 1 0.246778944925 0.045833423612
+CC322C HGR51 1 0.290272620344 0.072469005789
+CC322C HGR52 1 0.249451641079 0.089736802707
+CC322C HGR53 1 0.231633666716 0.089736802707
+CC322C HGR61 1 0.290272620344 0.072469005789
+CC322C HGR62 1 0.267269615442 0.089736802707
+CC322C HGR63 1 0.249451641079 0.089736802707
+CC322C HGR71 1 0.290272620344 0.072469005789
+CC322C CG1T1 1 0.333196120584 0.170981810495
+CC322C CG1T2 1 0.346782326036 0.134409982486
+CC322C CG1N1 1 0.335868816739 0.177512086349
+CC322C CG2D1 1 0.355468588538 0.109105371453
+CC322C CG2D2 1 0.354577689820 0.105847757841
+CC322C CG2D1O 1 0.355468588538 0.109105371453
+CC322C CG2D2O 1 0.355468588538 0.109105371453
+CC322C CG2DC1 1 0.355468588538 0.109105371453
+CC322C CG2DC2 1 0.355468588538 0.109105371453
+CC322C CG2DC3 1 0.354577689820 0.105847757841
+CC322C CG25C1 1 0.355468588538 0.109105371453
+CC322C CG25C2 1 0.355468588538 0.109105371453
+CC322C CG251O 1 0.355468588538 0.109105371453
+CC322C CG252O 1 0.355468588538 0.109105371453
+CC322C CG2N1 1 0.347450500075 0.138767581228
+CC322C CG2N2 1 0.347450500075 0.138767581228
+CC322C CG2O1 1 0.347450500075 0.138767581228
+CC322C CG2O2 1 0.320723538531 0.130979917850
+CC322C CG2O3 1 0.347450500075 0.110698234855
+CC322C CG2O4 1 0.329632525712 0.102486650838
+CC322C CG2O5 1 0.347450500075 0.125520000000
+CC322C CG2O6 1 0.347450500075 0.110698234855
+CC322C CG2O7 1 0.308518226092 0.100764063435
+CC322C CG2R51 1 0.356359487256 0.093557084179
+CC322C CG2R52 1 0.365268474438 0.059170695450
+CC322C CG2R53 1 0.365268474438 0.059170695450
+CC322C CG2R57 1 0.356359487256 0.093557084179
+CC322C CG2R61 1 0.346773417049 0.110698234855
+CC322C CG2R62 1 0.338541512893 0.125520000000
+CC322C CG2R63 1 0.338541512893 0.132309697301
+CC322C CG2R64 1 0.356359487256 0.083680000000
+CC322C CG2R66 1 0.338541512893 0.110698234855
+CC322C CG2R67 1 0.346773417049 0.110698234855
+CC322C CG2RC0 1 0.334977918021 0.131646486622
+CC322C CG2R71 1 0.346987232741 0.108300154755
+CC322C CG2RC7 1 0.334977918021 0.131646486622
+CC322C CG301 1 0.338541512893 0.041840000000
+CC322C CG302 1 0.374177461619 0.059170695450
+CC322C CG311 1 0.338541512893 0.041840000000
+CC322C CG312 1 0.351904993665 0.085746484010
+CC322C CG314 1 0.338541512893 0.041840000000
+CC322C CG321 1 0.338541512893 0.041840000000
+CC322C CG322 1 0.338541512893 0.102486650838
+CC322C CG323 1 0.365268474438 0.138767581228
+CC322C CG324 1 0.338541512893 0.041840000000
+CC322C CG331 1 0.338541512893 0.041840000000
+CC322C CG334 1 0.338541512893 0.041840000000
+CC322C CG3C50 1 0.338541512893 0.041840000000
+CC322C CG3C51 1 0.338541512893 0.041840000000
+CC322C CG3C52 1 0.338541512893 0.041840000000
+CC322C CG3C53 1 0.338541512893 0.041840000000
+CC322C CG3C54 1 0.338541512893 0.041840000000
+CC322C CG3C31 1 0.338541512893 0.041840000000
+CC322C CG3C41 1 0.338541512893 0.041840000000
+CC322C CG3RC1 1 0.338541512893 0.041840000000
+CC322C CG3AM0 1 0.344777803920 0.110698234855
+CC322C CG3AM1 1 0.345668702638 0.116852760686
+CC322C CG3AM2 1 0.346559601357 0.118341390899
+CC322C NG1T1 1 0.328741626994 0.177512086349
+CC322C NG2D1 1 0.334087019303 0.187114168357
+CC322C NG2S0 1 0.334087019303 0.004184000000
+CC322C NG2S1 1 0.307360057758 0.187114168357
+CC322C NG2S2 1 0.334087019303 0.187114168357
+CC322C NG2S3 1 0.334087019303 0.187114168357
+CC322C NG2O1 1 0.334087019303 0.187114168357
+CC322C NG2P1 1 0.334087019303 0.187114168357
+CC322C NG2R43 1 0.334087019303 0.187114168357
+CC322C NG2R50 1 0.334087019303 0.187114168357
+CC322C NG2R51 1 0.334087019303 0.187114168357
+CC322C NG2R52 1 0.334087019303 0.187114168357
+CC322C NG2R53 1 0.334087019303 0.187114168357
+CC322C NG2R57 1 0.334087019303 0.187114168357
+CC322C NG2R60 1 0.337650614175 0.102486650838
+CC322C NG2R61 1 0.334087019303 0.187114168357
+CC322C NG2R62 1 0.352795892384 0.093557084179
+CC322C NG2R67 1 0.334087019303 0.187114168357
+CC322C NG2RC0 1 0.334087019303 0.187114168357
+CC322C NG301 1 0.347450500075 0.078275472531
+CC322C NG311 1 0.347450500075 0.088756043175
+CC322C NG321 1 0.346559601357 0.102486650838
+CC322C NG331 1 0.345668702638 0.110698234855
+CC322C NG3C51 1 0.334087019303 0.187114168357
+CC322C NG3N1 1 0.351904993665 0.102486650838
+CC322C NG3P0 1 0.334087019303 0.187114168357
+CC322C NG3P1 1 0.334087019303 0.187114168357
+CC322C NG3P2 1 0.334087019303 0.187114168357
+CC322C NG3P3 1 0.334087019303 0.187114168357
+CC322C OG2D1 1 0.293996576986 0.144938011577
+CC322C OG2D2 1 0.320723538531 0.144938011577
+CC322C OG2D3 1 0.293996576986 0.144938011577
+CC322C OG2D4 1 0.320723538531 0.144938011577
+CC322C OG2D5 1 0.320010819556 0.169954883425
+CC322C OG2N1 1 0.320723538531 0.144938011577
+CC322C OG2P1 1 0.320723538531 0.144938011577
+CC322C OG2R50 1 0.320723538531 0.144938011577
+CC322C OG3R60 1 0.316269044940 0.132309697301
+CC322C OG301 1 0.316269044940 0.132309697301
+CC322C OG302 1 0.316269044940 0.132309697301
+CC322C OG303 1 0.316269044940 0.132309697301
+CC322C OG304 1 0.316269044940 0.132309697301
+CC322C OG311 1 0.326514380198 0.183381431383
+CC322C OG312 1 0.325178032121 0.144938011577
+CC322C OG3C31 1 0.316269044940 0.132309697301
+CC322C OG3C51 1 0.316269044940 0.132309697301
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+CC322C SG2D1 1 0.351904993665 0.314496560236
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+CC322C FGA1 1 0.314487247504 0.153729976257
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+CC322C FGR1 1 0.320723538531 0.144938011577
+CC322C CLGA1 1 0.339432411611 0.245040988571
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+CC322C IGR1 1 0.364377575719 0.310293744700
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+CC322C ALG1 1 0.347450500075 0.337324864189
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+CC322C CC2O1 1 0.347450500075 0.138767581228
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+CC322C NC2D1 1 0.307360057758 0.187114168357
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+CC322C CC312 1 0.338541512893 0.041840000000
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+CC322C HCR1 1 0.240542653898 0.089736802707
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+CC322C OC2DP 1 0.320723538531 0.144938011577
+CC322C OC312 1 0.326959829558 0.163176000000
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+CC322C SC 1 0.356359487256 0.286840588481
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+CC322C HN1 1 0.189271432669 0.089736802707
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+CC322C NN1 1 0.334087019303 0.187114168357
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+CC312C NP 1 0.334087019303 0.187114168357
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+CC312C NG2S0 1 0.334087019303 0.004184000000
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+CC312C NG2R60 1 0.337650614175 0.102486650838
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+CC312C NG2R67 1 0.334087019303 0.187114168357
+CC312C NG2RC0 1 0.334087019303 0.187114168357
+CC312C NG301 1 0.347450500075 0.078275472531
+CC312C NG311 1 0.347450500075 0.088756043175
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+CC312D HR3 1 0.300054688270 0.036952087465
+CC312D HS 1 0.209361198763 0.132309697301
+CC312D HA1 1 0.288651184677 0.088756043175
+CC312D HA2 1 0.288651184677 0.077149148019
+CC312D HA3 1 0.288651184677 0.064818249282
+CC312D N 1 0.334087019303 0.004184000000
+CC312D NC2 1 0.334087019303 0.187114168357
+CC312D NH1 1 0.307360057758 0.187114168357
+CC312D NH2 1 0.334087019303 0.187114168357
+CC312D NH3 1 0.334087019303 0.187114168357
+CC312D NP 1 0.334087019303 0.187114168357
+CC312D NR1 1 0.334087019303 0.187114168357
+CC312D NR2 1 0.334087019303 0.187114168357
+CC312D NR3 1 0.334087019303 0.187114168357
+CC312D NY 1 0.334087019303 0.187114168357
+CC312D O 1 0.293996576986 0.144938011577
+CC312D OB 1 0.293996576986 0.144938011577
+CC312D OC 1 0.320723538531 0.144938011577
+CC312D OH1 1 0.326959829558 0.163176000000
+CC312D OS 1 0.326959829558 0.163176000000
+CC312D S 1 0.347450500075 0.280671252536
+CC312D SM 1 0.345223253279 0.257919081884
+CC312D SS 1 0.365268474438 0.286840588481
+CC312D HT 1 0.189271432669 0.089736802707
+CC312D OT 1 0.326799467788 0.163176000000
+CC312D OX 1 0.320723538531 0.144938011577
+CC312D HX 1 0.189271432669 0.089736802707
+CC312D LIT 1 0.284864865125 0.020196198771
+CC312D SOD 1 0.294954293108 0.090610410351
+CC312D MG 1 0.274842254546 0.051243325419
+CC312D POT 1 0.326403017859 0.123410269913
+CC312D CAL 1 0.291056611216 0.144938011577
+CC312D RUB 1 0.338541512893 0.162045623205
+CC312D CES 1 0.356359487256 0.182376331798
+CC312D BAR 1 0.337650614175 0.162045623205
+CC312D ZN 1 0.266378716724 0.209200000000
+CC312D CAD 1 0.290165712498 0.144938011577
+CC312D CLA 1 0.371504765465 0.162045623205
+CC312D HGA1 1 0.288651184677 0.088756043175
+CC312D HGA2 1 0.288651184677 0.078275472531
+CC312D HGA3 1 0.288651184677 0.064818249282
+CC312D HGA4 1 0.280633096214 0.073666921749
+CC312D HGA5 1 0.281523994932 0.067464972838
+CC312D HGA6 1 0.286869387241 0.070011711020
+CC312D HGA7 1 0.285087589805 0.072469005789
+CC312D HGAAM0 1 0.283305792369 0.070011711020
+CC312D HGAAM1 1 0.283305792369 0.070011711020
+CC312D HGAAM2 1 0.281523994932 0.083680000000
+CC312D HGP1 1 0.189271432669 0.089736802707
+CC312D HGP2 1 0.189271432669 0.089736802707
+CC312D HGP3 1 0.209361198763 0.132309697301
+CC312D HGP4 1 0.189271432669 0.089736802707
+CC312D HGP5 1 0.231633666716 0.089736802707
+CC312D HGPAM1 1 0.247224394284 0.039692909190
+CC312D HGPAM2 1 0.247224394284 0.041840000000
+CC312D HGPAM3 1 0.246778944925 0.045833423612
+CC312D HGR51 1 0.290272620344 0.072469005789
+CC312D HGR52 1 0.249451641079 0.089736802707
+CC312D HGR53 1 0.231633666716 0.089736802707
+CC312D HGR61 1 0.290272620344 0.072469005789
+CC312D HGR62 1 0.267269615442 0.089736802707
+CC312D HGR63 1 0.249451641079 0.089736802707
+CC312D HGR71 1 0.290272620344 0.072469005789
+CC312D CG1T1 1 0.333196120584 0.170981810495
+CC312D CG1T2 1 0.346782326036 0.134409982486
+CC312D CG1N1 1 0.335868816739 0.177512086349
+CC312D CG2D1 1 0.355468588538 0.109105371453
+CC312D CG2D2 1 0.354577689820 0.105847757841
+CC312D CG2D1O 1 0.355468588538 0.109105371453
+CC312D CG2D2O 1 0.355468588538 0.109105371453
+CC312D CG2DC1 1 0.355468588538 0.109105371453
+CC312D CG2DC2 1 0.355468588538 0.109105371453
+CC312D CG2DC3 1 0.354577689820 0.105847757841
+CC312D CG25C1 1 0.355468588538 0.109105371453
+CC312D CG25C2 1 0.355468588538 0.109105371453
+CC312D CG251O 1 0.355468588538 0.109105371453
+CC312D CG252O 1 0.355468588538 0.109105371453
+CC312D CG2N1 1 0.347450500075 0.138767581228
+CC312D CG2N2 1 0.347450500075 0.138767581228
+CC312D CG2O1 1 0.347450500075 0.138767581228
+CC312D CG2O2 1 0.320723538531 0.130979917850
+CC312D CG2O3 1 0.347450500075 0.110698234855
+CC312D CG2O4 1 0.329632525712 0.102486650838
+CC312D CG2O5 1 0.347450500075 0.125520000000
+CC312D CG2O6 1 0.347450500075 0.110698234855
+CC312D CG2O7 1 0.308518226092 0.100764063435
+CC312D CG2R51 1 0.356359487256 0.093557084179
+CC312D CG2R52 1 0.365268474438 0.059170695450
+CC312D CG2R53 1 0.365268474438 0.059170695450
+CC312D CG2R57 1 0.356359487256 0.093557084179
+CC312D CG2R61 1 0.346773417049 0.110698234855
+CC312D CG2R62 1 0.338541512893 0.125520000000
+CC312D CG2R63 1 0.338541512893 0.132309697301
+CC312D CG2R64 1 0.356359487256 0.083680000000
+CC312D CG2R66 1 0.338541512893 0.110698234855
+CC312D CG2R67 1 0.346773417049 0.110698234855
+CC312D CG2RC0 1 0.334977918021 0.131646486622
+CC312D CG2R71 1 0.346987232741 0.108300154755
+CC312D CG2RC7 1 0.334977918021 0.131646486622
+CC312D CG301 1 0.338541512893 0.041840000000
+CC312D CG302 1 0.374177461619 0.059170695450
+CC312D CG311 1 0.338541512893 0.041840000000
+CC312D CG312 1 0.351904993665 0.085746484010
+CC312D CG314 1 0.338541512893 0.041840000000
+CC312D CG321 1 0.338541512893 0.041840000000
+CC312D CG322 1 0.338541512893 0.102486650838
+CC312D CG323 1 0.365268474438 0.138767581228
+CC312D CG324 1 0.338541512893 0.041840000000
+CC312D CG331 1 0.338541512893 0.041840000000
+CC312D CG334 1 0.338541512893 0.041840000000
+CC312D CG3C50 1 0.338541512893 0.041840000000
+CC312D CG3C51 1 0.338541512893 0.041840000000
+CC312D CG3C52 1 0.338541512893 0.041840000000
+CC312D CG3C53 1 0.338541512893 0.041840000000
+CC312D CG3C54 1 0.338541512893 0.041840000000
+CC312D CG3C31 1 0.338541512893 0.041840000000
+CC312D CG3C41 1 0.338541512893 0.041840000000
+CC312D CG3RC1 1 0.338541512893 0.041840000000
+CC312D CG3AM0 1 0.344777803920 0.110698234855
+CC312D CG3AM1 1 0.345668702638 0.116852760686
+CC312D CG3AM2 1 0.346559601357 0.118341390899
+CC312D NG1T1 1 0.328741626994 0.177512086349
+CC312D NG2D1 1 0.334087019303 0.187114168357
+CC312D NG2S0 1 0.334087019303 0.004184000000
+CC312D NG2S1 1 0.307360057758 0.187114168357
+CC312D NG2S2 1 0.334087019303 0.187114168357
+CC312D NG2S3 1 0.334087019303 0.187114168357
+CC312D NG2O1 1 0.334087019303 0.187114168357
+CC312D NG2P1 1 0.334087019303 0.187114168357
+CC312D NG2R43 1 0.334087019303 0.187114168357
+CC312D NG2R50 1 0.334087019303 0.187114168357
+CC312D NG2R51 1 0.334087019303 0.187114168357
+CC312D NG2R52 1 0.334087019303 0.187114168357
+CC312D NG2R53 1 0.334087019303 0.187114168357
+CC312D NG2R57 1 0.334087019303 0.187114168357
+CC312D NG2R60 1 0.337650614175 0.102486650838
+CC312D NG2R61 1 0.334087019303 0.187114168357
+CC312D NG2R62 1 0.352795892384 0.093557084179
+CC312D NG2R67 1 0.334087019303 0.187114168357
+CC312D NG2RC0 1 0.334087019303 0.187114168357
+CC312D NG301 1 0.347450500075 0.078275472531
+CC312D NG311 1 0.347450500075 0.088756043175
+CC312D NG321 1 0.346559601357 0.102486650838
+CC312D NG331 1 0.345668702638 0.110698234855
+CC312D NG3C51 1 0.334087019303 0.187114168357
+CC312D NG3N1 1 0.351904993665 0.102486650838
+CC312D NG3P0 1 0.334087019303 0.187114168357
+CC312D NG3P1 1 0.334087019303 0.187114168357
+CC312D NG3P2 1 0.334087019303 0.187114168357
+CC312D NG3P3 1 0.334087019303 0.187114168357
+CC312D OG2D1 1 0.293996576986 0.144938011577
+CC312D OG2D2 1 0.320723538531 0.144938011577
+CC312D OG2D3 1 0.293996576986 0.144938011577
+CC312D OG2D4 1 0.320723538531 0.144938011577
+CC312D OG2D5 1 0.320010819556 0.169954883425
+CC312D OG2N1 1 0.320723538531 0.144938011577
+CC312D OG2P1 1 0.320723538531 0.144938011577
+CC312D OG2R50 1 0.320723538531 0.144938011577
+CC312D OG3R60 1 0.316269044940 0.132309697301
+CC312D OG301 1 0.316269044940 0.132309697301
+CC312D OG302 1 0.316269044940 0.132309697301
+CC312D OG303 1 0.316269044940 0.132309697301
+CC312D OG304 1 0.316269044940 0.132309697301
+CC312D OG311 1 0.326514380198 0.183381431383
+CC312D OG312 1 0.325178032121 0.144938011577
+CC312D OG3C31 1 0.316269044940 0.132309697301
+CC312D OG3C51 1 0.316269044940 0.132309697301
+CC312D OG3C61 1 0.316269044940 0.132309697301
+CC312D SG2D1 1 0.351904993665 0.314496560236
+CC312D SG2R50 1 0.347450500075 0.280671252536
+CC312D SG311 1 0.347450500075 0.280671252536
+CC312D SG301 1 0.345223253279 0.257919081884
+CC312D SG302 1 0.365268474438 0.286840588481
+CC312D SG3O1 1 0.356359487256 0.286840588481
+CC312D SG3O2 1 0.347450500075 0.247528778125
+CC312D SG3O3 1 0.347450500075 0.247528778125
+CC312D FGA1 1 0.314487247504 0.153729976257
+CC312D FGA2 1 0.314487247504 0.135577095411
+CC312D FGA3 1 0.311814551349 0.130309939452
+CC312D FGP1 1 0.311814551349 0.130309939452
+CC312D FGR1 1 0.320723538531 0.144938011577
+CC312D CLGA1 1 0.339432411611 0.245040988571
+CC312D CLGA3 1 0.339432411611 0.232955260941
+CC312D CLGR1 1 0.341214209048 0.236682781799
+CC312D BRGA1 1 0.344777803920 0.289876023155
+CC312D BRGA2 1 0.351904993665 0.304599797767
+CC312D BRGA3 1 0.347450500075 0.307459952514
+CC312D BRGR1 1 0.353686791102 0.271154190821
+CC312D IGR1 1 0.364377575719 0.310293744700
+CC312D PG0 1 0.360813980847 0.320014464673
+CC312D PG1 1 0.360813980847 0.320014464673
+CC312D PG2 1 0.360813980847 0.320014464673
+CC312D ALG1 1 0.347450500075 0.337324864189
+CC312D CC301 1 0.338541512893 0.041840000000
+CC312D CC3062 1 0.338541512893 0.041840000000
+CC312D CC311 1 0.338541512893 0.041840000000
+CC312D CC3161 1 0.338541512893 0.041840000000
+CC312D CC3162 1 0.338541512893 0.041840000000
+CC312D CC3163 1 0.338541512893 0.041840000000
+CC312D CC321 1 0.338541512893 0.041840000000
+CC312D CC3261 1 0.338541512893 0.041840000000
+CC312D CC3263 1 0.338541512893 0.041840000000
+CC312D CC331 1 0.338541512893 0.041840000000
+CC312D CC2O1 1 0.347450500075 0.138767581228
+CC312D CC2O2 1 0.347450500075 0.110698234855
+CC312D CC2O3 1 0.347450500075 0.125520000000
+CC312D CC2O4 1 0.329632525712 0.102486650838
+CC312D OC2D1 1 0.293996576986 0.144938011577
+CC312D OC2D2 1 0.320723538531 0.144938011577
+CC312D OC2D3 1 0.293996576986 0.144938011577
+CC312D OC2D4 1 0.293996576986 0.144938011577
+CC312D OC3C61 1 0.316269044940 0.132309697301
+CC312D OC311 1 0.326514380198 0.183381431383
+CC312D NC2D1 1 0.307360057758 0.187114168357
+CC312D HCP1 1 0.189271432669 0.089736802707
+CC312D HCA1 1 0.288651184677 0.088756043175
+CC312D HCA2 1 0.288651184677 0.078275472531
+CC312D HCA3 1 0.288651184677 0.064818249282
+CC312D CC312 1 0.338541512893 0.041840000000
+CC312D CC322 1 0.338541512893 0.041840000000
+CC312D HCR1 1 0.240542653898 0.089736802707
+CC312D HCA3M 1 0.288651184677 0.064818249282
+CC312D CC321C 1 0.338541512893 0.041840000000
+CC312D CC321D 1 0.338541512893 0.041840000000
+CC312D CC311C 1 0.338541512893 0.041840000000
+CC312D CC311D 1 0.338541512893 0.041840000000
+CC312D OC301 1 0.316269044940 0.132309697301
+CC312D OC302 1 0.316269044940 0.132309697301
+CC312D HCP1M 1 0.189271432669 0.089736802707
+CC312D OC311M 1 0.326514380198 0.183381431383
+CC312D OC3C5M 1 0.316269044940 0.132309697301
+CC312D CC322C 1 0.338541512893 0.041840000000
+CC312D HCA2C2 1 0.285087589805 0.078275472531
+CC312D CC312C 1 0.338541512893 0.041840000000
+CC312D HCA1C2 1 0.288651184677 0.088756043175
+CC312D OC3C51 1 0.316269044940 0.132309697301
+CC312D CC3152 1 0.338541512893 0.041840000000
+CC312D CC3051 1 0.338541512893 0.041840000000
+CC312D CC3251 1 0.338541512893 0.041840000000
+CC312D CC3151 1 0.338541512893 0.041840000000
+CC312D CC3153 1 0.338541512893 0.041840000000
+CC312D OC2DP 1 0.320723538531 0.144938011577
+CC312D OC312 1 0.326959829558 0.163176000000
+CC312D OC30P 1 0.326959829558 0.163176000000
+CC312D PC 1 0.360813980847 0.320014464673
+CC312D SC 1 0.356359487256 0.286840588481
+CC312D CC312D 1 0.338541512893 0.041840000000
+CC312D OC303 1 0.316269044940 0.132309697301
+CC312D HN1 1 0.189271432669 0.089736802707
+CC312D HN2 1 0.189271432669 0.089736802707
+CC312D HN3 1 0.267269615442 0.089736802707
+CC312D HN4 1 0.189271432669 0.089736802707
+CC312D HN5 1 0.189271432669 0.089736802707
+CC312D HN6 1 0.286869387241 0.062058748940
+CC312D HN7 1 0.286869387241 0.062058748940
+CC312D HN8 1 0.288651184677 0.070011711020
+CC312D HN9 1 0.288651184677 0.064818249282
+CC312D NN1 1 0.334087019303 0.187114168357
+CC312D NN2 1 0.334087019303 0.187114168357
+CC312D NN2B 1 0.334087019303 0.187114168357
+CC312D NN2G 1 0.334087019303 0.187114168357
+CC312D NN2U 1 0.334087019303 0.187114168357
+CC312D NN3 1 0.334087019303 0.187114168357
+CC312D NN3A 1 0.334087019303 0.187114168357
+CC312D NN3G 1 0.334087019303 0.187114168357
+CC312D NN4 1 0.334087019303 0.187114168357
+CC312D NN6 1 0.334087019303 0.187114168357
+CC312D ON1 1 0.320723538531 0.144938011577
+CC312D ON1C 1 0.320723538531 0.144938011577
+CC312D ON2 1 0.326959829558 0.163176000000
+CC312D ON3 1 0.320723538531 0.144938011577
+CC312D ON4 1 0.326959829558 0.163176000000
+CC312D ON5 1 0.326959829558 0.163176000000
+CC312D ON6 1 0.326959829558 0.163176000000
+CC312D ON6B 1 0.326959829558 0.163176000000
+CC312D CN1 1 0.338541512893 0.132309697301
+CC312D CN1T 1 0.338541512893 0.132309697301
+CC312D CN2 1 0.338541512893 0.132309697301
+CC312D CN3 1 0.338541512893 0.125520000000
+CC312D CN3T 1 0.338541512893 0.125520000000
+CC312D CN4 1 0.338541512893 0.114583559030
+CC312D CN5 1 0.338541512893 0.114583559030
+CC312D CN5G 1 0.338541512893 0.114583559030
+CC312D CN7 1 0.338541512893 0.041840000000
+CC312D CN7B 1 0.338541512893 0.041840000000
+CC312D CN8 1 0.338541512893 0.041840000000
+CC312D CN8B 1 0.338541512893 0.041840000000
+CC312D CN9 1 0.338541512893 0.041840000000
+CC312D P 1 0.360813980847 0.320014464673
+CC312D P2 1 0.360813980847 0.320014464673
+CC312D HOL 1 0.189271432669 0.089736802707
+CC312D HAL1 1 0.286869387241 0.062058748940
+CC312D HAL2 1 0.288651184677 0.070011711020
+CC312D HAL3 1 0.288651184677 0.064818249282
+CC312D HBL 1 0.286869387241 0.062058748940
+CC312D HCL 1 0.189271432669 0.089736802707
+CC312D HL 1 0.231633666716 0.089736802707
+CC312D HEL1 1 0.280633096214 0.073666921749
+CC312D HEL2 1 0.281523994932 0.067464972838
+CC312D CL 1 0.347450500075 0.110698234855
+CC312D CCL 1 0.347450500075 0.110698234855
+CC312D CTL1 1 0.338541512893 0.041840000000
+CC312D CTL2 1 0.338541512893 0.041840000000
+CC312D CTL3 1 0.338541512893 0.041840000000
+CC312D CTL5 1 0.338541512893 0.041840000000
+CC312D CEL1 1 0.355468588538 0.109105371453
+CC312D CEL2 1 0.354577689820 0.105847757841
+CC312D CRL1 1 0.338541512893 0.041840000000
+CC312D CRL2 1 0.338541512893 0.041840000000
+CC312D OBL 1 0.293996576986 0.144938011577
+CC312D OCL 1 0.320723538531 0.144938011577
+CC312D O2L 1 0.320723538531 0.144938011577
+CC312D OHL 1 0.326959829558 0.163176000000
+CC312D OSL 1 0.316269044940 0.132309697301
+CC312D OSLP 1 0.316269044940 0.132309697301
+CC312D NH3L 1 0.334087019303 0.187114168357
+CC312D NTL 1 0.334087019303 0.187114168357
+CC312D SL 1 0.356359487256 0.286840588481
+CC312D PL 1 0.360813980847 0.320014464673
+CC312D HCA1A 1 0.288651184677 0.088756043175
+CC312D HCA2A 1 0.288651184677 0.078275472531
+CC312D HCA3A 1 0.288651184677 0.064818249282
+CC312D CC30A 1 0.338541512893 0.041840000000
+CC312D CC31A 1 0.338541512893 0.041840000000
+CC312D CC32A 1 0.338541512893 0.041840000000
+CC312D CC33A 1 0.338541512893 0.041840000000
+CC312D CC326A 1 0.338541512893 0.041840000000
+CC312D HCA25A 1 0.285087589805 0.078275472531
+CC312D CC325A 1 0.338541512893 0.041840000000
+CC312D CC325B 1 0.338541512893 0.041840000000
+CC312D OC305A 1 0.316269044940 0.132309697301
+CC312D OC30A 1 0.316269044940 0.132309697301
+CC312D CPA 1 0.329632525712 0.125520000000
+CC312D CPB 1 0.329632525712 0.125520000000
+CC312D CPM 1 0.329632525712 0.125520000000
+CC312D CM 1 0.356359487256 0.138767581228
+CC312D CST 1 0.308518226092 0.100764063435
+CC312D NPH 1 0.334087019303 0.187114168357
+CC312D OM 1 0.320723538531 0.144938011577
+CC312D OST 1 0.320010819556 0.169954883425
+CC312D FE 1 0.227179173126 0.000000000000
+CC312D ON2B 1 0.326959829558 0.163176000000
+CC312D SP 1 0.365268474438 0.280671252536
+ CN7 C 1 0.347450500075 0.138767581228
+ CN7 CA 1 0.346773417049 0.110698234855
+ CN7 CC 1 0.347450500075 0.110698234855
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+ CN9 ON2 1 0.326959829558 0.163176000000
+ CN9 ON3 1 0.320723538531 0.144938011577
+ CN9 ON4 1 0.326959829558 0.163176000000
+ CN9 ON5 1 0.326959829558 0.163176000000
+ CN9 ON6 1 0.326959829558 0.163176000000
+ CN9 ON6B 1 0.326959829558 0.163176000000
+ CN9 CN1 1 0.338541512893 0.132309697301
+ CN9 CN1T 1 0.338541512893 0.132309697301
+ CN9 CN2 1 0.338541512893 0.132309697301
+ CN9 CN3 1 0.338541512893 0.125520000000
+ CN9 CN3T 1 0.338541512893 0.125520000000
+ CN9 CN4 1 0.338541512893 0.114583559030
+ CN9 CN5 1 0.338541512893 0.114583559030
+ CN9 CN5G 1 0.338541512893 0.114583559030
+ CN9 CN7 1 0.338541512893 0.041840000000
+ CN9 CN7B 1 0.338541512893 0.041840000000
+ CN9 CN8 1 0.338541512893 0.041840000000
+ CN9 CN8B 1 0.338541512893 0.041840000000
+ CN9 CN9 1 0.338541512893 0.041840000000
+ CN9 P 1 0.360813980847 0.320014464673
+ CN9 P2 1 0.360813980847 0.320014464673
+ CN9 HOL 1 0.189271432669 0.089736802707
+ CN9 HAL1 1 0.286869387241 0.062058748940
+ CN9 HAL2 1 0.288651184677 0.070011711020
+ CN9 HAL3 1 0.288651184677 0.064818249282
+ CN9 HBL 1 0.286869387241 0.062058748940
+ CN9 HCL 1 0.189271432669 0.089736802707
+ CN9 HL 1 0.231633666716 0.089736802707
+ CN9 HEL1 1 0.280633096214 0.073666921749
+ CN9 HEL2 1 0.281523994932 0.067464972838
+ CN9 CL 1 0.347450500075 0.110698234855
+ CN9 CCL 1 0.347450500075 0.110698234855
+ CN9 CTL1 1 0.338541512893 0.041840000000
+ CN9 CTL2 1 0.338541512893 0.041840000000
+ CN9 CTL3 1 0.338541512893 0.041840000000
+ CN9 CTL5 1 0.338541512893 0.041840000000
+ CN9 CEL1 1 0.355468588538 0.109105371453
+ CN9 CEL2 1 0.354577689820 0.105847757841
+ CN9 CRL1 1 0.338541512893 0.041840000000
+ CN9 CRL2 1 0.338541512893 0.041840000000
+ CN9 OBL 1 0.293996576986 0.144938011577
+ CN9 OCL 1 0.320723538531 0.144938011577
+ CN9 O2L 1 0.320723538531 0.144938011577
+ CN9 OHL 1 0.326959829558 0.163176000000
+ CN9 OSL 1 0.316269044940 0.132309697301
+ CN9 OSLP 1 0.316269044940 0.132309697301
+ CN9 NH3L 1 0.334087019303 0.187114168357
+ CN9 NTL 1 0.334087019303 0.187114168357
+ CN9 SL 1 0.356359487256 0.286840588481
+ CN9 PL 1 0.360813980847 0.320014464673
+ CN9 HCA1A 1 0.288651184677 0.088756043175
+ CN9 HCA2A 1 0.288651184677 0.078275472531
+ CN9 HCA3A 1 0.288651184677 0.064818249282
+ CN9 CC30A 1 0.338541512893 0.041840000000
+ CN9 CC31A 1 0.338541512893 0.041840000000
+ CN9 CC32A 1 0.338541512893 0.041840000000
+ CN9 CC33A 1 0.338541512893 0.041840000000
+ CN9 CC326A 1 0.338541512893 0.041840000000
+ CN9 HCA25A 1 0.285087589805 0.078275472531
+ CN9 CC325A 1 0.338541512893 0.041840000000
+ CN9 CC325B 1 0.338541512893 0.041840000000
+ CN9 OC305A 1 0.316269044940 0.132309697301
+ CN9 OC30A 1 0.316269044940 0.132309697301
+ CN9 CPA 1 0.329632525712 0.125520000000
+ CN9 CPB 1 0.329632525712 0.125520000000
+ CN9 CPM 1 0.329632525712 0.125520000000
+ CN9 CM 1 0.356359487256 0.138767581228
+ CN9 CST 1 0.308518226092 0.100764063435
+ CN9 NPH 1 0.334087019303 0.187114168357
+ CN9 OM 1 0.320723538531 0.144938011577
+ CN9 OST 1 0.320010819556 0.169954883425
+ CN9 FE 1 0.227179173126 0.000000000000
+ CN9 ON2B 1 0.326959829558 0.163176000000
+ CN9 SP 1 0.365268474438 0.280671252536
+ CTL1 C 1 0.347450500075 0.138767581228
+ CTL1 CA 1 0.346773417049 0.110698234855
+ CTL1 CC 1 0.347450500075 0.110698234855
+ CTL1 CD 1 0.347450500075 0.110698234855
+ CTL1 CE1 1 0.355468588538 0.109105371453
+ CTL1 CE2 1 0.354577689820 0.105847757841
+ CTL1 CP1 1 0.338541512893 0.041840000000
+ CTL1 CP2 1 0.338541512893 0.041840000000
+ CTL1 CP3 1 0.338541512893 0.041840000000
+ CTL1 CPH1 1 0.329632525712 0.093557084179
+ CTL1 CPH2 1 0.329632525712 0.093557084179
+ CTL1 CS 1 0.365268474438 0.138767581228
+ CTL1 CPT 1 0.334977918021 0.131646486622
+ CTL1 CY 1 0.346559601357 0.113045454929
+ CTL1 CAI 1 0.346559601357 0.113045454929
+ CTL1 CT 1 0.338541512893 0.041840000000
+ CTL1 CT1 1 0.338541512893 0.041840000000
+ CTL1 CT2 1 0.338541512893 0.041840000000
+ CTL1 CT2A 1 0.338541512893 0.041840000000
+ CTL1 CT3 1 0.338541512893 0.041840000000
+ CTL1 H 1 0.189271432669 0.089736802707
+ CTL1 HA 1 0.286869387241 0.062058748940
+ CTL1 HB1 1 0.286869387241 0.062058748940
+ CTL1 HB2 1 0.288651184677 0.070011711020
+ CTL1 HE1 1 0.280633096214 0.073666921749
+ CTL1 HE2 1 0.281523994932 0.067464972838
+ CTL1 HC 1 0.189271432669 0.089736802707
+ CTL1 HP 1 0.290272620344 0.072469005789
+ CTL1 HR1 1 0.249451641079 0.089736802707
+ CTL1 HR2 1 0.231633666716 0.089736802707
+ CTL1 HR3 1 0.300054688270 0.036952087465
+ CTL1 HS 1 0.209361198763 0.132309697301
+ CTL1 HA1 1 0.288651184677 0.088756043175
+ CTL1 HA2 1 0.288651184677 0.077149148019
+ CTL1 HA3 1 0.288651184677 0.064818249282
+ CTL1 N 1 0.334087019303 0.004184000000
+ CTL1 NC2 1 0.334087019303 0.187114168357
+ CTL1 NH1 1 0.307360057758 0.187114168357
+ CTL1 NH2 1 0.334087019303 0.187114168357
+ CTL1 NH3 1 0.334087019303 0.187114168357
+ CTL1 NP 1 0.334087019303 0.187114168357
+ CTL1 NR1 1 0.334087019303 0.187114168357
+ CTL1 NR2 1 0.334087019303 0.187114168357
+ CTL1 NR3 1 0.334087019303 0.187114168357
+ CTL1 NY 1 0.334087019303 0.187114168357
+ CTL1 O 1 0.293996576986 0.144938011577
+ CTL1 OB 1 0.293996576986 0.144938011577
+ CTL1 OC 1 0.320723538531 0.144938011577
+ CTL1 OH1 1 0.326959829558 0.163176000000
+ CTL1 OS 1 0.326959829558 0.163176000000
+ CTL1 S 1 0.347450500075 0.280671252536
+ CTL1 SM 1 0.345223253279 0.257919081884
+ CTL1 SS 1 0.365268474438 0.286840588481
+ CTL1 HT 1 0.189271432669 0.089736802707
+ CTL1 OT 1 0.326799467788 0.163176000000
+ CTL1 OX 1 0.320723538531 0.144938011577
+ CTL1 HX 1 0.189271432669 0.089736802707
+ CTL1 LIT 1 0.284864865125 0.020196198771
+ CTL1 SOD 1 0.294954293108 0.090610410351
+ CTL1 MG 1 0.274842254546 0.051243325419
+ CTL1 POT 1 0.326403017859 0.123410269913
+ CTL1 CAL 1 0.291056611216 0.144938011577
+ CTL1 RUB 1 0.338541512893 0.162045623205
+ CTL1 CES 1 0.356359487256 0.182376331798
+ CTL1 BAR 1 0.337650614175 0.162045623205
+ CTL1 ZN 1 0.266378716724 0.209200000000
+ CTL1 CAD 1 0.290165712498 0.144938011577
+ CTL1 CLA 1 0.371504765465 0.162045623205
+ CTL1 HGA1 1 0.288651184677 0.088756043175
+ CTL1 HGA2 1 0.288651184677 0.078275472531
+ CTL1 HGA3 1 0.288651184677 0.064818249282
+ CTL1 HGA4 1 0.280633096214 0.073666921749
+ CTL1 HGA5 1 0.281523994932 0.067464972838
+ CTL1 HGA6 1 0.286869387241 0.070011711020
+ CTL1 HGA7 1 0.285087589805 0.072469005789
+ CTL1 HGAAM0 1 0.283305792369 0.070011711020
+ CTL1 HGAAM1 1 0.283305792369 0.070011711020
+ CTL1 HGAAM2 1 0.281523994932 0.083680000000
+ CTL1 HGP1 1 0.189271432669 0.089736802707
+ CTL1 HGP2 1 0.189271432669 0.089736802707
+ CTL1 HGP3 1 0.209361198763 0.132309697301
+ CTL1 HGP4 1 0.189271432669 0.089736802707
+ CTL1 HGP5 1 0.231633666716 0.089736802707
+ CTL1 HGPAM1 1 0.247224394284 0.039692909190
+ CTL1 HGPAM2 1 0.247224394284 0.041840000000
+ CTL1 HGPAM3 1 0.246778944925 0.045833423612
+ CTL1 HGR51 1 0.290272620344 0.072469005789
+ CTL1 HGR52 1 0.249451641079 0.089736802707
+ CTL1 HGR53 1 0.231633666716 0.089736802707
+ CTL1 HGR61 1 0.290272620344 0.072469005789
+ CTL1 HGR62 1 0.267269615442 0.089736802707
+ CTL1 HGR63 1 0.249451641079 0.089736802707
+ CTL1 HGR71 1 0.290272620344 0.072469005789
+ CTL1 CG1T1 1 0.333196120584 0.170981810495
+ CTL1 CG1T2 1 0.346782326036 0.134409982486
+ CTL1 CG1N1 1 0.335868816739 0.177512086349
+ CTL1 CG2D1 1 0.355468588538 0.109105371453
+ CTL1 CG2D2 1 0.354577689820 0.105847757841
+ CTL1 CG2D1O 1 0.355468588538 0.109105371453
+ CTL1 CG2D2O 1 0.355468588538 0.109105371453
+ CTL1 CG2DC1 1 0.355468588538 0.109105371453
+ CTL1 CG2DC2 1 0.355468588538 0.109105371453
+ CTL1 CG2DC3 1 0.354577689820 0.105847757841
+ CTL1 CG25C1 1 0.355468588538 0.109105371453
+ CTL1 CG25C2 1 0.355468588538 0.109105371453
+ CTL1 CG251O 1 0.355468588538 0.109105371453
+ CTL1 CG252O 1 0.355468588538 0.109105371453
+ CTL1 CG2N1 1 0.347450500075 0.138767581228
+ CTL1 CG2N2 1 0.347450500075 0.138767581228
+ CTL1 CG2O1 1 0.347450500075 0.138767581228
+ CTL1 CG2O2 1 0.320723538531 0.130979917850
+ CTL1 CG2O3 1 0.347450500075 0.110698234855
+ CTL1 CG2O4 1 0.329632525712 0.102486650838
+ CTL1 CG2O5 1 0.347450500075 0.125520000000
+ CTL1 CG2O6 1 0.347450500075 0.110698234855
+ CTL1 CG2O7 1 0.308518226092 0.100764063435
+ CTL1 CG2R51 1 0.356359487256 0.093557084179
+ CTL1 CG2R52 1 0.365268474438 0.059170695450
+ CTL1 CG2R53 1 0.365268474438 0.059170695450
+ CTL1 CG2R57 1 0.356359487256 0.093557084179
+ CTL1 CG2R61 1 0.346773417049 0.110698234855
+ CTL1 CG2R62 1 0.338541512893 0.125520000000
+ CTL1 CG2R63 1 0.338541512893 0.132309697301
+ CTL1 CG2R64 1 0.356359487256 0.083680000000
+ CTL1 CG2R66 1 0.338541512893 0.110698234855
+ CTL1 CG2R67 1 0.346773417049 0.110698234855
+ CTL1 CG2RC0 1 0.334977918021 0.131646486622
+ CTL1 CG2R71 1 0.346987232741 0.108300154755
+ CTL1 CG2RC7 1 0.334977918021 0.131646486622
+ CTL1 CG301 1 0.338541512893 0.041840000000
+ CTL1 CG302 1 0.374177461619 0.059170695450
+ CTL1 CG311 1 0.338541512893 0.041840000000
+ CTL1 CG312 1 0.351904993665 0.085746484010
+ CTL1 CG314 1 0.338541512893 0.041840000000
+ CTL1 CG321 1 0.338541512893 0.041840000000
+ CTL1 CG322 1 0.338541512893 0.102486650838
+ CTL1 CG323 1 0.365268474438 0.138767581228
+ CTL1 CG324 1 0.338541512893 0.041840000000
+ CTL1 CG331 1 0.338541512893 0.041840000000
+ CTL1 CG334 1 0.338541512893 0.041840000000
+ CTL1 CG3C50 1 0.338541512893 0.041840000000
+ CTL1 CG3C51 1 0.338541512893 0.041840000000
+ CTL1 CG3C52 1 0.338541512893 0.041840000000
+ CTL1 CG3C53 1 0.338541512893 0.041840000000
+ CTL1 CG3C54 1 0.338541512893 0.041840000000
+ CTL1 CG3C31 1 0.338541512893 0.041840000000
+ CTL1 CG3C41 1 0.338541512893 0.041840000000
+ CTL1 CG3RC1 1 0.338541512893 0.041840000000
+ CTL1 CG3AM0 1 0.344777803920 0.110698234855
+ CTL1 CG3AM1 1 0.345668702638 0.116852760686
+ CTL1 CG3AM2 1 0.346559601357 0.118341390899
+ CTL1 NG1T1 1 0.328741626994 0.177512086349
+ CTL1 NG2D1 1 0.334087019303 0.187114168357
+ CTL1 NG2S0 1 0.334087019303 0.004184000000
+ CTL1 NG2S1 1 0.307360057758 0.187114168357
+ CTL1 NG2S2 1 0.334087019303 0.187114168357
+ CTL1 NG2S3 1 0.334087019303 0.187114168357
+ CTL1 NG2O1 1 0.334087019303 0.187114168357
+ CTL1 NG2P1 1 0.334087019303 0.187114168357
+ CTL1 NG2R43 1 0.334087019303 0.187114168357
+ CTL1 NG2R50 1 0.334087019303 0.187114168357
+ CTL1 NG2R51 1 0.334087019303 0.187114168357
+ CTL1 NG2R52 1 0.334087019303 0.187114168357
+ CTL1 NG2R53 1 0.334087019303 0.187114168357
+ CTL1 NG2R57 1 0.334087019303 0.187114168357
+ CTL1 NG2R60 1 0.337650614175 0.102486650838
+ CTL1 NG2R61 1 0.334087019303 0.187114168357
+ CTL1 NG2R62 1 0.352795892384 0.093557084179
+ CTL1 NG2R67 1 0.334087019303 0.187114168357
+ CTL1 NG2RC0 1 0.334087019303 0.187114168357
+ CTL1 NG301 1 0.347450500075 0.078275472531
+ CTL1 NG311 1 0.347450500075 0.088756043175
+ CTL1 NG321 1 0.346559601357 0.102486650838
+ CTL1 NG331 1 0.345668702638 0.110698234855
+ CTL1 NG3C51 1 0.334087019303 0.187114168357
+ CTL1 NG3N1 1 0.351904993665 0.102486650838
+ CTL1 NG3P0 1 0.334087019303 0.187114168357
+ CTL1 NG3P1 1 0.334087019303 0.187114168357
+ CTL1 NG3P2 1 0.334087019303 0.187114168357
+ CTL1 NG3P3 1 0.334087019303 0.187114168357
+ CTL1 OG2D1 1 0.293996576986 0.144938011577
+ CTL1 OG2D2 1 0.320723538531 0.144938011577
+ CTL1 OG2D3 1 0.293996576986 0.144938011577
+ CTL1 OG2D4 1 0.320723538531 0.144938011577
+ CTL1 OG2D5 1 0.320010819556 0.169954883425
+ CTL1 OG2N1 1 0.320723538531 0.144938011577
+ CTL1 OG2P1 1 0.320723538531 0.144938011577
+ CTL1 OG2R50 1 0.320723538531 0.144938011577
+ CTL1 OG3R60 1 0.316269044940 0.132309697301
+ CTL1 OG301 1 0.316269044940 0.132309697301
+ CTL1 OG302 1 0.316269044940 0.132309697301
+ CTL1 OG303 1 0.316269044940 0.132309697301
+ CTL1 OG304 1 0.316269044940 0.132309697301
+ CTL1 OG311 1 0.326514380198 0.183381431383
+ CTL1 OG312 1 0.325178032121 0.144938011577
+ CTL1 OG3C31 1 0.316269044940 0.132309697301
+ CTL1 OG3C51 1 0.316269044940 0.132309697301
+ CTL1 OG3C61 1 0.316269044940 0.132309697301
+ CTL1 SG2D1 1 0.351904993665 0.314496560236
+ CTL1 SG2R50 1 0.347450500075 0.280671252536
+ CTL1 SG311 1 0.347450500075 0.280671252536
+ CTL1 SG301 1 0.345223253279 0.257919081884
+ CTL1 SG302 1 0.365268474438 0.286840588481
+ CTL1 SG3O1 1 0.356359487256 0.286840588481
+ CTL1 SG3O2 1 0.347450500075 0.247528778125
+ CTL1 SG3O3 1 0.347450500075 0.247528778125
+ CTL1 FGA1 1 0.314487247504 0.153729976257
+ CTL1 FGA2 1 0.314487247504 0.135577095411
+ CTL1 FGA3 1 0.311814551349 0.130309939452
+ CTL1 FGP1 1 0.311814551349 0.130309939452
+ CTL1 FGR1 1 0.320723538531 0.144938011577
+ CTL1 CLGA1 1 0.339432411611 0.245040988571
+ CTL1 CLGA3 1 0.339432411611 0.232955260941
+ CTL1 CLGR1 1 0.341214209048 0.236682781799
+ CTL1 BRGA1 1 0.344777803920 0.289876023155
+ CTL1 BRGA2 1 0.351904993665 0.304599797767
+ CTL1 BRGA3 1 0.347450500075 0.307459952514
+ CTL1 BRGR1 1 0.353686791102 0.271154190821
+ CTL1 IGR1 1 0.364377575719 0.310293744700
+ CTL1 PG0 1 0.360813980847 0.320014464673
+ CTL1 PG1 1 0.360813980847 0.320014464673
+ CTL1 PG2 1 0.360813980847 0.320014464673
+ CTL1 ALG1 1 0.347450500075 0.337324864189
+ CTL1 CC301 1 0.338541512893 0.041840000000
+ CTL1 CC3062 1 0.338541512893 0.041840000000
+ CTL1 CC311 1 0.338541512893 0.041840000000
+ CTL1 CC3161 1 0.338541512893 0.041840000000
+ CTL1 CC3162 1 0.338541512893 0.041840000000
+ CTL1 CC3163 1 0.338541512893 0.041840000000
+ CTL1 CC321 1 0.338541512893 0.041840000000
+ CTL1 CC3261 1 0.338541512893 0.041840000000
+ CTL1 CC3263 1 0.338541512893 0.041840000000
+ CTL1 CC331 1 0.338541512893 0.041840000000
+ CTL1 CC2O1 1 0.347450500075 0.138767581228
+ CTL1 CC2O2 1 0.347450500075 0.110698234855
+ CTL1 CC2O3 1 0.347450500075 0.125520000000
+ CTL1 CC2O4 1 0.329632525712 0.102486650838
+ CTL1 OC2D1 1 0.293996576986 0.144938011577
+ CTL1 OC2D2 1 0.320723538531 0.144938011577
+ CTL1 OC2D3 1 0.293996576986 0.144938011577
+ CTL1 OC2D4 1 0.293996576986 0.144938011577
+ CTL1 OC3C61 1 0.316269044940 0.132309697301
+ CTL1 OC311 1 0.326514380198 0.183381431383
+ CTL1 NC2D1 1 0.307360057758 0.187114168357
+ CTL1 HCP1 1 0.189271432669 0.089736802707
+ CTL1 HCA1 1 0.288651184677 0.088756043175
+ CTL1 HCA2 1 0.288651184677 0.078275472531
+ CTL1 HCA3 1 0.288651184677 0.064818249282
+ CTL1 CC312 1 0.338541512893 0.041840000000
+ CTL1 CC322 1 0.338541512893 0.041840000000
+ CTL1 HCR1 1 0.240542653898 0.089736802707
+ CTL1 HCA3M 1 0.288651184677 0.064818249282
+ CTL1 CC321C 1 0.338541512893 0.041840000000
+ CTL1 CC321D 1 0.338541512893 0.041840000000
+ CTL1 CC311C 1 0.338541512893 0.041840000000
+ CTL1 CC311D 1 0.338541512893 0.041840000000
+ CTL1 OC301 1 0.316269044940 0.132309697301
+ CTL1 OC302 1 0.316269044940 0.132309697301
+ CTL1 HCP1M 1 0.189271432669 0.089736802707
+ CTL1 OC311M 1 0.326514380198 0.183381431383
+ CTL1 OC3C5M 1 0.316269044940 0.132309697301
+ CTL1 CC322C 1 0.338541512893 0.041840000000
+ CTL1 HCA2C2 1 0.285087589805 0.078275472531
+ CTL1 CC312C 1 0.338541512893 0.041840000000
+ CTL1 HCA1C2 1 0.288651184677 0.088756043175
+ CTL1 OC3C51 1 0.316269044940 0.132309697301
+ CTL1 CC3152 1 0.338541512893 0.041840000000
+ CTL1 CC3051 1 0.338541512893 0.041840000000
+ CTL1 CC3251 1 0.338541512893 0.041840000000
+ CTL1 CC3151 1 0.338541512893 0.041840000000
+ CTL1 CC3153 1 0.338541512893 0.041840000000
+ CTL1 OC2DP 1 0.320723538531 0.144938011577
+ CTL1 OC312 1 0.326959829558 0.163176000000
+ CTL1 OC30P 1 0.326959829558 0.163176000000
+ CTL1 PC 1 0.360813980847 0.320014464673
+ CTL1 SC 1 0.356359487256 0.286840588481
+ CTL1 CC312D 1 0.338541512893 0.041840000000
+ CTL1 OC303 1 0.316269044940 0.132309697301
+ CTL1 HN1 1 0.189271432669 0.089736802707
+ CTL1 HN2 1 0.189271432669 0.089736802707
+ CTL1 HN3 1 0.267269615442 0.089736802707
+ CTL1 HN4 1 0.189271432669 0.089736802707
+ CTL1 HN5 1 0.189271432669 0.089736802707
+ CTL1 HN6 1 0.286869387241 0.062058748940
+ CTL1 HN7 1 0.286869387241 0.062058748940
+ CTL1 HN8 1 0.288651184677 0.070011711020
+ CTL1 HN9 1 0.288651184677 0.064818249282
+ CTL1 NN1 1 0.334087019303 0.187114168357
+ CTL1 NN2 1 0.334087019303 0.187114168357
+ CTL1 NN2B 1 0.334087019303 0.187114168357
+ CTL1 NN2G 1 0.334087019303 0.187114168357
+ CTL1 NN2U 1 0.334087019303 0.187114168357
+ CTL1 NN3 1 0.334087019303 0.187114168357
+ CTL1 NN3A 1 0.334087019303 0.187114168357
+ CTL1 NN3G 1 0.334087019303 0.187114168357
+ CTL1 NN4 1 0.334087019303 0.187114168357
+ CTL1 NN6 1 0.334087019303 0.187114168357
+ CTL1 ON1 1 0.320723538531 0.144938011577
+ CTL1 ON1C 1 0.320723538531 0.144938011577
+ CTL1 ON2 1 0.326959829558 0.163176000000
+ CTL1 ON3 1 0.320723538531 0.144938011577
+ CTL1 ON4 1 0.326959829558 0.163176000000
+ CTL1 ON5 1 0.326959829558 0.163176000000
+ CTL1 ON6 1 0.326959829558 0.163176000000
+ CTL1 ON6B 1 0.326959829558 0.163176000000
+ CTL1 CN1 1 0.338541512893 0.132309697301
+ CTL1 CN1T 1 0.338541512893 0.132309697301
+ CTL1 CN2 1 0.338541512893 0.132309697301
+ CTL1 CN3 1 0.338541512893 0.125520000000
+ CTL1 CN3T 1 0.338541512893 0.125520000000
+ CTL1 CN4 1 0.338541512893 0.114583559030
+ CTL1 CN5 1 0.338541512893 0.114583559030
+ CTL1 CN5G 1 0.338541512893 0.114583559030
+ CTL1 CN7 1 0.338541512893 0.041840000000
+ CTL1 CN7B 1 0.338541512893 0.041840000000
+ CTL1 CN8 1 0.338541512893 0.041840000000
+ CTL1 CN8B 1 0.338541512893 0.041840000000
+ CTL1 CN9 1 0.338541512893 0.041840000000
+ CTL1 P 1 0.360813980847 0.320014464673
+ CTL1 P2 1 0.360813980847 0.320014464673
+ CTL1 HOL 1 0.189271432669 0.089736802707
+ CTL1 HAL1 1 0.286869387241 0.062058748940
+ CTL1 HAL2 1 0.288651184677 0.070011711020
+ CTL1 HAL3 1 0.288651184677 0.064818249282
+ CTL1 HBL 1 0.286869387241 0.062058748940
+ CTL1 HCL 1 0.189271432669 0.089736802707
+ CTL1 HL 1 0.231633666716 0.089736802707
+ CTL1 HEL1 1 0.280633096214 0.073666921749
+ CTL1 HEL2 1 0.281523994932 0.067464972838
+ CTL1 CL 1 0.347450500075 0.110698234855
+ CTL1 CCL 1 0.347450500075 0.110698234855
+ CTL1 CTL1 1 0.338541512893 0.041840000000
+ CTL1 CTL2 1 0.338541512893 0.041840000000
+ CTL1 CTL3 1 0.338541512893 0.041840000000
+ CTL1 CTL5 1 0.338541512893 0.041840000000
+ CTL1 CEL1 1 0.355468588538 0.109105371453
+ CTL1 CEL2 1 0.354577689820 0.105847757841
+ CTL1 CRL1 1 0.338541512893 0.041840000000
+ CTL1 CRL2 1 0.338541512893 0.041840000000
+ CTL1 OBL 1 0.293996576986 0.144938011577
+ CTL1 OCL 1 0.320723538531 0.144938011577
+ CTL1 O2L 1 0.320723538531 0.144938011577
+ CTL1 OHL 1 0.326959829558 0.163176000000
+ CTL1 OSL 1 0.316269044940 0.132309697301
+ CTL1 OSLP 1 0.316269044940 0.132309697301
+ CTL1 NH3L 1 0.334087019303 0.187114168357
+ CTL1 NTL 1 0.334087019303 0.187114168357
+ CTL1 SL 1 0.356359487256 0.286840588481
+ CTL1 PL 1 0.360813980847 0.320014464673
+ CTL1 HCA1A 1 0.288651184677 0.088756043175
+ CTL1 HCA2A 1 0.288651184677 0.078275472531
+ CTL1 HCA3A 1 0.288651184677 0.064818249282
+ CTL1 CC30A 1 0.338541512893 0.041840000000
+ CTL1 CC31A 1 0.338541512893 0.041840000000
+ CTL1 CC32A 1 0.338541512893 0.041840000000
+ CTL1 CC33A 1 0.338541512893 0.041840000000
+ CTL1 CC326A 1 0.338541512893 0.041840000000
+ CTL1 HCA25A 1 0.285087589805 0.078275472531
+ CTL1 CC325A 1 0.338541512893 0.041840000000
+ CTL1 CC325B 1 0.338541512893 0.041840000000
+ CTL1 OC305A 1 0.316269044940 0.132309697301
+ CTL1 OC30A 1 0.316269044940 0.132309697301
+ CTL1 CPA 1 0.329632525712 0.125520000000
+ CTL1 CPB 1 0.329632525712 0.125520000000
+ CTL1 CPM 1 0.329632525712 0.125520000000
+ CTL1 CM 1 0.356359487256 0.138767581228
+ CTL1 CST 1 0.308518226092 0.100764063435
+ CTL1 NPH 1 0.334087019303 0.187114168357
+ CTL1 OM 1 0.320723538531 0.144938011577
+ CTL1 OST 1 0.320010819556 0.169954883425
+ CTL1 FE 1 0.227179173126 0.000000000000
+ CTL1 ON2B 1 0.326959829558 0.163176000000
+ CTL1 SP 1 0.365268474438 0.280671252536
+ CTL2 C 1 0.347450500075 0.138767581228
+ CTL2 CA 1 0.346773417049 0.110698234855
+ CTL2 CC 1 0.347450500075 0.110698234855
+ CTL2 CD 1 0.347450500075 0.110698234855
+ CTL2 CE1 1 0.355468588538 0.109105371453
+ CTL2 CE2 1 0.354577689820 0.105847757841
+ CTL2 CP1 1 0.338541512893 0.041840000000
+ CTL2 CP2 1 0.338541512893 0.041840000000
+ CTL2 CP3 1 0.338541512893 0.041840000000
+ CTL2 CPH1 1 0.329632525712 0.093557084179
+ CTL2 CPH2 1 0.329632525712 0.093557084179
+ CTL2 CS 1 0.365268474438 0.138767581228
+ CTL2 CPT 1 0.334977918021 0.131646486622
+ CTL2 CY 1 0.346559601357 0.113045454929
+ CTL2 CAI 1 0.346559601357 0.113045454929
+ CTL2 CT 1 0.338541512893 0.041840000000
+ CTL2 CT1 1 0.338541512893 0.041840000000
+ CTL2 CT2 1 0.338541512893 0.041840000000
+ CTL2 CT2A 1 0.338541512893 0.041840000000
+ CTL2 CT3 1 0.338541512893 0.041840000000
+ CTL2 H 1 0.189271432669 0.089736802707
+ CTL2 HA 1 0.286869387241 0.062058748940
+ CTL2 HB1 1 0.286869387241 0.062058748940
+ CTL2 HB2 1 0.288651184677 0.070011711020
+ CTL2 HE1 1 0.280633096214 0.073666921749
+ CTL2 HE2 1 0.281523994932 0.067464972838
+ CTL2 HC 1 0.189271432669 0.089736802707
+ CTL2 HP 1 0.290272620344 0.072469005789
+ CTL2 HR1 1 0.249451641079 0.089736802707
+ CTL2 HR2 1 0.231633666716 0.089736802707
+ CTL2 HR3 1 0.300054688270 0.036952087465
+ CTL2 HS 1 0.209361198763 0.132309697301
+ CTL2 HA1 1 0.288651184677 0.088756043175
+ CTL2 HA2 1 0.288651184677 0.077149148019
+ CTL2 HA3 1 0.288651184677 0.064818249282
+ CTL2 N 1 0.334087019303 0.004184000000
+ CTL2 NC2 1 0.334087019303 0.187114168357
+ CTL2 NH1 1 0.307360057758 0.187114168357
+ CTL2 NH2 1 0.334087019303 0.187114168357
+ CTL2 NH3 1 0.334087019303 0.187114168357
+ CTL2 NP 1 0.334087019303 0.187114168357
+ CTL2 NR1 1 0.334087019303 0.187114168357
+ CTL2 NR2 1 0.334087019303 0.187114168357
+ CTL2 NR3 1 0.334087019303 0.187114168357
+ CTL2 NY 1 0.334087019303 0.187114168357
+ CTL2 O 1 0.293996576986 0.144938011577
+ CTL2 OB 1 0.293996576986 0.144938011577
+ CTL2 OC 1 0.320723538531 0.144938011577
+ CTL2 OH1 1 0.326959829558 0.163176000000
+ CTL2 OS 1 0.326959829558 0.163176000000
+ CTL2 S 1 0.347450500075 0.280671252536
+ CTL2 SM 1 0.345223253279 0.257919081884
+ CTL2 SS 1 0.365268474438 0.286840588481
+ CTL2 HT 1 0.189271432669 0.089736802707
+ CTL2 OT 1 0.326799467788 0.163176000000
+ CTL2 OX 1 0.320723538531 0.144938011577
+ CTL2 HX 1 0.189271432669 0.089736802707
+ CTL2 LIT 1 0.284864865125 0.020196198771
+ CTL2 SOD 1 0.294954293108 0.090610410351
+ CTL2 MG 1 0.274842254546 0.051243325419
+ CTL2 POT 1 0.326403017859 0.123410269913
+ CTL2 CAL 1 0.291056611216 0.144938011577
+ CTL2 RUB 1 0.338541512893 0.162045623205
+ CTL2 CES 1 0.356359487256 0.182376331798
+ CTL2 BAR 1 0.337650614175 0.162045623205
+ CTL2 ZN 1 0.266378716724 0.209200000000
+ CTL2 CAD 1 0.290165712498 0.144938011577
+ CTL2 CLA 1 0.371504765465 0.162045623205
+ CTL2 HGA1 1 0.288651184677 0.088756043175
+ CTL2 HGA2 1 0.288651184677 0.078275472531
+ CTL2 HGA3 1 0.288651184677 0.064818249282
+ CTL2 HGA4 1 0.280633096214 0.073666921749
+ CTL2 HGA5 1 0.281523994932 0.067464972838
+ CTL2 HGA6 1 0.286869387241 0.070011711020
+ CTL2 HGA7 1 0.285087589805 0.072469005789
+ CTL2 HGAAM0 1 0.283305792369 0.070011711020
+ CTL2 HGAAM1 1 0.283305792369 0.070011711020
+ CTL2 HGAAM2 1 0.281523994932 0.083680000000
+ CTL2 HGP1 1 0.189271432669 0.089736802707
+ CTL2 HGP2 1 0.189271432669 0.089736802707
+ CTL2 HGP3 1 0.209361198763 0.132309697301
+ CTL2 HGP4 1 0.189271432669 0.089736802707
+ CTL2 HGP5 1 0.231633666716 0.089736802707
+ CTL2 HGPAM1 1 0.247224394284 0.039692909190
+ CTL2 HGPAM2 1 0.247224394284 0.041840000000
+ CTL2 HGPAM3 1 0.246778944925 0.045833423612
+ CTL2 HGR51 1 0.290272620344 0.072469005789
+ CTL2 HGR52 1 0.249451641079 0.089736802707
+ CTL2 HGR53 1 0.231633666716 0.089736802707
+ CTL2 HGR61 1 0.290272620344 0.072469005789
+ CTL2 HGR62 1 0.267269615442 0.089736802707
+ CTL2 HGR63 1 0.249451641079 0.089736802707
+ CTL2 HGR71 1 0.290272620344 0.072469005789
+ CTL2 CG1T1 1 0.333196120584 0.170981810495
+ CTL2 CG1T2 1 0.346782326036 0.134409982486
+ CTL2 CG1N1 1 0.335868816739 0.177512086349
+ CTL2 CG2D1 1 0.355468588538 0.109105371453
+ CTL2 CG2D2 1 0.354577689820 0.105847757841
+ CTL2 CG2D1O 1 0.355468588538 0.109105371453
+ CTL2 CG2D2O 1 0.355468588538 0.109105371453
+ CTL2 CG2DC1 1 0.355468588538 0.109105371453
+ CTL2 CG2DC2 1 0.355468588538 0.109105371453
+ CTL2 CG2DC3 1 0.354577689820 0.105847757841
+ CTL2 CG25C1 1 0.355468588538 0.109105371453
+ CTL2 CG25C2 1 0.355468588538 0.109105371453
+ CTL2 CG251O 1 0.355468588538 0.109105371453
+ CTL2 CG252O 1 0.355468588538 0.109105371453
+ CTL2 CG2N1 1 0.347450500075 0.138767581228
+ CTL2 CG2N2 1 0.347450500075 0.138767581228
+ CTL2 CG2O1 1 0.347450500075 0.138767581228
+ CTL2 CG2O2 1 0.320723538531 0.130979917850
+ CTL2 CG2O3 1 0.347450500075 0.110698234855
+ CTL2 CG2O4 1 0.329632525712 0.102486650838
+ CTL2 CG2O5 1 0.347450500075 0.125520000000
+ CTL2 CG2O6 1 0.347450500075 0.110698234855
+ CTL2 CG2O7 1 0.308518226092 0.100764063435
+ CTL2 CG2R51 1 0.356359487256 0.093557084179
+ CTL2 CG2R52 1 0.365268474438 0.059170695450
+ CTL2 CG2R53 1 0.365268474438 0.059170695450
+ CTL2 CG2R57 1 0.356359487256 0.093557084179
+ CTL2 CG2R61 1 0.346773417049 0.110698234855
+ CTL2 CG2R62 1 0.338541512893 0.125520000000
+ CTL2 CG2R63 1 0.338541512893 0.132309697301
+ CTL2 CG2R64 1 0.356359487256 0.083680000000
+ CTL2 CG2R66 1 0.338541512893 0.110698234855
+ CTL2 CG2R67 1 0.346773417049 0.110698234855
+ CTL2 CG2RC0 1 0.334977918021 0.131646486622
+ CTL2 CG2R71 1 0.346987232741 0.108300154755
+ CTL2 CG2RC7 1 0.334977918021 0.131646486622
+ CTL2 CG301 1 0.338541512893 0.041840000000
+ CTL2 CG302 1 0.374177461619 0.059170695450
+ CTL2 CG311 1 0.338541512893 0.041840000000
+ CTL2 CG312 1 0.351904993665 0.085746484010
+ CTL2 CG314 1 0.338541512893 0.041840000000
+ CTL2 CG321 1 0.338541512893 0.041840000000
+ CTL2 CG322 1 0.338541512893 0.102486650838
+ CTL2 CG323 1 0.365268474438 0.138767581228
+ CTL2 CG324 1 0.338541512893 0.041840000000
+ CTL2 CG331 1 0.338541512893 0.041840000000
+ CTL2 CG334 1 0.338541512893 0.041840000000
+ CTL2 CG3C50 1 0.338541512893 0.041840000000
+ CTL2 CG3C51 1 0.338541512893 0.041840000000
+ CTL2 CG3C52 1 0.338541512893 0.041840000000
+ CTL2 CG3C53 1 0.338541512893 0.041840000000
+ CTL2 CG3C54 1 0.338541512893 0.041840000000
+ CTL2 CG3C31 1 0.338541512893 0.041840000000
+ CTL2 CG3C41 1 0.338541512893 0.041840000000
+ CTL2 CG3RC1 1 0.338541512893 0.041840000000
+ CTL2 CG3AM0 1 0.344777803920 0.110698234855
+ CTL2 CG3AM1 1 0.345668702638 0.116852760686
+ CTL2 CG3AM2 1 0.346559601357 0.118341390899
+ CTL2 NG1T1 1 0.328741626994 0.177512086349
+ CTL2 NG2D1 1 0.334087019303 0.187114168357
+ CTL2 NG2S0 1 0.334087019303 0.004184000000
+ CTL2 NG2S1 1 0.307360057758 0.187114168357
+ CTL2 NG2S2 1 0.334087019303 0.187114168357
+ CTL2 NG2S3 1 0.334087019303 0.187114168357
+ CTL2 NG2O1 1 0.334087019303 0.187114168357
+ CTL2 NG2P1 1 0.334087019303 0.187114168357
+ CTL2 NG2R43 1 0.334087019303 0.187114168357
+ CTL2 NG2R50 1 0.334087019303 0.187114168357
+ CTL2 NG2R51 1 0.334087019303 0.187114168357
+ CTL2 NG2R52 1 0.334087019303 0.187114168357
+ CTL2 NG2R53 1 0.334087019303 0.187114168357
+ CTL2 NG2R57 1 0.334087019303 0.187114168357
+ CTL2 NG2R60 1 0.337650614175 0.102486650838
+ CTL2 NG2R61 1 0.334087019303 0.187114168357
+ CTL2 NG2R62 1 0.352795892384 0.093557084179
+ CTL2 NG2R67 1 0.334087019303 0.187114168357
+ CTL2 NG2RC0 1 0.334087019303 0.187114168357
+ CTL2 NG301 1 0.347450500075 0.078275472531
+ CTL2 NG311 1 0.347450500075 0.088756043175
+ CTL2 NG321 1 0.346559601357 0.102486650838
+ CTL2 NG331 1 0.345668702638 0.110698234855
+ CTL2 NG3C51 1 0.334087019303 0.187114168357
+ CTL2 NG3N1 1 0.351904993665 0.102486650838
+ CTL2 NG3P0 1 0.334087019303 0.187114168357
+ CTL2 NG3P1 1 0.334087019303 0.187114168357
+ CTL2 NG3P2 1 0.334087019303 0.187114168357
+ CTL2 NG3P3 1 0.334087019303 0.187114168357
+ CTL2 OG2D1 1 0.293996576986 0.144938011577
+ CTL2 OG2D2 1 0.320723538531 0.144938011577
+ CTL2 OG2D3 1 0.293996576986 0.144938011577
+ CTL2 OG2D4 1 0.320723538531 0.144938011577
+ CTL2 OG2D5 1 0.320010819556 0.169954883425
+ CTL2 OG2N1 1 0.320723538531 0.144938011577
+ CTL2 OG2P1 1 0.320723538531 0.144938011577
+ CTL2 OG2R50 1 0.320723538531 0.144938011577
+ CTL2 OG3R60 1 0.316269044940 0.132309697301
+ CTL2 OG301 1 0.316269044940 0.132309697301
+ CTL2 OG302 1 0.316269044940 0.132309697301
+ CTL2 OG303 1 0.316269044940 0.132309697301
+ CTL2 OG304 1 0.316269044940 0.132309697301
+ CTL2 OG311 1 0.326514380198 0.183381431383
+ CTL2 OG312 1 0.325178032121 0.144938011577
+ CTL2 OG3C31 1 0.316269044940 0.132309697301
+ CTL2 OG3C51 1 0.316269044940 0.132309697301
+ CTL2 OG3C61 1 0.316269044940 0.132309697301
+ CTL2 SG2D1 1 0.351904993665 0.314496560236
+ CTL2 SG2R50 1 0.347450500075 0.280671252536
+ CTL2 SG311 1 0.347450500075 0.280671252536
+ CTL2 SG301 1 0.345223253279 0.257919081884
+ CTL2 SG302 1 0.365268474438 0.286840588481
+ CTL2 SG3O1 1 0.356359487256 0.286840588481
+ CTL2 SG3O2 1 0.347450500075 0.247528778125
+ CTL2 SG3O3 1 0.347450500075 0.247528778125
+ CTL2 FGA1 1 0.314487247504 0.153729976257
+ CTL2 FGA2 1 0.314487247504 0.135577095411
+ CTL2 FGA3 1 0.311814551349 0.130309939452
+ CTL2 FGP1 1 0.311814551349 0.130309939452
+ CTL2 FGR1 1 0.320723538531 0.144938011577
+ CTL2 CLGA1 1 0.339432411611 0.245040988571
+ CTL2 CLGA3 1 0.339432411611 0.232955260941
+ CTL2 CLGR1 1 0.341214209048 0.236682781799
+ CTL2 BRGA1 1 0.344777803920 0.289876023155
+ CTL2 BRGA2 1 0.351904993665 0.304599797767
+ CTL2 BRGA3 1 0.347450500075 0.307459952514
+ CTL2 BRGR1 1 0.353686791102 0.271154190821
+ CTL2 IGR1 1 0.364377575719 0.310293744700
+ CTL2 PG0 1 0.360813980847 0.320014464673
+ CTL2 PG1 1 0.360813980847 0.320014464673
+ CTL2 PG2 1 0.360813980847 0.320014464673
+ CTL2 ALG1 1 0.347450500075 0.337324864189
+ CTL2 CC301 1 0.338541512893 0.041840000000
+ CTL2 CC3062 1 0.338541512893 0.041840000000
+ CTL2 CC311 1 0.338541512893 0.041840000000
+ CTL2 CC3161 1 0.338541512893 0.041840000000
+ CTL2 CC3162 1 0.338541512893 0.041840000000
+ CTL2 CC3163 1 0.338541512893 0.041840000000
+ CTL2 CC321 1 0.338541512893 0.041840000000
+ CTL2 CC3261 1 0.338541512893 0.041840000000
+ CTL2 CC3263 1 0.338541512893 0.041840000000
+ CTL2 CC331 1 0.338541512893 0.041840000000
+ CTL2 CC2O1 1 0.347450500075 0.138767581228
+ CTL2 CC2O2 1 0.347450500075 0.110698234855
+ CTL2 CC2O3 1 0.347450500075 0.125520000000
+ CTL2 CC2O4 1 0.329632525712 0.102486650838
+ CTL2 OC2D1 1 0.293996576986 0.144938011577
+ CTL2 OC2D2 1 0.320723538531 0.144938011577
+ CTL2 OC2D3 1 0.293996576986 0.144938011577
+ CTL2 OC2D4 1 0.293996576986 0.144938011577
+ CTL2 OC3C61 1 0.316269044940 0.132309697301
+ CTL2 OC311 1 0.326514380198 0.183381431383
+ CTL2 NC2D1 1 0.307360057758 0.187114168357
+ CTL2 HCP1 1 0.189271432669 0.089736802707
+ CTL2 HCA1 1 0.288651184677 0.088756043175
+ CTL2 HCA2 1 0.288651184677 0.078275472531
+ CTL2 HCA3 1 0.288651184677 0.064818249282
+ CTL2 CC312 1 0.338541512893 0.041840000000
+ CTL2 CC322 1 0.338541512893 0.041840000000
+ CTL2 HCR1 1 0.240542653898 0.089736802707
+ CTL2 HCA3M 1 0.288651184677 0.064818249282
+ CTL2 CC321C 1 0.338541512893 0.041840000000
+ CTL2 CC321D 1 0.338541512893 0.041840000000
+ CTL2 CC311C 1 0.338541512893 0.041840000000
+ CTL2 CC311D 1 0.338541512893 0.041840000000
+ CTL2 OC301 1 0.316269044940 0.132309697301
+ CTL2 OC302 1 0.316269044940 0.132309697301
+ CTL2 HCP1M 1 0.189271432669 0.089736802707
+ CTL2 OC311M 1 0.326514380198 0.183381431383
+ CTL2 OC3C5M 1 0.316269044940 0.132309697301
+ CTL2 CC322C 1 0.338541512893 0.041840000000
+ CTL2 HCA2C2 1 0.285087589805 0.078275472531
+ CTL2 CC312C 1 0.338541512893 0.041840000000
+ CTL2 HCA1C2 1 0.288651184677 0.088756043175
+ CTL2 OC3C51 1 0.316269044940 0.132309697301
+ CTL2 CC3152 1 0.338541512893 0.041840000000
+ CTL2 CC3051 1 0.338541512893 0.041840000000
+ CTL2 CC3251 1 0.338541512893 0.041840000000
+ CTL2 CC3151 1 0.338541512893 0.041840000000
+ CTL2 CC3153 1 0.338541512893 0.041840000000
+ CTL2 OC2DP 1 0.320723538531 0.144938011577
+ CTL2 OC312 1 0.326959829558 0.163176000000
+ CTL2 OC30P 1 0.326959829558 0.163176000000
+ CTL2 PC 1 0.360813980847 0.320014464673
+ CTL2 SC 1 0.356359487256 0.286840588481
+ CTL2 CC312D 1 0.338541512893 0.041840000000
+ CTL2 OC303 1 0.316269044940 0.132309697301
+ CTL2 HN1 1 0.189271432669 0.089736802707
+ CTL2 HN2 1 0.189271432669 0.089736802707
+ CTL2 HN3 1 0.267269615442 0.089736802707
+ CTL2 HN4 1 0.189271432669 0.089736802707
+ CTL2 HN5 1 0.189271432669 0.089736802707
+ CTL2 HN6 1 0.286869387241 0.062058748940
+ CTL2 HN7 1 0.286869387241 0.062058748940
+ CTL2 HN8 1 0.288651184677 0.070011711020
+ CTL2 HN9 1 0.288651184677 0.064818249282
+ CTL2 NN1 1 0.334087019303 0.187114168357
+ CTL2 NN2 1 0.334087019303 0.187114168357
+ CTL2 NN2B 1 0.334087019303 0.187114168357
+ CTL2 NN2G 1 0.334087019303 0.187114168357
+ CTL2 NN2U 1 0.334087019303 0.187114168357
+ CTL2 NN3 1 0.334087019303 0.187114168357
+ CTL2 NN3A 1 0.334087019303 0.187114168357
+ CTL2 NN3G 1 0.334087019303 0.187114168357
+ CTL2 NN4 1 0.334087019303 0.187114168357
+ CTL2 NN6 1 0.334087019303 0.187114168357
+ CTL2 ON1 1 0.320723538531 0.144938011577
+ CTL2 ON1C 1 0.320723538531 0.144938011577
+ CTL2 ON2 1 0.326959829558 0.163176000000
+ CTL2 ON3 1 0.320723538531 0.144938011577
+ CTL2 ON4 1 0.326959829558 0.163176000000
+ CTL2 ON5 1 0.326959829558 0.163176000000
+ CTL2 ON6 1 0.326959829558 0.163176000000
+ CTL2 ON6B 1 0.326959829558 0.163176000000
+ CTL2 CN1 1 0.338541512893 0.132309697301
+ CTL2 CN1T 1 0.338541512893 0.132309697301
+ CTL2 CN2 1 0.338541512893 0.132309697301
+ CTL2 CN3 1 0.338541512893 0.125520000000
+ CTL2 CN3T 1 0.338541512893 0.125520000000
+ CTL2 CN4 1 0.338541512893 0.114583559030
+ CTL2 CN5 1 0.338541512893 0.114583559030
+ CTL2 CN5G 1 0.338541512893 0.114583559030
+ CTL2 CN7 1 0.338541512893 0.041840000000
+ CTL2 CN7B 1 0.338541512893 0.041840000000
+ CTL2 CN8 1 0.338541512893 0.041840000000
+ CTL2 CN8B 1 0.338541512893 0.041840000000
+ CTL2 CN9 1 0.338541512893 0.041840000000
+ CTL2 P 1 0.360813980847 0.320014464673
+ CTL2 P2 1 0.360813980847 0.320014464673
+ CTL2 HOL 1 0.189271432669 0.089736802707
+ CTL2 HAL1 1 0.286869387241 0.062058748940
+ CTL2 HAL2 1 0.288651184677 0.070011711020
+ CTL2 HAL3 1 0.288651184677 0.064818249282
+ CTL2 HBL 1 0.286869387241 0.062058748940
+ CTL2 HCL 1 0.189271432669 0.089736802707
+ CTL2 HL 1 0.231633666716 0.089736802707
+ CTL2 HEL1 1 0.280633096214 0.073666921749
+ CTL2 HEL2 1 0.281523994932 0.067464972838
+ CTL2 CL 1 0.347450500075 0.110698234855
+ CTL2 CCL 1 0.347450500075 0.110698234855
+ CTL2 CTL1 1 0.338541512893 0.041840000000
+ CTL2 CTL2 1 0.338541512893 0.041840000000
+ CTL2 CTL3 1 0.338541512893 0.041840000000
+ CTL2 CTL5 1 0.338541512893 0.041840000000
+ CTL2 CEL1 1 0.355468588538 0.109105371453
+ CTL2 CEL2 1 0.354577689820 0.105847757841
+ CTL2 CRL1 1 0.338541512893 0.041840000000
+ CTL2 CRL2 1 0.338541512893 0.041840000000
+ CTL2 OBL 1 0.293996576986 0.144938011577
+ CTL2 OCL 1 0.320723538531 0.144938011577
+ CTL2 O2L 1 0.320723538531 0.144938011577
+ CTL2 OHL 1 0.326959829558 0.163176000000
+ CTL2 OSL 1 0.316269044940 0.132309697301
+ CTL2 OSLP 1 0.316269044940 0.132309697301
+ CTL2 NH3L 1 0.334087019303 0.187114168357
+ CTL2 NTL 1 0.334087019303 0.187114168357
+ CTL2 SL 1 0.356359487256 0.286840588481
+ CTL2 PL 1 0.360813980847 0.320014464673
+ CTL2 HCA1A 1 0.288651184677 0.088756043175
+ CTL2 HCA2A 1 0.288651184677 0.078275472531
+ CTL2 HCA3A 1 0.288651184677 0.064818249282
+ CTL2 CC30A 1 0.338541512893 0.041840000000
+ CTL2 CC31A 1 0.338541512893 0.041840000000
+ CTL2 CC32A 1 0.338541512893 0.041840000000
+ CTL2 CC33A 1 0.338541512893 0.041840000000
+ CTL2 CC326A 1 0.338541512893 0.041840000000
+ CTL2 HCA25A 1 0.285087589805 0.078275472531
+ CTL2 CC325A 1 0.338541512893 0.041840000000
+ CTL2 CC325B 1 0.338541512893 0.041840000000
+ CTL2 OC305A 1 0.316269044940 0.132309697301
+ CTL2 OC30A 1 0.316269044940 0.132309697301
+ CTL2 CPA 1 0.329632525712 0.125520000000
+ CTL2 CPB 1 0.329632525712 0.125520000000
+ CTL2 CPM 1 0.329632525712 0.125520000000
+ CTL2 CM 1 0.356359487256 0.138767581228
+ CTL2 CST 1 0.308518226092 0.100764063435
+ CTL2 NPH 1 0.334087019303 0.187114168357
+ CTL2 OM 1 0.320723538531 0.144938011577
+ CTL2 OST 1 0.320010819556 0.169954883425
+ CTL2 FE 1 0.227179173126 0.000000000000
+ CTL2 ON2B 1 0.326959829558 0.163176000000
+ CTL2 SP 1 0.365268474438 0.280671252536
+ CTL3 C 1 0.347450500075 0.138767581228
+ CTL3 CA 1 0.346773417049 0.110698234855
+ CTL3 CC 1 0.347450500075 0.110698234855
+ CTL3 CD 1 0.347450500075 0.110698234855
+ CTL3 CE1 1 0.355468588538 0.109105371453
+ CTL3 CE2 1 0.354577689820 0.105847757841
+ CTL3 CP1 1 0.338541512893 0.041840000000
+ CTL3 CP2 1 0.338541512893 0.041840000000
+ CTL3 CP3 1 0.338541512893 0.041840000000
+ CTL3 CPH1 1 0.329632525712 0.093557084179
+ CTL3 CPH2 1 0.329632525712 0.093557084179
+ CTL3 CS 1 0.365268474438 0.138767581228
+ CTL3 CPT 1 0.334977918021 0.131646486622
+ CTL3 CY 1 0.346559601357 0.113045454929
+ CTL3 CAI 1 0.346559601357 0.113045454929
+ CTL3 CT 1 0.338541512893 0.041840000000
+ CTL3 CT1 1 0.338541512893 0.041840000000
+ CTL3 CT2 1 0.338541512893 0.041840000000
+ CTL3 CT2A 1 0.338541512893 0.041840000000
+ CTL3 CT3 1 0.338541512893 0.041840000000
+ CTL3 H 1 0.189271432669 0.089736802707
+ CTL3 HA 1 0.286869387241 0.062058748940
+ CTL3 HB1 1 0.286869387241 0.062058748940
+ CTL3 HB2 1 0.288651184677 0.070011711020
+ CTL3 HE1 1 0.280633096214 0.073666921749
+ CTL3 HE2 1 0.281523994932 0.067464972838
+ CTL3 HC 1 0.189271432669 0.089736802707
+ CTL3 HP 1 0.290272620344 0.072469005789
+ CTL3 HR1 1 0.249451641079 0.089736802707
+ CTL3 HR2 1 0.231633666716 0.089736802707
+ CTL3 HR3 1 0.300054688270 0.036952087465
+ CTL3 HS 1 0.209361198763 0.132309697301
+ CTL3 HA1 1 0.288651184677 0.088756043175
+ CTL3 HA2 1 0.288651184677 0.077149148019
+ CTL3 HA3 1 0.288651184677 0.064818249282
+ CTL3 N 1 0.334087019303 0.004184000000
+ CTL3 NC2 1 0.334087019303 0.187114168357
+ CTL3 NH1 1 0.307360057758 0.187114168357
+ CTL3 NH2 1 0.334087019303 0.187114168357
+ CTL3 NH3 1 0.334087019303 0.187114168357
+ CTL3 NP 1 0.334087019303 0.187114168357
+ CTL3 NR1 1 0.334087019303 0.187114168357
+ CTL3 NR2 1 0.334087019303 0.187114168357
+ CTL3 NR3 1 0.334087019303 0.187114168357
+ CTL3 NY 1 0.334087019303 0.187114168357
+ CTL3 O 1 0.293996576986 0.144938011577
+ CTL3 OB 1 0.293996576986 0.144938011577
+ CTL3 OC 1 0.320723538531 0.144938011577
+ CTL3 OH1 1 0.326959829558 0.163176000000
+ CTL3 OS 1 0.326959829558 0.163176000000
+ CTL3 S 1 0.347450500075 0.280671252536
+ CTL3 SM 1 0.345223253279 0.257919081884
+ CTL3 SS 1 0.365268474438 0.286840588481
+ CTL3 HT 1 0.189271432669 0.089736802707
+ CTL3 OT 1 0.326799467788 0.163176000000
+ CTL3 OX 1 0.320723538531 0.144938011577
+ CTL3 HX 1 0.189271432669 0.089736802707
+ CTL3 LIT 1 0.284864865125 0.020196198771
+ CTL3 SOD 1 0.294954293108 0.090610410351
+ CTL3 MG 1 0.274842254546 0.051243325419
+ CTL3 POT 1 0.326403017859 0.123410269913
+ CTL3 CAL 1 0.291056611216 0.144938011577
+ CTL3 RUB 1 0.338541512893 0.162045623205
+ CTL3 CES 1 0.356359487256 0.182376331798
+ CTL3 BAR 1 0.337650614175 0.162045623205
+ CTL3 ZN 1 0.266378716724 0.209200000000
+ CTL3 CAD 1 0.290165712498 0.144938011577
+ CTL3 CLA 1 0.371504765465 0.162045623205
+ CTL3 HGA1 1 0.288651184677 0.088756043175
+ CTL3 HGA2 1 0.288651184677 0.078275472531
+ CTL3 HGA3 1 0.288651184677 0.064818249282
+ CTL3 HGA4 1 0.280633096214 0.073666921749
+ CTL3 HGA5 1 0.281523994932 0.067464972838
+ CTL3 HGA6 1 0.286869387241 0.070011711020
+ CTL3 HGA7 1 0.285087589805 0.072469005789
+ CTL3 HGAAM0 1 0.283305792369 0.070011711020
+ CTL3 HGAAM1 1 0.283305792369 0.070011711020
+ CTL3 HGAAM2 1 0.281523994932 0.083680000000
+ CTL3 HGP1 1 0.189271432669 0.089736802707
+ CTL3 HGP2 1 0.189271432669 0.089736802707
+ CTL3 HGP3 1 0.209361198763 0.132309697301
+ CTL3 HGP4 1 0.189271432669 0.089736802707
+ CTL3 HGP5 1 0.231633666716 0.089736802707
+ CTL3 HGPAM1 1 0.247224394284 0.039692909190
+ CTL3 HGPAM2 1 0.247224394284 0.041840000000
+ CTL3 HGPAM3 1 0.246778944925 0.045833423612
+ CTL3 HGR51 1 0.290272620344 0.072469005789
+ CTL3 HGR52 1 0.249451641079 0.089736802707
+ CTL3 HGR53 1 0.231633666716 0.089736802707
+ CTL3 HGR61 1 0.290272620344 0.072469005789
+ CTL3 HGR62 1 0.267269615442 0.089736802707
+ CTL3 HGR63 1 0.249451641079 0.089736802707
+ CTL3 HGR71 1 0.290272620344 0.072469005789
+ CTL3 CG1T1 1 0.333196120584 0.170981810495
+ CTL3 CG1T2 1 0.346782326036 0.134409982486
+ CTL3 CG1N1 1 0.335868816739 0.177512086349
+ CTL3 CG2D1 1 0.355468588538 0.109105371453
+ CTL3 CG2D2 1 0.354577689820 0.105847757841
+ CTL3 CG2D1O 1 0.355468588538 0.109105371453
+ CTL3 CG2D2O 1 0.355468588538 0.109105371453
+ CTL3 CG2DC1 1 0.355468588538 0.109105371453
+ CTL3 CG2DC2 1 0.355468588538 0.109105371453
+ CTL3 CG2DC3 1 0.354577689820 0.105847757841
+ CTL3 CG25C1 1 0.355468588538 0.109105371453
+ CTL3 CG25C2 1 0.355468588538 0.109105371453
+ CTL3 CG251O 1 0.355468588538 0.109105371453
+ CTL3 CG252O 1 0.355468588538 0.109105371453
+ CTL3 CG2N1 1 0.347450500075 0.138767581228
+ CTL3 CG2N2 1 0.347450500075 0.138767581228
+ CTL3 CG2O1 1 0.347450500075 0.138767581228
+ CTL3 CG2O2 1 0.320723538531 0.130979917850
+ CTL3 CG2O3 1 0.347450500075 0.110698234855
+ CTL3 CG2O4 1 0.329632525712 0.102486650838
+ CTL3 CG2O5 1 0.347450500075 0.125520000000
+ CTL3 CG2O6 1 0.347450500075 0.110698234855
+ CTL3 CG2O7 1 0.308518226092 0.100764063435
+ CTL3 CG2R51 1 0.356359487256 0.093557084179
+ CTL3 CG2R52 1 0.365268474438 0.059170695450
+ CTL3 CG2R53 1 0.365268474438 0.059170695450
+ CTL3 CG2R57 1 0.356359487256 0.093557084179
+ CTL3 CG2R61 1 0.346773417049 0.110698234855
+ CTL3 CG2R62 1 0.338541512893 0.125520000000
+ CTL3 CG2R63 1 0.338541512893 0.132309697301
+ CTL3 CG2R64 1 0.356359487256 0.083680000000
+ CTL3 CG2R66 1 0.338541512893 0.110698234855
+ CTL3 CG2R67 1 0.346773417049 0.110698234855
+ CTL3 CG2RC0 1 0.334977918021 0.131646486622
+ CTL3 CG2R71 1 0.346987232741 0.108300154755
+ CTL3 CG2RC7 1 0.334977918021 0.131646486622
+ CTL3 CG301 1 0.338541512893 0.041840000000
+ CTL3 CG302 1 0.374177461619 0.059170695450
+ CTL3 CG311 1 0.338541512893 0.041840000000
+ CTL3 CG312 1 0.351904993665 0.085746484010
+ CTL3 CG314 1 0.338541512893 0.041840000000
+ CTL3 CG321 1 0.338541512893 0.041840000000
+ CTL3 CG322 1 0.338541512893 0.102486650838
+ CTL3 CG323 1 0.365268474438 0.138767581228
+ CTL3 CG324 1 0.338541512893 0.041840000000
+ CTL3 CG331 1 0.338541512893 0.041840000000
+ CTL3 CG334 1 0.338541512893 0.041840000000
+ CTL3 CG3C50 1 0.338541512893 0.041840000000
+ CTL3 CG3C51 1 0.338541512893 0.041840000000
+ CTL3 CG3C52 1 0.338541512893 0.041840000000
+ CTL3 CG3C53 1 0.338541512893 0.041840000000
+ CTL3 CG3C54 1 0.338541512893 0.041840000000
+ CTL3 CG3C31 1 0.338541512893 0.041840000000
+ CTL3 CG3C41 1 0.338541512893 0.041840000000
+ CTL3 CG3RC1 1 0.338541512893 0.041840000000
+ CTL3 CG3AM0 1 0.344777803920 0.110698234855
+ CTL3 CG3AM1 1 0.345668702638 0.116852760686
+ CTL3 CG3AM2 1 0.346559601357 0.118341390899
+ CTL3 NG1T1 1 0.328741626994 0.177512086349
+ CTL3 NG2D1 1 0.334087019303 0.187114168357
+ CTL3 NG2S0 1 0.334087019303 0.004184000000
+ CTL3 NG2S1 1 0.307360057758 0.187114168357
+ CTL3 NG2S2 1 0.334087019303 0.187114168357
+ CTL3 NG2S3 1 0.334087019303 0.187114168357
+ CTL3 NG2O1 1 0.334087019303 0.187114168357
+ CTL3 NG2P1 1 0.334087019303 0.187114168357
+ CTL3 NG2R43 1 0.334087019303 0.187114168357
+ CTL3 NG2R50 1 0.334087019303 0.187114168357
+ CTL3 NG2R51 1 0.334087019303 0.187114168357
+ CTL3 NG2R52 1 0.334087019303 0.187114168357
+ CTL3 NG2R53 1 0.334087019303 0.187114168357
+ CTL3 NG2R57 1 0.334087019303 0.187114168357
+ CTL3 NG2R60 1 0.337650614175 0.102486650838
+ CTL3 NG2R61 1 0.334087019303 0.187114168357
+ CTL3 NG2R62 1 0.352795892384 0.093557084179
+ CTL3 NG2R67 1 0.334087019303 0.187114168357
+ CTL3 NG2RC0 1 0.334087019303 0.187114168357
+ CTL3 NG301 1 0.347450500075 0.078275472531
+ CTL3 NG311 1 0.347450500075 0.088756043175
+ CTL3 NG321 1 0.346559601357 0.102486650838
+ CTL3 NG331 1 0.345668702638 0.110698234855
+ CTL3 NG3C51 1 0.334087019303 0.187114168357
+ CTL3 NG3N1 1 0.351904993665 0.102486650838
+ CTL3 NG3P0 1 0.334087019303 0.187114168357
+ CTL3 NG3P1 1 0.334087019303 0.187114168357
+ CTL3 NG3P2 1 0.334087019303 0.187114168357
+ CTL3 NG3P3 1 0.334087019303 0.187114168357
+ CTL3 OG2D1 1 0.293996576986 0.144938011577
+ CTL3 OG2D2 1 0.320723538531 0.144938011577
+ CTL3 OG2D3 1 0.293996576986 0.144938011577
+ CTL3 OG2D4 1 0.320723538531 0.144938011577
+ CTL3 OG2D5 1 0.320010819556 0.169954883425
+ CTL3 OG2N1 1 0.320723538531 0.144938011577
+ CTL3 OG2P1 1 0.320723538531 0.144938011577
+ CTL3 OG2R50 1 0.320723538531 0.144938011577
+ CTL3 OG3R60 1 0.316269044940 0.132309697301
+ CTL3 OG301 1 0.316269044940 0.132309697301
+ CTL3 OG302 1 0.316269044940 0.132309697301
+ CTL3 OG303 1 0.316269044940 0.132309697301
+ CTL3 OG304 1 0.316269044940 0.132309697301
+ CTL3 OG311 1 0.326514380198 0.183381431383
+ CTL3 OG312 1 0.325178032121 0.144938011577
+ CTL3 OG3C31 1 0.316269044940 0.132309697301
+ CTL3 OG3C51 1 0.316269044940 0.132309697301
+ CTL3 OG3C61 1 0.316269044940 0.132309697301
+ CTL3 SG2D1 1 0.351904993665 0.314496560236
+ CTL3 SG2R50 1 0.347450500075 0.280671252536
+ CTL3 SG311 1 0.347450500075 0.280671252536
+ CTL3 SG301 1 0.345223253279 0.257919081884
+ CTL3 SG302 1 0.365268474438 0.286840588481
+ CTL3 SG3O1 1 0.356359487256 0.286840588481
+ CTL3 SG3O2 1 0.347450500075 0.247528778125
+ CTL3 SG3O3 1 0.347450500075 0.247528778125
+ CTL3 FGA1 1 0.314487247504 0.153729976257
+ CTL3 FGA2 1 0.314487247504 0.135577095411
+ CTL3 FGA3 1 0.311814551349 0.130309939452
+ CTL3 FGP1 1 0.311814551349 0.130309939452
+ CTL3 FGR1 1 0.320723538531 0.144938011577
+ CTL3 CLGA1 1 0.339432411611 0.245040988571
+ CTL3 CLGA3 1 0.339432411611 0.232955260941
+ CTL3 CLGR1 1 0.341214209048 0.236682781799
+ CTL3 BRGA1 1 0.344777803920 0.289876023155
+ CTL3 BRGA2 1 0.351904993665 0.304599797767
+ CTL3 BRGA3 1 0.347450500075 0.307459952514
+ CTL3 BRGR1 1 0.353686791102 0.271154190821
+ CTL3 IGR1 1 0.364377575719 0.310293744700
+ CTL3 PG0 1 0.360813980847 0.320014464673
+ CTL3 PG1 1 0.360813980847 0.320014464673
+ CTL3 PG2 1 0.360813980847 0.320014464673
+ CTL3 ALG1 1 0.347450500075 0.337324864189
+ CTL3 CC301 1 0.338541512893 0.041840000000
+ CTL3 CC3062 1 0.338541512893 0.041840000000
+ CTL3 CC311 1 0.338541512893 0.041840000000
+ CTL3 CC3161 1 0.338541512893 0.041840000000
+ CTL3 CC3162 1 0.338541512893 0.041840000000
+ CTL3 CC3163 1 0.338541512893 0.041840000000
+ CTL3 CC321 1 0.338541512893 0.041840000000
+ CTL3 CC3261 1 0.338541512893 0.041840000000
+ CTL3 CC3263 1 0.338541512893 0.041840000000
+ CTL3 CC331 1 0.338541512893 0.041840000000
+ CTL3 CC2O1 1 0.347450500075 0.138767581228
+ CTL3 CC2O2 1 0.347450500075 0.110698234855
+ CTL3 CC2O3 1 0.347450500075 0.125520000000
+ CTL3 CC2O4 1 0.329632525712 0.102486650838
+ CTL3 OC2D1 1 0.293996576986 0.144938011577
+ CTL3 OC2D2 1 0.320723538531 0.144938011577
+ CTL3 OC2D3 1 0.293996576986 0.144938011577
+ CTL3 OC2D4 1 0.293996576986 0.144938011577
+ CTL3 OC3C61 1 0.316269044940 0.132309697301
+ CTL3 OC311 1 0.326514380198 0.183381431383
+ CTL3 NC2D1 1 0.307360057758 0.187114168357
+ CTL3 HCP1 1 0.189271432669 0.089736802707
+ CTL3 HCA1 1 0.288651184677 0.088756043175
+ CTL3 HCA2 1 0.288651184677 0.078275472531
+ CTL3 HCA3 1 0.288651184677 0.064818249282
+ CTL3 CC312 1 0.338541512893 0.041840000000
+ CTL3 CC322 1 0.338541512893 0.041840000000
+ CTL3 HCR1 1 0.240542653898 0.089736802707
+ CTL3 HCA3M 1 0.288651184677 0.064818249282
+ CTL3 CC321C 1 0.338541512893 0.041840000000
+ CTL3 CC321D 1 0.338541512893 0.041840000000
+ CTL3 CC311C 1 0.338541512893 0.041840000000
+ CTL3 CC311D 1 0.338541512893 0.041840000000
+ CTL3 OC301 1 0.316269044940 0.132309697301
+ CTL3 OC302 1 0.316269044940 0.132309697301
+ CTL3 HCP1M 1 0.189271432669 0.089736802707
+ CTL3 OC311M 1 0.326514380198 0.183381431383
+ CTL3 OC3C5M 1 0.316269044940 0.132309697301
+ CTL3 CC322C 1 0.338541512893 0.041840000000
+ CTL3 HCA2C2 1 0.285087589805 0.078275472531
+ CTL3 CC312C 1 0.338541512893 0.041840000000
+ CTL3 HCA1C2 1 0.288651184677 0.088756043175
+ CTL3 OC3C51 1 0.316269044940 0.132309697301
+ CTL3 CC3152 1 0.338541512893 0.041840000000
+ CTL3 CC3051 1 0.338541512893 0.041840000000
+ CTL3 CC3251 1 0.338541512893 0.041840000000
+ CTL3 CC3151 1 0.338541512893 0.041840000000
+ CTL3 CC3153 1 0.338541512893 0.041840000000
+ CTL3 OC2DP 1 0.320723538531 0.144938011577
+ CTL3 OC312 1 0.326959829558 0.163176000000
+ CTL3 OC30P 1 0.326959829558 0.163176000000
+ CTL3 PC 1 0.360813980847 0.320014464673
+ CTL3 SC 1 0.356359487256 0.286840588481
+ CTL3 CC312D 1 0.338541512893 0.041840000000
+ CTL3 OC303 1 0.316269044940 0.132309697301
+ CTL3 HN1 1 0.189271432669 0.089736802707
+ CTL3 HN2 1 0.189271432669 0.089736802707
+ CTL3 HN3 1 0.267269615442 0.089736802707
+ CTL3 HN4 1 0.189271432669 0.089736802707
+ CTL3 HN5 1 0.189271432669 0.089736802707
+ CTL3 HN6 1 0.286869387241 0.062058748940
+ CTL3 HN7 1 0.286869387241 0.062058748940
+ CTL3 HN8 1 0.288651184677 0.070011711020
+ CTL3 HN9 1 0.288651184677 0.064818249282
+ CTL3 NN1 1 0.334087019303 0.187114168357
+ CTL3 NN2 1 0.334087019303 0.187114168357
+ CTL3 NN2B 1 0.334087019303 0.187114168357
+ CTL3 NN2G 1 0.334087019303 0.187114168357
+ CTL3 NN2U 1 0.334087019303 0.187114168357
+ CTL3 NN3 1 0.334087019303 0.187114168357
+ CTL3 NN3A 1 0.334087019303 0.187114168357
+ CTL3 NN3G 1 0.334087019303 0.187114168357
+ CTL3 NN4 1 0.334087019303 0.187114168357
+ CTL3 NN6 1 0.334087019303 0.187114168357
+ CTL3 ON1 1 0.320723538531 0.144938011577
+ CTL3 ON1C 1 0.320723538531 0.144938011577
+ CTL3 ON2 1 0.326959829558 0.163176000000
+ CTL3 ON3 1 0.320723538531 0.144938011577
+ CTL3 ON4 1 0.326959829558 0.163176000000
+ CTL3 ON5 1 0.326959829558 0.163176000000
+ CTL3 ON6 1 0.326959829558 0.163176000000
+ CTL3 ON6B 1 0.326959829558 0.163176000000
+ CTL3 CN1 1 0.338541512893 0.132309697301
+ CTL3 CN1T 1 0.338541512893 0.132309697301
+ CTL3 CN2 1 0.338541512893 0.132309697301
+ CTL3 CN3 1 0.338541512893 0.125520000000
+ CTL3 CN3T 1 0.338541512893 0.125520000000
+ CTL3 CN4 1 0.338541512893 0.114583559030
+ CTL3 CN5 1 0.338541512893 0.114583559030
+ CTL3 CN5G 1 0.338541512893 0.114583559030
+ CTL3 CN7 1 0.338541512893 0.041840000000
+ CTL3 CN7B 1 0.338541512893 0.041840000000
+ CTL3 CN8 1 0.338541512893 0.041840000000
+ CTL3 CN8B 1 0.338541512893 0.041840000000
+ CTL3 CN9 1 0.338541512893 0.041840000000
+ CTL3 P 1 0.360813980847 0.320014464673
+ CTL3 P2 1 0.360813980847 0.320014464673
+ CTL3 HOL 1 0.189271432669 0.089736802707
+ CTL3 HAL1 1 0.286869387241 0.062058748940
+ CTL3 HAL2 1 0.288651184677 0.070011711020
+ CTL3 HAL3 1 0.288651184677 0.064818249282
+ CTL3 HBL 1 0.286869387241 0.062058748940
+ CTL3 HCL 1 0.189271432669 0.089736802707
+ CTL3 HL 1 0.231633666716 0.089736802707
+ CTL3 HEL1 1 0.280633096214 0.073666921749
+ CTL3 HEL2 1 0.281523994932 0.067464972838
+ CTL3 CL 1 0.347450500075 0.110698234855
+ CTL3 CCL 1 0.347450500075 0.110698234855
+ CTL3 CTL1 1 0.338541512893 0.041840000000
+ CTL3 CTL2 1 0.338541512893 0.041840000000
+ CTL3 CTL3 1 0.338541512893 0.041840000000
+ CTL3 CTL5 1 0.338541512893 0.041840000000
+ CTL3 CEL1 1 0.355468588538 0.109105371453
+ CTL3 CEL2 1 0.354577689820 0.105847757841
+ CTL3 CRL1 1 0.338541512893 0.041840000000
+ CTL3 CRL2 1 0.338541512893 0.041840000000
+ CTL3 OBL 1 0.293996576986 0.144938011577
+ CTL3 OCL 1 0.320723538531 0.144938011577
+ CTL3 O2L 1 0.320723538531 0.144938011577
+ CTL3 OHL 1 0.326959829558 0.163176000000
+ CTL3 OSL 1 0.316269044940 0.132309697301
+ CTL3 OSLP 1 0.316269044940 0.132309697301
+ CTL3 NH3L 1 0.334087019303 0.187114168357
+ CTL3 NTL 1 0.334087019303 0.187114168357
+ CTL3 SL 1 0.356359487256 0.286840588481
+ CTL3 PL 1 0.360813980847 0.320014464673
+ CTL3 HCA1A 1 0.288651184677 0.088756043175
+ CTL3 HCA2A 1 0.288651184677 0.078275472531
+ CTL3 HCA3A 1 0.288651184677 0.064818249282
+ CTL3 CC30A 1 0.338541512893 0.041840000000
+ CTL3 CC31A 1 0.338541512893 0.041840000000
+ CTL3 CC32A 1 0.338541512893 0.041840000000
+ CTL3 CC33A 1 0.338541512893 0.041840000000
+ CTL3 CC326A 1 0.338541512893 0.041840000000
+ CTL3 HCA25A 1 0.285087589805 0.078275472531
+ CTL3 CC325A 1 0.338541512893 0.041840000000
+ CTL3 CC325B 1 0.338541512893 0.041840000000
+ CTL3 OC305A 1 0.316269044940 0.132309697301
+ CTL3 OC30A 1 0.316269044940 0.132309697301
+ CTL3 CPA 1 0.329632525712 0.125520000000
+ CTL3 CPB 1 0.329632525712 0.125520000000
+ CTL3 CPM 1 0.329632525712 0.125520000000
+ CTL3 CM 1 0.356359487256 0.138767581228
+ CTL3 CST 1 0.308518226092 0.100764063435
+ CTL3 NPH 1 0.334087019303 0.187114168357
+ CTL3 OM 1 0.320723538531 0.144938011577
+ CTL3 OST 1 0.320010819556 0.169954883425
+ CTL3 FE 1 0.227179173126 0.000000000000
+ CTL3 ON2B 1 0.326959829558 0.163176000000
+ CTL3 SP 1 0.365268474438 0.280671252536
+ CTL5 C 1 0.347450500075 0.138767581228
+ CTL5 CA 1 0.346773417049 0.110698234855
+ CTL5 CC 1 0.347450500075 0.110698234855
+ CTL5 CD 1 0.347450500075 0.110698234855
+ CTL5 CE1 1 0.355468588538 0.109105371453
+ CTL5 CE2 1 0.354577689820 0.105847757841
+ CTL5 CP1 1 0.338541512893 0.041840000000
+ CTL5 CP2 1 0.338541512893 0.041840000000
+ CTL5 CP3 1 0.338541512893 0.041840000000
+ CTL5 CPH1 1 0.329632525712 0.093557084179
+ CTL5 CPH2 1 0.329632525712 0.093557084179
+ CTL5 CS 1 0.365268474438 0.138767581228
+ CTL5 CPT 1 0.334977918021 0.131646486622
+ CTL5 CY 1 0.346559601357 0.113045454929
+ CTL5 CAI 1 0.346559601357 0.113045454929
+ CTL5 CT 1 0.338541512893 0.041840000000
+ CTL5 CT1 1 0.338541512893 0.041840000000
+ CTL5 CT2 1 0.338541512893 0.041840000000
+ CTL5 CT2A 1 0.338541512893 0.041840000000
+ CTL5 CT3 1 0.338541512893 0.041840000000
+ CTL5 H 1 0.189271432669 0.089736802707
+ CTL5 HA 1 0.286869387241 0.062058748940
+ CTL5 HB1 1 0.286869387241 0.062058748940
+ CTL5 HB2 1 0.288651184677 0.070011711020
+ CTL5 HE1 1 0.280633096214 0.073666921749
+ CTL5 HE2 1 0.281523994932 0.067464972838
+ CTL5 HC 1 0.189271432669 0.089736802707
+ CTL5 HP 1 0.290272620344 0.072469005789
+ CTL5 HR1 1 0.249451641079 0.089736802707
+ CTL5 HR2 1 0.231633666716 0.089736802707
+ CTL5 HR3 1 0.300054688270 0.036952087465
+ CTL5 HS 1 0.209361198763 0.132309697301
+ CTL5 HA1 1 0.288651184677 0.088756043175
+ CTL5 HA2 1 0.288651184677 0.077149148019
+ CTL5 HA3 1 0.288651184677 0.064818249282
+ CTL5 N 1 0.334087019303 0.004184000000
+ CTL5 NC2 1 0.334087019303 0.187114168357
+ CTL5 NH1 1 0.307360057758 0.187114168357
+ CTL5 NH2 1 0.334087019303 0.187114168357
+ CTL5 NH3 1 0.334087019303 0.187114168357
+ CTL5 NP 1 0.334087019303 0.187114168357
+ CTL5 NR1 1 0.334087019303 0.187114168357
+ CTL5 NR2 1 0.334087019303 0.187114168357
+ CTL5 NR3 1 0.334087019303 0.187114168357
+ CTL5 NY 1 0.334087019303 0.187114168357
+ CTL5 O 1 0.293996576986 0.144938011577
+ CTL5 OB 1 0.293996576986 0.144938011577
+ CTL5 OC 1 0.320723538531 0.144938011577
+ CTL5 OH1 1 0.326959829558 0.163176000000
+ CTL5 OS 1 0.326959829558 0.163176000000
+ CTL5 S 1 0.347450500075 0.280671252536
+ CTL5 SM 1 0.345223253279 0.257919081884
+ CTL5 SS 1 0.365268474438 0.286840588481
+ CTL5 HT 1 0.189271432669 0.089736802707
+ CTL5 OT 1 0.326799467788 0.163176000000
+ CTL5 OX 1 0.320723538531 0.144938011577
+ CTL5 HX 1 0.189271432669 0.089736802707
+ CTL5 LIT 1 0.284864865125 0.020196198771
+ CTL5 SOD 1 0.294954293108 0.090610410351
+ CTL5 MG 1 0.274842254546 0.051243325419
+ CTL5 POT 1 0.326403017859 0.123410269913
+ CTL5 CAL 1 0.291056611216 0.144938011577
+ CTL5 RUB 1 0.338541512893 0.162045623205
+ CTL5 CES 1 0.356359487256 0.182376331798
+ CTL5 BAR 1 0.337650614175 0.162045623205
+ CTL5 ZN 1 0.266378716724 0.209200000000
+ CTL5 CAD 1 0.290165712498 0.144938011577
+ CTL5 CLA 1 0.371504765465 0.162045623205
+ CTL5 HGA1 1 0.288651184677 0.088756043175
+ CTL5 HGA2 1 0.288651184677 0.078275472531
+ CTL5 HGA3 1 0.288651184677 0.064818249282
+ CTL5 HGA4 1 0.280633096214 0.073666921749
+ CTL5 HGA5 1 0.281523994932 0.067464972838
+ CTL5 HGA6 1 0.286869387241 0.070011711020
+ CTL5 HGA7 1 0.285087589805 0.072469005789
+ CTL5 HGAAM0 1 0.283305792369 0.070011711020
+ CTL5 HGAAM1 1 0.283305792369 0.070011711020
+ CTL5 HGAAM2 1 0.281523994932 0.083680000000
+ CTL5 HGP1 1 0.189271432669 0.089736802707
+ CTL5 HGP2 1 0.189271432669 0.089736802707
+ CTL5 HGP3 1 0.209361198763 0.132309697301
+ CTL5 HGP4 1 0.189271432669 0.089736802707
+ CTL5 HGP5 1 0.231633666716 0.089736802707
+ CTL5 HGPAM1 1 0.247224394284 0.039692909190
+ CTL5 HGPAM2 1 0.247224394284 0.041840000000
+ CTL5 HGPAM3 1 0.246778944925 0.045833423612
+ CTL5 HGR51 1 0.290272620344 0.072469005789
+ CTL5 HGR52 1 0.249451641079 0.089736802707
+ CTL5 HGR53 1 0.231633666716 0.089736802707
+ CTL5 HGR61 1 0.290272620344 0.072469005789
+ CTL5 HGR62 1 0.267269615442 0.089736802707
+ CTL5 HGR63 1 0.249451641079 0.089736802707
+ CTL5 HGR71 1 0.290272620344 0.072469005789
+ CTL5 CG1T1 1 0.333196120584 0.170981810495
+ CTL5 CG1T2 1 0.346782326036 0.134409982486
+ CTL5 CG1N1 1 0.335868816739 0.177512086349
+ CTL5 CG2D1 1 0.355468588538 0.109105371453
+ CTL5 CG2D2 1 0.354577689820 0.105847757841
+ CTL5 CG2D1O 1 0.355468588538 0.109105371453
+ CTL5 CG2D2O 1 0.355468588538 0.109105371453
+ CTL5 CG2DC1 1 0.355468588538 0.109105371453
+ CTL5 CG2DC2 1 0.355468588538 0.109105371453
+ CTL5 CG2DC3 1 0.354577689820 0.105847757841
+ CTL5 CG25C1 1 0.355468588538 0.109105371453
+ CTL5 CG25C2 1 0.355468588538 0.109105371453
+ CTL5 CG251O 1 0.355468588538 0.109105371453
+ CTL5 CG252O 1 0.355468588538 0.109105371453
+ CTL5 CG2N1 1 0.347450500075 0.138767581228
+ CTL5 CG2N2 1 0.347450500075 0.138767581228
+ CTL5 CG2O1 1 0.347450500075 0.138767581228
+ CTL5 CG2O2 1 0.320723538531 0.130979917850
+ CTL5 CG2O3 1 0.347450500075 0.110698234855
+ CTL5 CG2O4 1 0.329632525712 0.102486650838
+ CTL5 CG2O5 1 0.347450500075 0.125520000000
+ CTL5 CG2O6 1 0.347450500075 0.110698234855
+ CTL5 CG2O7 1 0.308518226092 0.100764063435
+ CTL5 CG2R51 1 0.356359487256 0.093557084179
+ CTL5 CG2R52 1 0.365268474438 0.059170695450
+ CTL5 CG2R53 1 0.365268474438 0.059170695450
+ CTL5 CG2R57 1 0.356359487256 0.093557084179
+ CTL5 CG2R61 1 0.346773417049 0.110698234855
+ CTL5 CG2R62 1 0.338541512893 0.125520000000
+ CTL5 CG2R63 1 0.338541512893 0.132309697301
+ CTL5 CG2R64 1 0.356359487256 0.083680000000
+ CTL5 CG2R66 1 0.338541512893 0.110698234855
+ CTL5 CG2R67 1 0.346773417049 0.110698234855
+ CTL5 CG2RC0 1 0.334977918021 0.131646486622
+ CTL5 CG2R71 1 0.346987232741 0.108300154755
+ CTL5 CG2RC7 1 0.334977918021 0.131646486622
+ CTL5 CG301 1 0.338541512893 0.041840000000
+ CTL5 CG302 1 0.374177461619 0.059170695450
+ CTL5 CG311 1 0.338541512893 0.041840000000
+ CTL5 CG312 1 0.351904993665 0.085746484010
+ CTL5 CG314 1 0.338541512893 0.041840000000
+ CTL5 CG321 1 0.338541512893 0.041840000000
+ CTL5 CG322 1 0.338541512893 0.102486650838
+ CTL5 CG323 1 0.365268474438 0.138767581228
+ CTL5 CG324 1 0.338541512893 0.041840000000
+ CTL5 CG331 1 0.338541512893 0.041840000000
+ CTL5 CG334 1 0.338541512893 0.041840000000
+ CTL5 CG3C50 1 0.338541512893 0.041840000000
+ CTL5 CG3C51 1 0.338541512893 0.041840000000
+ CTL5 CG3C52 1 0.338541512893 0.041840000000
+ CTL5 CG3C53 1 0.338541512893 0.041840000000
+ CTL5 CG3C54 1 0.338541512893 0.041840000000
+ CTL5 CG3C31 1 0.338541512893 0.041840000000
+ CTL5 CG3C41 1 0.338541512893 0.041840000000
+ CTL5 CG3RC1 1 0.338541512893 0.041840000000
+ CTL5 CG3AM0 1 0.344777803920 0.110698234855
+ CTL5 CG3AM1 1 0.345668702638 0.116852760686
+ CTL5 CG3AM2 1 0.346559601357 0.118341390899
+ CTL5 NG1T1 1 0.328741626994 0.177512086349
+ CTL5 NG2D1 1 0.334087019303 0.187114168357
+ CTL5 NG2S0 1 0.334087019303 0.004184000000
+ CTL5 NG2S1 1 0.307360057758 0.187114168357
+ CTL5 NG2S2 1 0.334087019303 0.187114168357
+ CTL5 NG2S3 1 0.334087019303 0.187114168357
+ CTL5 NG2O1 1 0.334087019303 0.187114168357
+ CTL5 NG2P1 1 0.334087019303 0.187114168357
+ CTL5 NG2R43 1 0.334087019303 0.187114168357
+ CTL5 NG2R50 1 0.334087019303 0.187114168357
+ CTL5 NG2R51 1 0.334087019303 0.187114168357
+ CTL5 NG2R52 1 0.334087019303 0.187114168357
+ CTL5 NG2R53 1 0.334087019303 0.187114168357
+ CTL5 NG2R57 1 0.334087019303 0.187114168357
+ CTL5 NG2R60 1 0.337650614175 0.102486650838
+ CTL5 NG2R61 1 0.334087019303 0.187114168357
+ CTL5 NG2R62 1 0.352795892384 0.093557084179
+ CTL5 NG2R67 1 0.334087019303 0.187114168357
+ CTL5 NG2RC0 1 0.334087019303 0.187114168357
+ CTL5 NG301 1 0.347450500075 0.078275472531
+ CTL5 NG311 1 0.347450500075 0.088756043175
+ CTL5 NG321 1 0.346559601357 0.102486650838
+ CTL5 NG331 1 0.345668702638 0.110698234855
+ CTL5 NG3C51 1 0.334087019303 0.187114168357
+ CTL5 NG3N1 1 0.351904993665 0.102486650838
+ CTL5 NG3P0 1 0.334087019303 0.187114168357
+ CTL5 NG3P1 1 0.334087019303 0.187114168357
+ CTL5 NG3P2 1 0.334087019303 0.187114168357
+ CTL5 NG3P3 1 0.334087019303 0.187114168357
+ CTL5 OG2D1 1 0.293996576986 0.144938011577
+ CTL5 OG2D2 1 0.320723538531 0.144938011577
+ CTL5 OG2D3 1 0.293996576986 0.144938011577
+ CTL5 OG2D4 1 0.320723538531 0.144938011577
+ CTL5 OG2D5 1 0.320010819556 0.169954883425
+ CTL5 OG2N1 1 0.320723538531 0.144938011577
+ CTL5 OG2P1 1 0.320723538531 0.144938011577
+ CTL5 OG2R50 1 0.320723538531 0.144938011577
+ CTL5 OG3R60 1 0.316269044940 0.132309697301
+ CTL5 OG301 1 0.316269044940 0.132309697301
+ CTL5 OG302 1 0.316269044940 0.132309697301
+ CTL5 OG303 1 0.316269044940 0.132309697301
+ CTL5 OG304 1 0.316269044940 0.132309697301
+ CTL5 OG311 1 0.326514380198 0.183381431383
+ CTL5 OG312 1 0.325178032121 0.144938011577
+ CTL5 OG3C31 1 0.316269044940 0.132309697301
+ CTL5 OG3C51 1 0.316269044940 0.132309697301
+ CTL5 OG3C61 1 0.316269044940 0.132309697301
+ CTL5 SG2D1 1 0.351904993665 0.314496560236
+ CTL5 SG2R50 1 0.347450500075 0.280671252536
+ CTL5 SG311 1 0.347450500075 0.280671252536
+ CTL5 SG301 1 0.345223253279 0.257919081884
+ CTL5 SG302 1 0.365268474438 0.286840588481
+ CTL5 SG3O1 1 0.356359487256 0.286840588481
+ CTL5 SG3O2 1 0.347450500075 0.247528778125
+ CTL5 SG3O3 1 0.347450500075 0.247528778125
+ CTL5 FGA1 1 0.314487247504 0.153729976257
+ CTL5 FGA2 1 0.314487247504 0.135577095411
+ CTL5 FGA3 1 0.311814551349 0.130309939452
+ CTL5 FGP1 1 0.311814551349 0.130309939452
+ CTL5 FGR1 1 0.320723538531 0.144938011577
+ CTL5 CLGA1 1 0.339432411611 0.245040988571
+ CTL5 CLGA3 1 0.339432411611 0.232955260941
+ CTL5 CLGR1 1 0.341214209048 0.236682781799
+ CTL5 BRGA1 1 0.344777803920 0.289876023155
+ CTL5 BRGA2 1 0.351904993665 0.304599797767
+ CTL5 BRGA3 1 0.347450500075 0.307459952514
+ CTL5 BRGR1 1 0.353686791102 0.271154190821
+ CTL5 IGR1 1 0.364377575719 0.310293744700
+ CTL5 PG0 1 0.360813980847 0.320014464673
+ CTL5 PG1 1 0.360813980847 0.320014464673
+ CTL5 PG2 1 0.360813980847 0.320014464673
+ CTL5 ALG1 1 0.347450500075 0.337324864189
+ CTL5 CC301 1 0.338541512893 0.041840000000
+ CTL5 CC3062 1 0.338541512893 0.041840000000
+ CTL5 CC311 1 0.338541512893 0.041840000000
+ CTL5 CC3161 1 0.338541512893 0.041840000000
+ CTL5 CC3162 1 0.338541512893 0.041840000000
+ CTL5 CC3163 1 0.338541512893 0.041840000000
+ CTL5 CC321 1 0.338541512893 0.041840000000
+ CTL5 CC3261 1 0.338541512893 0.041840000000
+ CTL5 CC3263 1 0.338541512893 0.041840000000
+ CTL5 CC331 1 0.338541512893 0.041840000000
+ CTL5 CC2O1 1 0.347450500075 0.138767581228
+ CTL5 CC2O2 1 0.347450500075 0.110698234855
+ CTL5 CC2O3 1 0.347450500075 0.125520000000
+ CTL5 CC2O4 1 0.329632525712 0.102486650838
+ CTL5 OC2D1 1 0.293996576986 0.144938011577
+ CTL5 OC2D2 1 0.320723538531 0.144938011577
+ CTL5 OC2D3 1 0.293996576986 0.144938011577
+ CTL5 OC2D4 1 0.293996576986 0.144938011577
+ CTL5 OC3C61 1 0.316269044940 0.132309697301
+ CTL5 OC311 1 0.326514380198 0.183381431383
+ CTL5 NC2D1 1 0.307360057758 0.187114168357
+ CTL5 HCP1 1 0.189271432669 0.089736802707
+ CTL5 HCA1 1 0.288651184677 0.088756043175
+ CTL5 HCA2 1 0.288651184677 0.078275472531
+ CTL5 HCA3 1 0.288651184677 0.064818249282
+ CTL5 CC312 1 0.338541512893 0.041840000000
+ CTL5 CC322 1 0.338541512893 0.041840000000
+ CTL5 HCR1 1 0.240542653898 0.089736802707
+ CTL5 HCA3M 1 0.288651184677 0.064818249282
+ CTL5 CC321C 1 0.338541512893 0.041840000000
+ CTL5 CC321D 1 0.338541512893 0.041840000000
+ CTL5 CC311C 1 0.338541512893 0.041840000000
+ CTL5 CC311D 1 0.338541512893 0.041840000000
+ CTL5 OC301 1 0.316269044940 0.132309697301
+ CTL5 OC302 1 0.316269044940 0.132309697301
+ CTL5 HCP1M 1 0.189271432669 0.089736802707
+ CTL5 OC311M 1 0.326514380198 0.183381431383
+ CTL5 OC3C5M 1 0.316269044940 0.132309697301
+ CTL5 CC322C 1 0.338541512893 0.041840000000
+ CTL5 HCA2C2 1 0.285087589805 0.078275472531
+ CTL5 CC312C 1 0.338541512893 0.041840000000
+ CTL5 HCA1C2 1 0.288651184677 0.088756043175
+ CTL5 OC3C51 1 0.316269044940 0.132309697301
+ CTL5 CC3152 1 0.338541512893 0.041840000000
+ CTL5 CC3051 1 0.338541512893 0.041840000000
+ CTL5 CC3251 1 0.338541512893 0.041840000000
+ CTL5 CC3151 1 0.338541512893 0.041840000000
+ CTL5 CC3153 1 0.338541512893 0.041840000000
+ CTL5 OC2DP 1 0.320723538531 0.144938011577
+ CTL5 OC312 1 0.326959829558 0.163176000000
+ CTL5 OC30P 1 0.326959829558 0.163176000000
+ CTL5 PC 1 0.360813980847 0.320014464673
+ CTL5 SC 1 0.356359487256 0.286840588481
+ CTL5 CC312D 1 0.338541512893 0.041840000000
+ CTL5 OC303 1 0.316269044940 0.132309697301
+ CTL5 HN1 1 0.189271432669 0.089736802707
+ CTL5 HN2 1 0.189271432669 0.089736802707
+ CTL5 HN3 1 0.267269615442 0.089736802707
+ CTL5 HN4 1 0.189271432669 0.089736802707
+ CTL5 HN5 1 0.189271432669 0.089736802707
+ CTL5 HN6 1 0.286869387241 0.062058748940
+ CTL5 HN7 1 0.286869387241 0.062058748940
+ CTL5 HN8 1 0.288651184677 0.070011711020
+ CTL5 HN9 1 0.288651184677 0.064818249282
+ CTL5 NN1 1 0.334087019303 0.187114168357
+ CTL5 NN2 1 0.334087019303 0.187114168357
+ CTL5 NN2B 1 0.334087019303 0.187114168357
+ CTL5 NN2G 1 0.334087019303 0.187114168357
+ CTL5 NN2U 1 0.334087019303 0.187114168357
+ CTL5 NN3 1 0.334087019303 0.187114168357
+ CTL5 NN3A 1 0.334087019303 0.187114168357
+ CTL5 NN3G 1 0.334087019303 0.187114168357
+ CTL5 NN4 1 0.334087019303 0.187114168357
+ CTL5 NN6 1 0.334087019303 0.187114168357
+ CTL5 ON1 1 0.320723538531 0.144938011577
+ CTL5 ON1C 1 0.320723538531 0.144938011577
+ CTL5 ON2 1 0.326959829558 0.163176000000
+ CTL5 ON3 1 0.320723538531 0.144938011577
+ CTL5 ON4 1 0.326959829558 0.163176000000
+ CTL5 ON5 1 0.326959829558 0.163176000000
+ CTL5 ON6 1 0.326959829558 0.163176000000
+ CTL5 ON6B 1 0.326959829558 0.163176000000
+ CTL5 CN1 1 0.338541512893 0.132309697301
+ CTL5 CN1T 1 0.338541512893 0.132309697301
+ CTL5 CN2 1 0.338541512893 0.132309697301
+ CTL5 CN3 1 0.338541512893 0.125520000000
+ CTL5 CN3T 1 0.338541512893 0.125520000000
+ CTL5 CN4 1 0.338541512893 0.114583559030
+ CTL5 CN5 1 0.338541512893 0.114583559030
+ CTL5 CN5G 1 0.338541512893 0.114583559030
+ CTL5 CN7 1 0.338541512893 0.041840000000
+ CTL5 CN7B 1 0.338541512893 0.041840000000
+ CTL5 CN8 1 0.338541512893 0.041840000000
+ CTL5 CN8B 1 0.338541512893 0.041840000000
+ CTL5 CN9 1 0.338541512893 0.041840000000
+ CTL5 P 1 0.360813980847 0.320014464673
+ CTL5 P2 1 0.360813980847 0.320014464673
+ CTL5 HOL 1 0.189271432669 0.089736802707
+ CTL5 HAL1 1 0.286869387241 0.062058748940
+ CTL5 HAL2 1 0.288651184677 0.070011711020
+ CTL5 HAL3 1 0.288651184677 0.064818249282
+ CTL5 HBL 1 0.286869387241 0.062058748940
+ CTL5 HCL 1 0.189271432669 0.089736802707
+ CTL5 HL 1 0.231633666716 0.089736802707
+ CTL5 HEL1 1 0.280633096214 0.073666921749
+ CTL5 HEL2 1 0.281523994932 0.067464972838
+ CTL5 CL 1 0.347450500075 0.110698234855
+ CTL5 CCL 1 0.347450500075 0.110698234855
+ CTL5 CTL1 1 0.338541512893 0.041840000000
+ CTL5 CTL2 1 0.338541512893 0.041840000000
+ CTL5 CTL3 1 0.338541512893 0.041840000000
+ CTL5 CTL5 1 0.338541512893 0.041840000000
+ CTL5 CEL1 1 0.355468588538 0.109105371453
+ CTL5 CEL2 1 0.354577689820 0.105847757841
+ CTL5 CRL1 1 0.338541512893 0.041840000000
+ CTL5 CRL2 1 0.338541512893 0.041840000000
+ CTL5 OBL 1 0.293996576986 0.144938011577
+ CTL5 OCL 1 0.320723538531 0.144938011577
+ CTL5 O2L 1 0.320723538531 0.144938011577
+ CTL5 OHL 1 0.326959829558 0.163176000000
+ CTL5 OSL 1 0.316269044940 0.132309697301
+ CTL5 OSLP 1 0.316269044940 0.132309697301
+ CTL5 NH3L 1 0.334087019303 0.187114168357
+ CTL5 NTL 1 0.334087019303 0.187114168357
+ CTL5 SL 1 0.356359487256 0.286840588481
+ CTL5 PL 1 0.360813980847 0.320014464673
+ CTL5 HCA1A 1 0.288651184677 0.088756043175
+ CTL5 HCA2A 1 0.288651184677 0.078275472531
+ CTL5 HCA3A 1 0.288651184677 0.064818249282
+ CTL5 CC30A 1 0.338541512893 0.041840000000
+ CTL5 CC31A 1 0.338541512893 0.041840000000
+ CTL5 CC32A 1 0.338541512893 0.041840000000
+ CTL5 CC33A 1 0.338541512893 0.041840000000
+ CTL5 CC326A 1 0.338541512893 0.041840000000
+ CTL5 HCA25A 1 0.285087589805 0.078275472531
+ CTL5 CC325A 1 0.338541512893 0.041840000000
+ CTL5 CC325B 1 0.338541512893 0.041840000000
+ CTL5 OC305A 1 0.316269044940 0.132309697301
+ CTL5 OC30A 1 0.316269044940 0.132309697301
+ CTL5 CPA 1 0.329632525712 0.125520000000
+ CTL5 CPB 1 0.329632525712 0.125520000000
+ CTL5 CPM 1 0.329632525712 0.125520000000
+ CTL5 CM 1 0.356359487256 0.138767581228
+ CTL5 CST 1 0.308518226092 0.100764063435
+ CTL5 NPH 1 0.334087019303 0.187114168357
+ CTL5 OM 1 0.320723538531 0.144938011577
+ CTL5 OST 1 0.320010819556 0.169954883425
+ CTL5 FE 1 0.227179173126 0.000000000000
+ CTL5 ON2B 1 0.326959829558 0.163176000000
+ CTL5 SP 1 0.365268474438 0.280671252536
+ CRL1 C 1 0.347450500075 0.138767581228
+ CRL1 CA 1 0.346773417049 0.110698234855
+ CRL1 CC 1 0.347450500075 0.110698234855
+ CRL1 CD 1 0.347450500075 0.110698234855
+ CRL1 CE1 1 0.355468588538 0.109105371453
+ CRL1 CE2 1 0.354577689820 0.105847757841
+ CRL1 CP1 1 0.338541512893 0.041840000000
+ CRL1 CP2 1 0.338541512893 0.041840000000
+ CRL1 CP3 1 0.338541512893 0.041840000000
+ CRL1 CPH1 1 0.329632525712 0.093557084179
+ CRL1 CPH2 1 0.329632525712 0.093557084179
+ CRL1 CS 1 0.365268474438 0.138767581228
+ CRL1 CPT 1 0.334977918021 0.131646486622
+ CRL1 CY 1 0.346559601357 0.113045454929
+ CRL1 CAI 1 0.346559601357 0.113045454929
+ CRL1 CT 1 0.338541512893 0.041840000000
+ CRL1 CT1 1 0.338541512893 0.041840000000
+ CRL1 CT2 1 0.338541512893 0.041840000000
+ CRL1 CT2A 1 0.338541512893 0.041840000000
+ CRL1 CT3 1 0.338541512893 0.041840000000
+ CRL1 H 1 0.189271432669 0.089736802707
+ CRL1 HA 1 0.286869387241 0.062058748940
+ CRL1 HB1 1 0.286869387241 0.062058748940
+ CRL1 HB2 1 0.288651184677 0.070011711020
+ CRL1 HE1 1 0.280633096214 0.073666921749
+ CRL1 HE2 1 0.281523994932 0.067464972838
+ CRL1 HC 1 0.189271432669 0.089736802707
+ CRL1 HP 1 0.290272620344 0.072469005789
+ CRL1 HR1 1 0.249451641079 0.089736802707
+ CRL1 HR2 1 0.231633666716 0.089736802707
+ CRL1 HR3 1 0.300054688270 0.036952087465
+ CRL1 HS 1 0.209361198763 0.132309697301
+ CRL1 HA1 1 0.288651184677 0.088756043175
+ CRL1 HA2 1 0.288651184677 0.077149148019
+ CRL1 HA3 1 0.288651184677 0.064818249282
+ CRL1 N 1 0.334087019303 0.004184000000
+ CRL1 NC2 1 0.334087019303 0.187114168357
+ CRL1 NH1 1 0.307360057758 0.187114168357
+ CRL1 NH2 1 0.334087019303 0.187114168357
+ CRL1 NH3 1 0.334087019303 0.187114168357
+ CRL1 NP 1 0.334087019303 0.187114168357
+ CRL1 NR1 1 0.334087019303 0.187114168357
+ CRL1 NR2 1 0.334087019303 0.187114168357
+ CRL1 NR3 1 0.334087019303 0.187114168357
+ CRL1 NY 1 0.334087019303 0.187114168357
+ CRL1 O 1 0.293996576986 0.144938011577
+ CRL1 OB 1 0.293996576986 0.144938011577
+ CRL1 OC 1 0.320723538531 0.144938011577
+ CRL1 OH1 1 0.326959829558 0.163176000000
+ CRL1 OS 1 0.326959829558 0.163176000000
+ CRL1 S 1 0.347450500075 0.280671252536
+ CRL1 SM 1 0.345223253279 0.257919081884
+ CRL1 SS 1 0.365268474438 0.286840588481
+ CRL1 HT 1 0.189271432669 0.089736802707
+ CRL1 OT 1 0.326799467788 0.163176000000
+ CRL1 OX 1 0.320723538531 0.144938011577
+ CRL1 HX 1 0.189271432669 0.089736802707
+ CRL1 LIT 1 0.284864865125 0.020196198771
+ CRL1 SOD 1 0.294954293108 0.090610410351
+ CRL1 MG 1 0.274842254546 0.051243325419
+ CRL1 POT 1 0.326403017859 0.123410269913
+ CRL1 CAL 1 0.291056611216 0.144938011577
+ CRL1 RUB 1 0.338541512893 0.162045623205
+ CRL1 CES 1 0.356359487256 0.182376331798
+ CRL1 BAR 1 0.337650614175 0.162045623205
+ CRL1 ZN 1 0.266378716724 0.209200000000
+ CRL1 CAD 1 0.290165712498 0.144938011577
+ CRL1 CLA 1 0.371504765465 0.162045623205
+ CRL1 HGA1 1 0.288651184677 0.088756043175
+ CRL1 HGA2 1 0.288651184677 0.078275472531
+ CRL1 HGA3 1 0.288651184677 0.064818249282
+ CRL1 HGA4 1 0.280633096214 0.073666921749
+ CRL1 HGA5 1 0.281523994932 0.067464972838
+ CRL1 HGA6 1 0.286869387241 0.070011711020
+ CRL1 HGA7 1 0.285087589805 0.072469005789
+ CRL1 HGAAM0 1 0.283305792369 0.070011711020
+ CRL1 HGAAM1 1 0.283305792369 0.070011711020
+ CRL1 HGAAM2 1 0.281523994932 0.083680000000
+ CRL1 HGP1 1 0.189271432669 0.089736802707
+ CRL1 HGP2 1 0.189271432669 0.089736802707
+ CRL1 HGP3 1 0.209361198763 0.132309697301
+ CRL1 HGP4 1 0.189271432669 0.089736802707
+ CRL1 HGP5 1 0.231633666716 0.089736802707
+ CRL1 HGPAM1 1 0.247224394284 0.039692909190
+ CRL1 HGPAM2 1 0.247224394284 0.041840000000
+ CRL1 HGPAM3 1 0.246778944925 0.045833423612
+ CRL1 HGR51 1 0.290272620344 0.072469005789
+ CRL1 HGR52 1 0.249451641079 0.089736802707
+ CRL1 HGR53 1 0.231633666716 0.089736802707
+ CRL1 HGR61 1 0.290272620344 0.072469005789
+ CRL1 HGR62 1 0.267269615442 0.089736802707
+ CRL1 HGR63 1 0.249451641079 0.089736802707
+ CRL1 HGR71 1 0.290272620344 0.072469005789
+ CRL1 CG1T1 1 0.333196120584 0.170981810495
+ CRL1 CG1T2 1 0.346782326036 0.134409982486
+ CRL1 CG1N1 1 0.335868816739 0.177512086349
+ CRL1 CG2D1 1 0.355468588538 0.109105371453
+ CRL1 CG2D2 1 0.354577689820 0.105847757841
+ CRL1 CG2D1O 1 0.355468588538 0.109105371453
+ CRL1 CG2D2O 1 0.355468588538 0.109105371453
+ CRL1 CG2DC1 1 0.355468588538 0.109105371453
+ CRL1 CG2DC2 1 0.355468588538 0.109105371453
+ CRL1 CG2DC3 1 0.354577689820 0.105847757841
+ CRL1 CG25C1 1 0.355468588538 0.109105371453
+ CRL1 CG25C2 1 0.355468588538 0.109105371453
+ CRL1 CG251O 1 0.355468588538 0.109105371453
+ CRL1 CG252O 1 0.355468588538 0.109105371453
+ CRL1 CG2N1 1 0.347450500075 0.138767581228
+ CRL1 CG2N2 1 0.347450500075 0.138767581228
+ CRL1 CG2O1 1 0.347450500075 0.138767581228
+ CRL1 CG2O2 1 0.320723538531 0.130979917850
+ CRL1 CG2O3 1 0.347450500075 0.110698234855
+ CRL1 CG2O4 1 0.329632525712 0.102486650838
+ CRL1 CG2O5 1 0.347450500075 0.125520000000
+ CRL1 CG2O6 1 0.347450500075 0.110698234855
+ CRL1 CG2O7 1 0.308518226092 0.100764063435
+ CRL1 CG2R51 1 0.356359487256 0.093557084179
+ CRL1 CG2R52 1 0.365268474438 0.059170695450
+ CRL1 CG2R53 1 0.365268474438 0.059170695450
+ CRL1 CG2R57 1 0.356359487256 0.093557084179
+ CRL1 CG2R61 1 0.346773417049 0.110698234855
+ CRL1 CG2R62 1 0.338541512893 0.125520000000
+ CRL1 CG2R63 1 0.338541512893 0.132309697301
+ CRL1 CG2R64 1 0.356359487256 0.083680000000
+ CRL1 CG2R66 1 0.338541512893 0.110698234855
+ CRL1 CG2R67 1 0.346773417049 0.110698234855
+ CRL1 CG2RC0 1 0.334977918021 0.131646486622
+ CRL1 CG2R71 1 0.346987232741 0.108300154755
+ CRL1 CG2RC7 1 0.334977918021 0.131646486622
+ CRL1 CG301 1 0.338541512893 0.041840000000
+ CRL1 CG302 1 0.374177461619 0.059170695450
+ CRL1 CG311 1 0.338541512893 0.041840000000
+ CRL1 CG312 1 0.351904993665 0.085746484010
+ CRL1 CG314 1 0.338541512893 0.041840000000
+ CRL1 CG321 1 0.338541512893 0.041840000000
+ CRL1 CG322 1 0.338541512893 0.102486650838
+ CRL1 CG323 1 0.365268474438 0.138767581228
+ CRL1 CG324 1 0.338541512893 0.041840000000
+ CRL1 CG331 1 0.338541512893 0.041840000000
+ CRL1 CG334 1 0.338541512893 0.041840000000
+ CRL1 CG3C50 1 0.338541512893 0.041840000000
+ CRL1 CG3C51 1 0.338541512893 0.041840000000
+ CRL1 CG3C52 1 0.338541512893 0.041840000000
+ CRL1 CG3C53 1 0.338541512893 0.041840000000
+ CRL1 CG3C54 1 0.338541512893 0.041840000000
+ CRL1 CG3C31 1 0.338541512893 0.041840000000
+ CRL1 CG3C41 1 0.338541512893 0.041840000000
+ CRL1 CG3RC1 1 0.338541512893 0.041840000000
+ CRL1 CG3AM0 1 0.344777803920 0.110698234855
+ CRL1 CG3AM1 1 0.345668702638 0.116852760686
+ CRL1 CG3AM2 1 0.346559601357 0.118341390899
+ CRL1 NG1T1 1 0.328741626994 0.177512086349
+ CRL1 NG2D1 1 0.334087019303 0.187114168357
+ CRL1 NG2S0 1 0.334087019303 0.004184000000
+ CRL1 NG2S1 1 0.307360057758 0.187114168357
+ CRL1 NG2S2 1 0.334087019303 0.187114168357
+ CRL1 NG2S3 1 0.334087019303 0.187114168357
+ CRL1 NG2O1 1 0.334087019303 0.187114168357
+ CRL1 NG2P1 1 0.334087019303 0.187114168357
+ CRL1 NG2R43 1 0.334087019303 0.187114168357
+ CRL1 NG2R50 1 0.334087019303 0.187114168357
+ CRL1 NG2R51 1 0.334087019303 0.187114168357
+ CRL1 NG2R52 1 0.334087019303 0.187114168357
+ CRL1 NG2R53 1 0.334087019303 0.187114168357
+ CRL1 NG2R57 1 0.334087019303 0.187114168357
+ CRL1 NG2R60 1 0.337650614175 0.102486650838
+ CRL1 NG2R61 1 0.334087019303 0.187114168357
+ CRL1 NG2R62 1 0.352795892384 0.093557084179
+ CRL1 NG2R67 1 0.334087019303 0.187114168357
+ CRL1 NG2RC0 1 0.334087019303 0.187114168357
+ CRL1 NG301 1 0.347450500075 0.078275472531
+ CRL1 NG311 1 0.347450500075 0.088756043175
+ CRL1 NG321 1 0.346559601357 0.102486650838
+ CRL1 NG331 1 0.345668702638 0.110698234855
+ CRL1 NG3C51 1 0.334087019303 0.187114168357
+ CRL1 NG3N1 1 0.351904993665 0.102486650838
+ CRL1 NG3P0 1 0.334087019303 0.187114168357
+ CRL1 NG3P1 1 0.334087019303 0.187114168357
+ CRL1 NG3P2 1 0.334087019303 0.187114168357
+ CRL1 NG3P3 1 0.334087019303 0.187114168357
+ CRL1 OG2D1 1 0.293996576986 0.144938011577
+ CRL1 OG2D2 1 0.320723538531 0.144938011577
+ CRL1 OG2D3 1 0.293996576986 0.144938011577
+ CRL1 OG2D4 1 0.320723538531 0.144938011577
+ CRL1 OG2D5 1 0.320010819556 0.169954883425
+ CRL1 OG2N1 1 0.320723538531 0.144938011577
+ CRL1 OG2P1 1 0.320723538531 0.144938011577
+ CRL1 OG2R50 1 0.320723538531 0.144938011577
+ CRL1 OG3R60 1 0.316269044940 0.132309697301
+ CRL1 OG301 1 0.316269044940 0.132309697301
+ CRL1 OG302 1 0.316269044940 0.132309697301
+ CRL1 OG303 1 0.316269044940 0.132309697301
+ CRL1 OG304 1 0.316269044940 0.132309697301
+ CRL1 OG311 1 0.326514380198 0.183381431383
+ CRL1 OG312 1 0.325178032121 0.144938011577
+ CRL1 OG3C31 1 0.316269044940 0.132309697301
+ CRL1 OG3C51 1 0.316269044940 0.132309697301
+ CRL1 OG3C61 1 0.316269044940 0.132309697301
+ CRL1 SG2D1 1 0.351904993665 0.314496560236
+ CRL1 SG2R50 1 0.347450500075 0.280671252536
+ CRL1 SG311 1 0.347450500075 0.280671252536
+ CRL1 SG301 1 0.345223253279 0.257919081884
+ CRL1 SG302 1 0.365268474438 0.286840588481
+ CRL1 SG3O1 1 0.356359487256 0.286840588481
+ CRL1 SG3O2 1 0.347450500075 0.247528778125
+ CRL1 SG3O3 1 0.347450500075 0.247528778125
+ CRL1 FGA1 1 0.314487247504 0.153729976257
+ CRL1 FGA2 1 0.314487247504 0.135577095411
+ CRL1 FGA3 1 0.311814551349 0.130309939452
+ CRL1 FGP1 1 0.311814551349 0.130309939452
+ CRL1 FGR1 1 0.320723538531 0.144938011577
+ CRL1 CLGA1 1 0.339432411611 0.245040988571
+ CRL1 CLGA3 1 0.339432411611 0.232955260941
+ CRL1 CLGR1 1 0.341214209048 0.236682781799
+ CRL1 BRGA1 1 0.344777803920 0.289876023155
+ CRL1 BRGA2 1 0.351904993665 0.304599797767
+ CRL1 BRGA3 1 0.347450500075 0.307459952514
+ CRL1 BRGR1 1 0.353686791102 0.271154190821
+ CRL1 IGR1 1 0.364377575719 0.310293744700
+ CRL1 PG0 1 0.360813980847 0.320014464673
+ CRL1 PG1 1 0.360813980847 0.320014464673
+ CRL1 PG2 1 0.360813980847 0.320014464673
+ CRL1 ALG1 1 0.347450500075 0.337324864189
+ CRL1 CC301 1 0.338541512893 0.041840000000
+ CRL1 CC3062 1 0.338541512893 0.041840000000
+ CRL1 CC311 1 0.338541512893 0.041840000000
+ CRL1 CC3161 1 0.338541512893 0.041840000000
+ CRL1 CC3162 1 0.338541512893 0.041840000000
+ CRL1 CC3163 1 0.338541512893 0.041840000000
+ CRL1 CC321 1 0.338541512893 0.041840000000
+ CRL1 CC3261 1 0.338541512893 0.041840000000
+ CRL1 CC3263 1 0.338541512893 0.041840000000
+ CRL1 CC331 1 0.338541512893 0.041840000000
+ CRL1 CC2O1 1 0.347450500075 0.138767581228
+ CRL1 CC2O2 1 0.347450500075 0.110698234855
+ CRL1 CC2O3 1 0.347450500075 0.125520000000
+ CRL1 CC2O4 1 0.329632525712 0.102486650838
+ CRL1 OC2D1 1 0.293996576986 0.144938011577
+ CRL1 OC2D2 1 0.320723538531 0.144938011577
+ CRL1 OC2D3 1 0.293996576986 0.144938011577
+ CRL1 OC2D4 1 0.293996576986 0.144938011577
+ CRL1 OC3C61 1 0.316269044940 0.132309697301
+ CRL1 OC311 1 0.326514380198 0.183381431383
+ CRL1 NC2D1 1 0.307360057758 0.187114168357
+ CRL1 HCP1 1 0.189271432669 0.089736802707
+ CRL1 HCA1 1 0.288651184677 0.088756043175
+ CRL1 HCA2 1 0.288651184677 0.078275472531
+ CRL1 HCA3 1 0.288651184677 0.064818249282
+ CRL1 CC312 1 0.338541512893 0.041840000000
+ CRL1 CC322 1 0.338541512893 0.041840000000
+ CRL1 HCR1 1 0.240542653898 0.089736802707
+ CRL1 HCA3M 1 0.288651184677 0.064818249282
+ CRL1 CC321C 1 0.338541512893 0.041840000000
+ CRL1 CC321D 1 0.338541512893 0.041840000000
+ CRL1 CC311C 1 0.338541512893 0.041840000000
+ CRL1 CC311D 1 0.338541512893 0.041840000000
+ CRL1 OC301 1 0.316269044940 0.132309697301
+ CRL1 OC302 1 0.316269044940 0.132309697301
+ CRL1 HCP1M 1 0.189271432669 0.089736802707
+ CRL1 OC311M 1 0.326514380198 0.183381431383
+ CRL1 OC3C5M 1 0.316269044940 0.132309697301
+ CRL1 CC322C 1 0.338541512893 0.041840000000
+ CRL1 HCA2C2 1 0.285087589805 0.078275472531
+ CRL1 CC312C 1 0.338541512893 0.041840000000
+ CRL1 HCA1C2 1 0.288651184677 0.088756043175
+ CRL1 OC3C51 1 0.316269044940 0.132309697301
+ CRL1 CC3152 1 0.338541512893 0.041840000000
+ CRL1 CC3051 1 0.338541512893 0.041840000000
+ CRL1 CC3251 1 0.338541512893 0.041840000000
+ CRL1 CC3151 1 0.338541512893 0.041840000000
+ CRL1 CC3153 1 0.338541512893 0.041840000000
+ CRL1 OC2DP 1 0.320723538531 0.144938011577
+ CRL1 OC312 1 0.326959829558 0.163176000000
+ CRL1 OC30P 1 0.326959829558 0.163176000000
+ CRL1 PC 1 0.360813980847 0.320014464673
+ CRL1 SC 1 0.356359487256 0.286840588481
+ CRL1 CC312D 1 0.338541512893 0.041840000000
+ CRL1 OC303 1 0.316269044940 0.132309697301
+ CRL1 HN1 1 0.189271432669 0.089736802707
+ CRL1 HN2 1 0.189271432669 0.089736802707
+ CRL1 HN3 1 0.267269615442 0.089736802707
+ CRL1 HN4 1 0.189271432669 0.089736802707
+ CRL1 HN5 1 0.189271432669 0.089736802707
+ CRL1 HN6 1 0.286869387241 0.062058748940
+ CRL1 HN7 1 0.286869387241 0.062058748940
+ CRL1 HN8 1 0.288651184677 0.070011711020
+ CRL1 HN9 1 0.288651184677 0.064818249282
+ CRL1 NN1 1 0.334087019303 0.187114168357
+ CRL1 NN2 1 0.334087019303 0.187114168357
+ CRL1 NN2B 1 0.334087019303 0.187114168357
+ CRL1 NN2G 1 0.334087019303 0.187114168357
+ CRL1 NN2U 1 0.334087019303 0.187114168357
+ CRL1 NN3 1 0.334087019303 0.187114168357
+ CRL1 NN3A 1 0.334087019303 0.187114168357
+ CRL1 NN3G 1 0.334087019303 0.187114168357
+ CRL1 NN4 1 0.334087019303 0.187114168357
+ CRL1 NN6 1 0.334087019303 0.187114168357
+ CRL1 ON1 1 0.320723538531 0.144938011577
+ CRL1 ON1C 1 0.320723538531 0.144938011577
+ CRL1 ON2 1 0.326959829558 0.163176000000
+ CRL1 ON3 1 0.320723538531 0.144938011577
+ CRL1 ON4 1 0.326959829558 0.163176000000
+ CRL1 ON5 1 0.326959829558 0.163176000000
+ CRL1 ON6 1 0.326959829558 0.163176000000
+ CRL1 ON6B 1 0.326959829558 0.163176000000
+ CRL1 CN1 1 0.338541512893 0.132309697301
+ CRL1 CN1T 1 0.338541512893 0.132309697301
+ CRL1 CN2 1 0.338541512893 0.132309697301
+ CRL1 CN3 1 0.338541512893 0.125520000000
+ CRL1 CN3T 1 0.338541512893 0.125520000000
+ CRL1 CN4 1 0.338541512893 0.114583559030
+ CRL1 CN5 1 0.338541512893 0.114583559030
+ CRL1 CN5G 1 0.338541512893 0.114583559030
+ CRL1 CN7 1 0.338541512893 0.041840000000
+ CRL1 CN7B 1 0.338541512893 0.041840000000
+ CRL1 CN8 1 0.338541512893 0.041840000000
+ CRL1 CN8B 1 0.338541512893 0.041840000000
+ CRL1 CN9 1 0.338541512893 0.041840000000
+ CRL1 P 1 0.360813980847 0.320014464673
+ CRL1 P2 1 0.360813980847 0.320014464673
+ CRL1 HOL 1 0.189271432669 0.089736802707
+ CRL1 HAL1 1 0.286869387241 0.062058748940
+ CRL1 HAL2 1 0.288651184677 0.070011711020
+ CRL1 HAL3 1 0.288651184677 0.064818249282
+ CRL1 HBL 1 0.286869387241 0.062058748940
+ CRL1 HCL 1 0.189271432669 0.089736802707
+ CRL1 HL 1 0.231633666716 0.089736802707
+ CRL1 HEL1 1 0.280633096214 0.073666921749
+ CRL1 HEL2 1 0.281523994932 0.067464972838
+ CRL1 CL 1 0.347450500075 0.110698234855
+ CRL1 CCL 1 0.347450500075 0.110698234855
+ CRL1 CTL1 1 0.338541512893 0.041840000000
+ CRL1 CTL2 1 0.338541512893 0.041840000000
+ CRL1 CTL3 1 0.338541512893 0.041840000000
+ CRL1 CTL5 1 0.338541512893 0.041840000000
+ CRL1 CEL1 1 0.355468588538 0.109105371453
+ CRL1 CEL2 1 0.354577689820 0.105847757841
+ CRL1 CRL1 1 0.338541512893 0.041840000000
+ CRL1 CRL2 1 0.338541512893 0.041840000000
+ CRL1 OBL 1 0.293996576986 0.144938011577
+ CRL1 OCL 1 0.320723538531 0.144938011577
+ CRL1 O2L 1 0.320723538531 0.144938011577
+ CRL1 OHL 1 0.326959829558 0.163176000000
+ CRL1 OSL 1 0.316269044940 0.132309697301
+ CRL1 OSLP 1 0.316269044940 0.132309697301
+ CRL1 NH3L 1 0.334087019303 0.187114168357
+ CRL1 NTL 1 0.334087019303 0.187114168357
+ CRL1 SL 1 0.356359487256 0.286840588481
+ CRL1 PL 1 0.360813980847 0.320014464673
+ CRL1 HCA1A 1 0.288651184677 0.088756043175
+ CRL1 HCA2A 1 0.288651184677 0.078275472531
+ CRL1 HCA3A 1 0.288651184677 0.064818249282
+ CRL1 CC30A 1 0.338541512893 0.041840000000
+ CRL1 CC31A 1 0.338541512893 0.041840000000
+ CRL1 CC32A 1 0.338541512893 0.041840000000
+ CRL1 CC33A 1 0.338541512893 0.041840000000
+ CRL1 CC326A 1 0.338541512893 0.041840000000
+ CRL1 HCA25A 1 0.285087589805 0.078275472531
+ CRL1 CC325A 1 0.338541512893 0.041840000000
+ CRL1 CC325B 1 0.338541512893 0.041840000000
+ CRL1 OC305A 1 0.316269044940 0.132309697301
+ CRL1 OC30A 1 0.316269044940 0.132309697301
+ CRL1 CPA 1 0.329632525712 0.125520000000
+ CRL1 CPB 1 0.329632525712 0.125520000000
+ CRL1 CPM 1 0.329632525712 0.125520000000
+ CRL1 CM 1 0.356359487256 0.138767581228
+ CRL1 CST 1 0.308518226092 0.100764063435
+ CRL1 NPH 1 0.334087019303 0.187114168357
+ CRL1 OM 1 0.320723538531 0.144938011577
+ CRL1 OST 1 0.320010819556 0.169954883425
+ CRL1 FE 1 0.227179173126 0.000000000000
+ CRL1 ON2B 1 0.326959829558 0.163176000000
+ CRL1 SP 1 0.365268474438 0.280671252536
+ CRL2 C 1 0.347450500075 0.138767581228
+ CRL2 CA 1 0.346773417049 0.110698234855
+ CRL2 CC 1 0.347450500075 0.110698234855
+ CRL2 CD 1 0.347450500075 0.110698234855
+ CRL2 CE1 1 0.355468588538 0.109105371453
+ CRL2 CE2 1 0.354577689820 0.105847757841
+ CRL2 CP1 1 0.338541512893 0.041840000000
+ CRL2 CP2 1 0.338541512893 0.041840000000
+ CRL2 CP3 1 0.338541512893 0.041840000000
+ CRL2 CPH1 1 0.329632525712 0.093557084179
+ CRL2 CPH2 1 0.329632525712 0.093557084179
+ CRL2 CS 1 0.365268474438 0.138767581228
+ CRL2 CPT 1 0.334977918021 0.131646486622
+ CRL2 CY 1 0.346559601357 0.113045454929
+ CRL2 CAI 1 0.346559601357 0.113045454929
+ CRL2 CT 1 0.338541512893 0.041840000000
+ CRL2 CT1 1 0.338541512893 0.041840000000
+ CRL2 CT2 1 0.338541512893 0.041840000000
+ CRL2 CT2A 1 0.338541512893 0.041840000000
+ CRL2 CT3 1 0.338541512893 0.041840000000
+ CRL2 H 1 0.189271432669 0.089736802707
+ CRL2 HA 1 0.286869387241 0.062058748940
+ CRL2 HB1 1 0.286869387241 0.062058748940
+ CRL2 HB2 1 0.288651184677 0.070011711020
+ CRL2 HE1 1 0.280633096214 0.073666921749
+ CRL2 HE2 1 0.281523994932 0.067464972838
+ CRL2 HC 1 0.189271432669 0.089736802707
+ CRL2 HP 1 0.290272620344 0.072469005789
+ CRL2 HR1 1 0.249451641079 0.089736802707
+ CRL2 HR2 1 0.231633666716 0.089736802707
+ CRL2 HR3 1 0.300054688270 0.036952087465
+ CRL2 HS 1 0.209361198763 0.132309697301
+ CRL2 HA1 1 0.288651184677 0.088756043175
+ CRL2 HA2 1 0.288651184677 0.077149148019
+ CRL2 HA3 1 0.288651184677 0.064818249282
+ CRL2 N 1 0.334087019303 0.004184000000
+ CRL2 NC2 1 0.334087019303 0.187114168357
+ CRL2 NH1 1 0.307360057758 0.187114168357
+ CRL2 NH2 1 0.334087019303 0.187114168357
+ CRL2 NH3 1 0.334087019303 0.187114168357
+ CRL2 NP 1 0.334087019303 0.187114168357
+ CRL2 NR1 1 0.334087019303 0.187114168357
+ CRL2 NR2 1 0.334087019303 0.187114168357
+ CRL2 NR3 1 0.334087019303 0.187114168357
+ CRL2 NY 1 0.334087019303 0.187114168357
+ CRL2 O 1 0.293996576986 0.144938011577
+ CRL2 OB 1 0.293996576986 0.144938011577
+ CRL2 OC 1 0.320723538531 0.144938011577
+ CRL2 OH1 1 0.326959829558 0.163176000000
+ CRL2 OS 1 0.326959829558 0.163176000000
+ CRL2 S 1 0.347450500075 0.280671252536
+ CRL2 SM 1 0.345223253279 0.257919081884
+ CRL2 SS 1 0.365268474438 0.286840588481
+ CRL2 HT 1 0.189271432669 0.089736802707
+ CRL2 OT 1 0.326799467788 0.163176000000
+ CRL2 OX 1 0.320723538531 0.144938011577
+ CRL2 HX 1 0.189271432669 0.089736802707
+ CRL2 LIT 1 0.284864865125 0.020196198771
+ CRL2 SOD 1 0.294954293108 0.090610410351
+ CRL2 MG 1 0.274842254546 0.051243325419
+ CRL2 POT 1 0.326403017859 0.123410269913
+ CRL2 CAL 1 0.291056611216 0.144938011577
+ CRL2 RUB 1 0.338541512893 0.162045623205
+ CRL2 CES 1 0.356359487256 0.182376331798
+ CRL2 BAR 1 0.337650614175 0.162045623205
+ CRL2 ZN 1 0.266378716724 0.209200000000
+ CRL2 CAD 1 0.290165712498 0.144938011577
+ CRL2 CLA 1 0.371504765465 0.162045623205
+ CRL2 HGA1 1 0.288651184677 0.088756043175
+ CRL2 HGA2 1 0.288651184677 0.078275472531
+ CRL2 HGA3 1 0.288651184677 0.064818249282
+ CRL2 HGA4 1 0.280633096214 0.073666921749
+ CRL2 HGA5 1 0.281523994932 0.067464972838
+ CRL2 HGA6 1 0.286869387241 0.070011711020
+ CRL2 HGA7 1 0.285087589805 0.072469005789
+ CRL2 HGAAM0 1 0.283305792369 0.070011711020
+ CRL2 HGAAM1 1 0.283305792369 0.070011711020
+ CRL2 HGAAM2 1 0.281523994932 0.083680000000
+ CRL2 HGP1 1 0.189271432669 0.089736802707
+ CRL2 HGP2 1 0.189271432669 0.089736802707
+ CRL2 HGP3 1 0.209361198763 0.132309697301
+ CRL2 HGP4 1 0.189271432669 0.089736802707
+ CRL2 HGP5 1 0.231633666716 0.089736802707
+ CRL2 HGPAM1 1 0.247224394284 0.039692909190
+ CRL2 HGPAM2 1 0.247224394284 0.041840000000
+ CRL2 HGPAM3 1 0.246778944925 0.045833423612
+ CRL2 HGR51 1 0.290272620344 0.072469005789
+ CRL2 HGR52 1 0.249451641079 0.089736802707
+ CRL2 HGR53 1 0.231633666716 0.089736802707
+ CRL2 HGR61 1 0.290272620344 0.072469005789
+ CRL2 HGR62 1 0.267269615442 0.089736802707
+ CRL2 HGR63 1 0.249451641079 0.089736802707
+ CRL2 HGR71 1 0.290272620344 0.072469005789
+ CRL2 CG1T1 1 0.333196120584 0.170981810495
+ CRL2 CG1T2 1 0.346782326036 0.134409982486
+ CRL2 CG1N1 1 0.335868816739 0.177512086349
+ CRL2 CG2D1 1 0.355468588538 0.109105371453
+ CRL2 CG2D2 1 0.354577689820 0.105847757841
+ CRL2 CG2D1O 1 0.355468588538 0.109105371453
+ CRL2 CG2D2O 1 0.355468588538 0.109105371453
+ CRL2 CG2DC1 1 0.355468588538 0.109105371453
+ CRL2 CG2DC2 1 0.355468588538 0.109105371453
+ CRL2 CG2DC3 1 0.354577689820 0.105847757841
+ CRL2 CG25C1 1 0.355468588538 0.109105371453
+ CRL2 CG25C2 1 0.355468588538 0.109105371453
+ CRL2 CG251O 1 0.355468588538 0.109105371453
+ CRL2 CG252O 1 0.355468588538 0.109105371453
+ CRL2 CG2N1 1 0.347450500075 0.138767581228
+ CRL2 CG2N2 1 0.347450500075 0.138767581228
+ CRL2 CG2O1 1 0.347450500075 0.138767581228
+ CRL2 CG2O2 1 0.320723538531 0.130979917850
+ CRL2 CG2O3 1 0.347450500075 0.110698234855
+ CRL2 CG2O4 1 0.329632525712 0.102486650838
+ CRL2 CG2O5 1 0.347450500075 0.125520000000
+ CRL2 CG2O6 1 0.347450500075 0.110698234855
+ CRL2 CG2O7 1 0.308518226092 0.100764063435
+ CRL2 CG2R51 1 0.356359487256 0.093557084179
+ CRL2 CG2R52 1 0.365268474438 0.059170695450
+ CRL2 CG2R53 1 0.365268474438 0.059170695450
+ CRL2 CG2R57 1 0.356359487256 0.093557084179
+ CRL2 CG2R61 1 0.346773417049 0.110698234855
+ CRL2 CG2R62 1 0.338541512893 0.125520000000
+ CRL2 CG2R63 1 0.338541512893 0.132309697301
+ CRL2 CG2R64 1 0.356359487256 0.083680000000
+ CRL2 CG2R66 1 0.338541512893 0.110698234855
+ CRL2 CG2R67 1 0.346773417049 0.110698234855
+ CRL2 CG2RC0 1 0.334977918021 0.131646486622
+ CRL2 CG2R71 1 0.346987232741 0.108300154755
+ CRL2 CG2RC7 1 0.334977918021 0.131646486622
+ CRL2 CG301 1 0.338541512893 0.041840000000
+ CRL2 CG302 1 0.374177461619 0.059170695450
+ CRL2 CG311 1 0.338541512893 0.041840000000
+ CRL2 CG312 1 0.351904993665 0.085746484010
+ CRL2 CG314 1 0.338541512893 0.041840000000
+ CRL2 CG321 1 0.338541512893 0.041840000000
+ CRL2 CG322 1 0.338541512893 0.102486650838
+ CRL2 CG323 1 0.365268474438 0.138767581228
+ CRL2 CG324 1 0.338541512893 0.041840000000
+ CRL2 CG331 1 0.338541512893 0.041840000000
+ CRL2 CG334 1 0.338541512893 0.041840000000
+ CRL2 CG3C50 1 0.338541512893 0.041840000000
+ CRL2 CG3C51 1 0.338541512893 0.041840000000
+ CRL2 CG3C52 1 0.338541512893 0.041840000000
+ CRL2 CG3C53 1 0.338541512893 0.041840000000
+ CRL2 CG3C54 1 0.338541512893 0.041840000000
+ CRL2 CG3C31 1 0.338541512893 0.041840000000
+ CRL2 CG3C41 1 0.338541512893 0.041840000000
+ CRL2 CG3RC1 1 0.338541512893 0.041840000000
+ CRL2 CG3AM0 1 0.344777803920 0.110698234855
+ CRL2 CG3AM1 1 0.345668702638 0.116852760686
+ CRL2 CG3AM2 1 0.346559601357 0.118341390899
+ CRL2 NG1T1 1 0.328741626994 0.177512086349
+ CRL2 NG2D1 1 0.334087019303 0.187114168357
+ CRL2 NG2S0 1 0.334087019303 0.004184000000
+ CRL2 NG2S1 1 0.307360057758 0.187114168357
+ CRL2 NG2S2 1 0.334087019303 0.187114168357
+ CRL2 NG2S3 1 0.334087019303 0.187114168357
+ CRL2 NG2O1 1 0.334087019303 0.187114168357
+ CRL2 NG2P1 1 0.334087019303 0.187114168357
+ CRL2 NG2R43 1 0.334087019303 0.187114168357
+ CRL2 NG2R50 1 0.334087019303 0.187114168357
+ CRL2 NG2R51 1 0.334087019303 0.187114168357
+ CRL2 NG2R52 1 0.334087019303 0.187114168357
+ CRL2 NG2R53 1 0.334087019303 0.187114168357
+ CRL2 NG2R57 1 0.334087019303 0.187114168357
+ CRL2 NG2R60 1 0.337650614175 0.102486650838
+ CRL2 NG2R61 1 0.334087019303 0.187114168357
+ CRL2 NG2R62 1 0.352795892384 0.093557084179
+ CRL2 NG2R67 1 0.334087019303 0.187114168357
+ CRL2 NG2RC0 1 0.334087019303 0.187114168357
+ CRL2 NG301 1 0.347450500075 0.078275472531
+ CRL2 NG311 1 0.347450500075 0.088756043175
+ CRL2 NG321 1 0.346559601357 0.102486650838
+ CRL2 NG331 1 0.345668702638 0.110698234855
+ CRL2 NG3C51 1 0.334087019303 0.187114168357
+ CRL2 NG3N1 1 0.351904993665 0.102486650838
+ CRL2 NG3P0 1 0.334087019303 0.187114168357
+ CRL2 NG3P1 1 0.334087019303 0.187114168357
+ CRL2 NG3P2 1 0.334087019303 0.187114168357
+ CRL2 NG3P3 1 0.334087019303 0.187114168357
+ CRL2 OG2D1 1 0.293996576986 0.144938011577
+ CRL2 OG2D2 1 0.320723538531 0.144938011577
+ CRL2 OG2D3 1 0.293996576986 0.144938011577
+ CRL2 OG2D4 1 0.320723538531 0.144938011577
+ CRL2 OG2D5 1 0.320010819556 0.169954883425
+ CRL2 OG2N1 1 0.320723538531 0.144938011577
+ CRL2 OG2P1 1 0.320723538531 0.144938011577
+ CRL2 OG2R50 1 0.320723538531 0.144938011577
+ CRL2 OG3R60 1 0.316269044940 0.132309697301
+ CRL2 OG301 1 0.316269044940 0.132309697301
+ CRL2 OG302 1 0.316269044940 0.132309697301
+ CRL2 OG303 1 0.316269044940 0.132309697301
+ CRL2 OG304 1 0.316269044940 0.132309697301
+ CRL2 OG311 1 0.326514380198 0.183381431383
+ CRL2 OG312 1 0.325178032121 0.144938011577
+ CRL2 OG3C31 1 0.316269044940 0.132309697301
+ CRL2 OG3C51 1 0.316269044940 0.132309697301
+ CRL2 OG3C61 1 0.316269044940 0.132309697301
+ CRL2 SG2D1 1 0.351904993665 0.314496560236
+ CRL2 SG2R50 1 0.347450500075 0.280671252536
+ CRL2 SG311 1 0.347450500075 0.280671252536
+ CRL2 SG301 1 0.345223253279 0.257919081884
+ CRL2 SG302 1 0.365268474438 0.286840588481
+ CRL2 SG3O1 1 0.356359487256 0.286840588481
+ CRL2 SG3O2 1 0.347450500075 0.247528778125
+ CRL2 SG3O3 1 0.347450500075 0.247528778125
+ CRL2 FGA1 1 0.314487247504 0.153729976257
+ CRL2 FGA2 1 0.314487247504 0.135577095411
+ CRL2 FGA3 1 0.311814551349 0.130309939452
+ CRL2 FGP1 1 0.311814551349 0.130309939452
+ CRL2 FGR1 1 0.320723538531 0.144938011577
+ CRL2 CLGA1 1 0.339432411611 0.245040988571
+ CRL2 CLGA3 1 0.339432411611 0.232955260941
+ CRL2 CLGR1 1 0.341214209048 0.236682781799
+ CRL2 BRGA1 1 0.344777803920 0.289876023155
+ CRL2 BRGA2 1 0.351904993665 0.304599797767
+ CRL2 BRGA3 1 0.347450500075 0.307459952514
+ CRL2 BRGR1 1 0.353686791102 0.271154190821
+ CRL2 IGR1 1 0.364377575719 0.310293744700
+ CRL2 PG0 1 0.360813980847 0.320014464673
+ CRL2 PG1 1 0.360813980847 0.320014464673
+ CRL2 PG2 1 0.360813980847 0.320014464673
+ CRL2 ALG1 1 0.347450500075 0.337324864189
+ CRL2 CC301 1 0.338541512893 0.041840000000
+ CRL2 CC3062 1 0.338541512893 0.041840000000
+ CRL2 CC311 1 0.338541512893 0.041840000000
+ CRL2 CC3161 1 0.338541512893 0.041840000000
+ CRL2 CC3162 1 0.338541512893 0.041840000000
+ CRL2 CC3163 1 0.338541512893 0.041840000000
+ CRL2 CC321 1 0.338541512893 0.041840000000
+ CRL2 CC3261 1 0.338541512893 0.041840000000
+ CRL2 CC3263 1 0.338541512893 0.041840000000
+ CRL2 CC331 1 0.338541512893 0.041840000000
+ CRL2 CC2O1 1 0.347450500075 0.138767581228
+ CRL2 CC2O2 1 0.347450500075 0.110698234855
+ CRL2 CC2O3 1 0.347450500075 0.125520000000
+ CRL2 CC2O4 1 0.329632525712 0.102486650838
+ CRL2 OC2D1 1 0.293996576986 0.144938011577
+ CRL2 OC2D2 1 0.320723538531 0.144938011577
+ CRL2 OC2D3 1 0.293996576986 0.144938011577
+ CRL2 OC2D4 1 0.293996576986 0.144938011577
+ CRL2 OC3C61 1 0.316269044940 0.132309697301
+ CRL2 OC311 1 0.326514380198 0.183381431383
+ CRL2 NC2D1 1 0.307360057758 0.187114168357
+ CRL2 HCP1 1 0.189271432669 0.089736802707
+ CRL2 HCA1 1 0.288651184677 0.088756043175
+ CRL2 HCA2 1 0.288651184677 0.078275472531
+ CRL2 HCA3 1 0.288651184677 0.064818249282
+ CRL2 CC312 1 0.338541512893 0.041840000000
+ CRL2 CC322 1 0.338541512893 0.041840000000
+ CRL2 HCR1 1 0.240542653898 0.089736802707
+ CRL2 HCA3M 1 0.288651184677 0.064818249282
+ CRL2 CC321C 1 0.338541512893 0.041840000000
+ CRL2 CC321D 1 0.338541512893 0.041840000000
+ CRL2 CC311C 1 0.338541512893 0.041840000000
+ CRL2 CC311D 1 0.338541512893 0.041840000000
+ CRL2 OC301 1 0.316269044940 0.132309697301
+ CRL2 OC302 1 0.316269044940 0.132309697301
+ CRL2 HCP1M 1 0.189271432669 0.089736802707
+ CRL2 OC311M 1 0.326514380198 0.183381431383
+ CRL2 OC3C5M 1 0.316269044940 0.132309697301
+ CRL2 CC322C 1 0.338541512893 0.041840000000
+ CRL2 HCA2C2 1 0.285087589805 0.078275472531
+ CRL2 CC312C 1 0.338541512893 0.041840000000
+ CRL2 HCA1C2 1 0.288651184677 0.088756043175
+ CRL2 OC3C51 1 0.316269044940 0.132309697301
+ CRL2 CC3152 1 0.338541512893 0.041840000000
+ CRL2 CC3051 1 0.338541512893 0.041840000000
+ CRL2 CC3251 1 0.338541512893 0.041840000000
+ CRL2 CC3151 1 0.338541512893 0.041840000000
+ CRL2 CC3153 1 0.338541512893 0.041840000000
+ CRL2 OC2DP 1 0.320723538531 0.144938011577
+ CRL2 OC312 1 0.326959829558 0.163176000000
+ CRL2 OC30P 1 0.326959829558 0.163176000000
+ CRL2 PC 1 0.360813980847 0.320014464673
+ CRL2 SC 1 0.356359487256 0.286840588481
+ CRL2 CC312D 1 0.338541512893 0.041840000000
+ CRL2 OC303 1 0.316269044940 0.132309697301
+ CRL2 HN1 1 0.189271432669 0.089736802707
+ CRL2 HN2 1 0.189271432669 0.089736802707
+ CRL2 HN3 1 0.267269615442 0.089736802707
+ CRL2 HN4 1 0.189271432669 0.089736802707
+ CRL2 HN5 1 0.189271432669 0.089736802707
+ CRL2 HN6 1 0.286869387241 0.062058748940
+ CRL2 HN7 1 0.286869387241 0.062058748940
+ CRL2 HN8 1 0.288651184677 0.070011711020
+ CRL2 HN9 1 0.288651184677 0.064818249282
+ CRL2 NN1 1 0.334087019303 0.187114168357
+ CRL2 NN2 1 0.334087019303 0.187114168357
+ CRL2 NN2B 1 0.334087019303 0.187114168357
+ CRL2 NN2G 1 0.334087019303 0.187114168357
+ CRL2 NN2U 1 0.334087019303 0.187114168357
+ CRL2 NN3 1 0.334087019303 0.187114168357
+ CRL2 NN3A 1 0.334087019303 0.187114168357
+ CRL2 NN3G 1 0.334087019303 0.187114168357
+ CRL2 NN4 1 0.334087019303 0.187114168357
+ CRL2 NN6 1 0.334087019303 0.187114168357
+ CRL2 ON1 1 0.320723538531 0.144938011577
+ CRL2 ON1C 1 0.320723538531 0.144938011577
+ CRL2 ON2 1 0.326959829558 0.163176000000
+ CRL2 ON3 1 0.320723538531 0.144938011577
+ CRL2 ON4 1 0.326959829558 0.163176000000
+ CRL2 ON5 1 0.326959829558 0.163176000000
+ CRL2 ON6 1 0.326959829558 0.163176000000
+ CRL2 ON6B 1 0.326959829558 0.163176000000
+ CRL2 CN1 1 0.338541512893 0.132309697301
+ CRL2 CN1T 1 0.338541512893 0.132309697301
+ CRL2 CN2 1 0.338541512893 0.132309697301
+ CRL2 CN3 1 0.338541512893 0.125520000000
+ CRL2 CN3T 1 0.338541512893 0.125520000000
+ CRL2 CN4 1 0.338541512893 0.114583559030
+ CRL2 CN5 1 0.338541512893 0.114583559030
+ CRL2 CN5G 1 0.338541512893 0.114583559030
+ CRL2 CN7 1 0.338541512893 0.041840000000
+ CRL2 CN7B 1 0.338541512893 0.041840000000
+ CRL2 CN8 1 0.338541512893 0.041840000000
+ CRL2 CN8B 1 0.338541512893 0.041840000000
+ CRL2 CN9 1 0.338541512893 0.041840000000
+ CRL2 P 1 0.360813980847 0.320014464673
+ CRL2 P2 1 0.360813980847 0.320014464673
+ CRL2 HOL 1 0.189271432669 0.089736802707
+ CRL2 HAL1 1 0.286869387241 0.062058748940
+ CRL2 HAL2 1 0.288651184677 0.070011711020
+ CRL2 HAL3 1 0.288651184677 0.064818249282
+ CRL2 HBL 1 0.286869387241 0.062058748940
+ CRL2 HCL 1 0.189271432669 0.089736802707
+ CRL2 HL 1 0.231633666716 0.089736802707
+ CRL2 HEL1 1 0.280633096214 0.073666921749
+ CRL2 HEL2 1 0.281523994932 0.067464972838
+ CRL2 CL 1 0.347450500075 0.110698234855
+ CRL2 CCL 1 0.347450500075 0.110698234855
+ CRL2 CTL1 1 0.338541512893 0.041840000000
+ CRL2 CTL2 1 0.338541512893 0.041840000000
+ CRL2 CTL3 1 0.338541512893 0.041840000000
+ CRL2 CTL5 1 0.338541512893 0.041840000000
+ CRL2 CEL1 1 0.355468588538 0.109105371453
+ CRL2 CEL2 1 0.354577689820 0.105847757841
+ CRL2 CRL1 1 0.338541512893 0.041840000000
+ CRL2 CRL2 1 0.338541512893 0.041840000000
+ CRL2 OBL 1 0.293996576986 0.144938011577
+ CRL2 OCL 1 0.320723538531 0.144938011577
+ CRL2 O2L 1 0.320723538531 0.144938011577
+ CRL2 OHL 1 0.326959829558 0.163176000000
+ CRL2 OSL 1 0.316269044940 0.132309697301
+ CRL2 OSLP 1 0.316269044940 0.132309697301
+ CRL2 NH3L 1 0.334087019303 0.187114168357
+ CRL2 NTL 1 0.334087019303 0.187114168357
+ CRL2 SL 1 0.356359487256 0.286840588481
+ CRL2 PL 1 0.360813980847 0.320014464673
+ CRL2 HCA1A 1 0.288651184677 0.088756043175
+ CRL2 HCA2A 1 0.288651184677 0.078275472531
+ CRL2 HCA3A 1 0.288651184677 0.064818249282
+ CRL2 CC30A 1 0.338541512893 0.041840000000
+ CRL2 CC31A 1 0.338541512893 0.041840000000
+ CRL2 CC32A 1 0.338541512893 0.041840000000
+ CRL2 CC33A 1 0.338541512893 0.041840000000
+ CRL2 CC326A 1 0.338541512893 0.041840000000
+ CRL2 HCA25A 1 0.285087589805 0.078275472531
+ CRL2 CC325A 1 0.338541512893 0.041840000000
+ CRL2 CC325B 1 0.338541512893 0.041840000000
+ CRL2 OC305A 1 0.316269044940 0.132309697301
+ CRL2 OC30A 1 0.316269044940 0.132309697301
+ CRL2 CPA 1 0.329632525712 0.125520000000
+ CRL2 CPB 1 0.329632525712 0.125520000000
+ CRL2 CPM 1 0.329632525712 0.125520000000
+ CRL2 CM 1 0.356359487256 0.138767581228
+ CRL2 CST 1 0.308518226092 0.100764063435
+ CRL2 NPH 1 0.334087019303 0.187114168357
+ CRL2 OM 1 0.320723538531 0.144938011577
+ CRL2 OST 1 0.320010819556 0.169954883425
+ CRL2 FE 1 0.227179173126 0.000000000000
+ CRL2 ON2B 1 0.326959829558 0.163176000000
+ CRL2 SP 1 0.365268474438 0.280671252536
+ OBL C 1 0.302905564168 0.480705002262
+ OBL CA 1 0.302228481142 0.383469934154
+ OBL CC 1 0.302905564168 0.383469934154
+ OBL CD 1 0.302905564168 0.383469934154
+ OBL CE1 1 0.310923652631 0.377952093472
+ OBL CE2 1 0.310032753913 0.366667388896
+ OBL CP1 1 0.293996576986 0.144938011577
+ OBL CP2 1 0.293996576986 0.144938011577
+ OBL CP3 1 0.293996576986 0.144938011577
+ OBL CPH1 1 0.285087589805 0.324091246411
+ OBL CPH2 1 0.285087589805 0.324091246411
+ OBL CS 1 0.320723538531 0.480705002262
+ OBL CPT 1 0.290432982114 0.456036806936
+ OBL CY 1 0.302014665450 0.391600943002
+ OBL CAI 1 0.302014665450 0.391600943002
+ OBL CT 1 0.293996576986 0.144938011577
+ OBL CT1 1 0.293996576986 0.144938011577
+ OBL CT2 1 0.293996576986 0.144938011577
+ OBL CT2A 1 0.293996576986 0.144938011577
+ OBL CT3 1 0.293996576986 0.144938011577
+ OBL H 1 0.144726496762 0.310857403193
+ OBL HA 1 0.242324451334 0.214977812437
+ OBL HB1 1 0.242324451334 0.214977812437
+ OBL HB2 1 0.244106248770 0.242527681224
+ OBL HE1 1 0.236088160307 0.255189702614
+ OBL HE2 1 0.236979059025 0.233705521373
+ OBL HC 1 0.144726496762 0.310857403193
+ OBL HP 1 0.245727684437 0.251040000000
+ OBL HR1 1 0.204906705172 0.310857403193
+ OBL HR2 1 0.187088730809 0.310857403193
+ OBL HR3 1 0.255509752363 0.128005785869
+ OBL HS 1 0.164816262856 0.458334236120
+ OBL HA1 1 0.244106248770 0.307459952514
+ OBL HA2 1 0.244106248770 0.267252488258
+ OBL HA3 1 0.244106248770 0.224537002029
+ OBL N 1 0.289542083396 0.014493801158
+ OBL NC2 1 0.289542083396 0.648182492821
+ OBL NH1 1 0.262815121851 0.648182492821
+ OBL NH2 1 0.289542083396 0.648182492821
+ OBL NH3 1 0.289542083396 0.648182492821
+ OBL NP 1 0.289542083396 0.648182492821
+ OBL NR1 1 0.289542083396 0.648182492821
+ OBL NR2 1 0.289542083396 0.648182492821
+ OBL NR3 1 0.289542083396 0.648182492821
+ OBL NY 1 0.289542083396 0.648182492821
+ OBL O 1 0.249451641079 0.502080000000
+ OBL OB 1 0.249451641079 0.502080000000
+ OBL OC 1 0.276178602624 0.502080000000
+ OBL OH1 1 0.282414893650 0.565258245152
+ OBL OS 1 0.282414893650 0.565258245152
+ OBL S 1 0.302905564168 0.972273739232
+ OBL SM 1 0.300678317372 0.893457908130
+ OBL SS 1 0.320723538531 0.993644945843
+ OBL HT 1 0.144726496762 0.310857403193
+ OBL OT 1 0.282254531881 0.565258245152
+ OBL OX 1 0.276178602624 0.502080000000
+ OBL HX 1 0.144726496762 0.310857403193
+ OBL LIT 1 0.240319929218 0.069961684782
+ OBL SOD 1 0.250409357201 0.313883668846
+ OBL MG 1 0.230297318639 0.177512086349
+ OBL POT 1 0.281858081952 0.427505715330
+ OBL CAL 1 0.246511675309 0.502080000000
+ OBL RUB 1 0.293996576986 0.561342505072
+ OBL CES 1 0.311814551349 0.631770145543
+ OBL BAR 1 0.293105678268 0.561342505072
+ OBL ZN 1 0.221833780817 0.724690057887
+ OBL CAD 1 0.245620776591 0.502080000000
+ OBL CLA 1 0.326959829558 0.561342505072
+ OBL HGA1 1 0.244106248770 0.307459952514
+ OBL HGA2 1 0.244106248770 0.271154190821
+ OBL HGA3 1 0.244106248770 0.224537002029
+ OBL HGA4 1 0.236088160307 0.255189702614
+ OBL HGA5 1 0.236979059025 0.233705521373
+ OBL HGA6 1 0.242324451334 0.242527681224
+ OBL HGA7 1 0.240542653898 0.251040000000
+ OBL HGAAM0 1 0.238760856462 0.242527681224
+ OBL HGAAM1 1 0.238760856462 0.242527681224
+ OBL HGAAM2 1 0.236979059025 0.289876023155
+ OBL HGP1 1 0.144726496762 0.310857403193
+ OBL HGP2 1 0.144726496762 0.310857403193
+ OBL HGP3 1 0.164816262856 0.458334236120
+ OBL HGP4 1 0.144726496762 0.310857403193
+ OBL HGP5 1 0.187088730809 0.310857403193
+ OBL HGPAM1 1 0.202679458377 0.137500270836
+ OBL HGPAM2 1 0.202679458377 0.144938011577
+ OBL HGPAM3 1 0.202234009018 0.158771636762
+ OBL HGR51 1 0.245727684437 0.251040000000
+ OBL HGR52 1 0.204906705172 0.310857403193
+ OBL HGR53 1 0.187088730809 0.310857403193
+ OBL HGR61 1 0.245727684437 0.251040000000
+ OBL HGR62 1 0.222724679535 0.310857403193
+ OBL HGR63 1 0.204906705172 0.310857403193
+ OBL HGR71 1 0.245727684437 0.251040000000
+ OBL CG1T1 1 0.288651184677 0.592298365893
+ OBL CG1T2 1 0.302237390129 0.465609837422
+ OBL CG1N1 1 0.291323880832 0.614919905028
+ OBL CG2D1 1 0.310923652631 0.377952093472
+ OBL CG2D2 1 0.310032753913 0.366667388896
+ OBL CG2D1O 1 0.310923652631 0.377952093472
+ OBL CG2D2O 1 0.310923652631 0.377952093472
+ OBL CG2DC1 1 0.310923652631 0.377952093472
+ OBL CG2DC2 1 0.310923652631 0.377952093472
+ OBL CG2DC3 1 0.310032753913 0.366667388896
+ OBL CG25C1 1 0.310923652631 0.377952093472
+ OBL CG25C2 1 0.310923652631 0.377952093472
+ OBL CG251O 1 0.310923652631 0.377952093472
+ OBL CG252O 1 0.310923652631 0.377952093472
+ OBL CG2N1 1 0.302905564168 0.480705002262
+ OBL CG2N2 1 0.302905564168 0.480705002262
+ OBL CG2O1 1 0.302905564168 0.480705002262
+ OBL CG2O2 1 0.276178602624 0.453727744975
+ OBL CG2O3 1 0.302905564168 0.383469934154
+ OBL CG2O4 1 0.285087589805 0.355024172698
+ OBL CG2O5 1 0.302905564168 0.434814034732
+ OBL CG2O6 1 0.302905564168 0.383469934154
+ OBL CG2O7 1 0.263973290185 0.349056954894
+ OBL CG2R51 1 0.311814551349 0.324091246411
+ OBL CG2R52 1 0.320723538531 0.204973301676
+ OBL CG2R53 1 0.320723538531 0.204973301676
+ OBL CG2R57 1 0.311814551349 0.324091246411
+ OBL CG2R61 1 0.302228481142 0.383469934154
+ OBL CG2R62 1 0.293996576986 0.434814034732
+ OBL CG2R63 1 0.293996576986 0.458334236120
+ OBL CG2R64 1 0.311814551349 0.289876023155
+ OBL CG2R66 1 0.293996576986 0.383469934154
+ OBL CG2R67 1 0.302228481142 0.383469934154
+ OBL CG2RC0 1 0.290432982114 0.456036806936
+ OBL CG2R71 1 0.302442296834 0.375162741007
+ OBL CG2RC7 1 0.290432982114 0.456036806936
+ OBL CG301 1 0.293996576986 0.144938011577
+ OBL CG302 1 0.329632525712 0.204973301676
+ OBL CG311 1 0.293996576986 0.144938011577
+ OBL CG312 1 0.307360057758 0.297034533750
+ OBL CG314 1 0.293996576986 0.144938011577
+ OBL CG321 1 0.293996576986 0.144938011577
+ OBL CG322 1 0.293996576986 0.355024172698
+ OBL CG323 1 0.320723538531 0.480705002262
+ OBL CG324 1 0.293996576986 0.144938011577
+ OBL CG331 1 0.293996576986 0.144938011577
+ OBL CG334 1 0.293996576986 0.144938011577
+ OBL CG3C50 1 0.293996576986 0.144938011577
+ OBL CG3C51 1 0.293996576986 0.144938011577
+ OBL CG3C52 1 0.293996576986 0.144938011577
+ OBL CG3C53 1 0.293996576986 0.144938011577
+ OBL CG3C54 1 0.293996576986 0.144938011577
+ OBL CG3C31 1 0.293996576986 0.144938011577
+ OBL CG3C41 1 0.293996576986 0.144938011577
+ OBL CG3RC1 1 0.293996576986 0.144938011577
+ OBL CG3AM0 1 0.300232868013 0.383469934154
+ OBL CG3AM1 1 0.301123766731 0.404789837027
+ OBL CG3AM2 1 0.302014665450 0.409946603352
+ OBL NG1T1 1 0.284196691087 0.614919905028
+ OBL NG2D1 1 0.289542083396 0.648182492821
+ OBL NG2S0 1 0.289542083396 0.014493801158
+ OBL NG2S1 1 0.262815121851 0.648182492821
+ OBL NG2S2 1 0.289542083396 0.648182492821
+ OBL NG2S3 1 0.289542083396 0.648182492821
+ OBL NG2O1 1 0.289542083396 0.648182492821
+ OBL NG2P1 1 0.289542083396 0.648182492821
+ OBL NG2R43 1 0.289542083396 0.648182492821
+ OBL NG2R50 1 0.289542083396 0.648182492821
+ OBL NG2R51 1 0.289542083396 0.648182492821
+ OBL NG2R52 1 0.289542083396 0.648182492821
+ OBL NG2R53 1 0.289542083396 0.648182492821
+ OBL NG2R57 1 0.289542083396 0.648182492821
+ OBL NG2R60 1 0.293105678268 0.355024172698
+ OBL NG2R61 1 0.289542083396 0.648182492821
+ OBL NG2R62 1 0.308250956477 0.324091246411
+ OBL NG2R67 1 0.289542083396 0.648182492821
+ OBL NG2RC0 1 0.289542083396 0.648182492821
+ OBL NG301 1 0.302905564168 0.271154190821
+ OBL NG311 1 0.302905564168 0.307459952514
+ OBL NG321 1 0.302014665450 0.355024172698
+ OBL NG331 1 0.301123766731 0.383469934154
+ OBL NG3C51 1 0.289542083396 0.648182492821
+ OBL NG3N1 1 0.307360057758 0.355024172698
+ OBL NG3P0 1 0.289542083396 0.648182492821
+ OBL NG3P1 1 0.289542083396 0.648182492821
+ OBL NG3P2 1 0.289542083396 0.648182492821
+ OBL NG3P3 1 0.289542083396 0.648182492821
+ OBL OG2D1 1 0.249451641079 0.502080000000
+ OBL OG2D2 1 0.276178602624 0.502080000000
+ OBL OG2D3 1 0.249451641079 0.502080000000
+ OBL OG2D4 1 0.276178602624 0.502080000000
+ OBL OG2D5 1 0.275465883649 0.588740986173
+ OBL OG2N1 1 0.276178602624 0.502080000000
+ OBL OG2P1 1 0.276178602624 0.502080000000
+ OBL OG2R50 1 0.276178602624 0.502080000000
+ OBL OG3R60 1 0.271724109033 0.458334236120
+ OBL OG301 1 0.271724109033 0.458334236120
+ OBL OG302 1 0.271724109033 0.458334236120
+ OBL OG303 1 0.271724109033 0.458334236120
+ OBL OG304 1 0.271724109033 0.458334236120
+ OBL OG311 1 0.281969444291 0.635251912639
+ OBL OG312 1 0.280633096214 0.502080000000
+ OBL OG3C31 1 0.271724109033 0.458334236120
+ OBL OG3C51 1 0.271724109033 0.458334236120
+ OBL OG3C61 1 0.271724109033 0.458334236120
+ OBL SG2D1 1 0.307360057758 1.089448042267
+ OBL SG2R50 1 0.302905564168 0.972273739232
+ OBL SG311 1 0.302905564168 0.972273739232
+ OBL SG301 1 0.300678317372 0.893457908130
+ OBL SG302 1 0.320723538531 0.993644945843
+ OBL SG3O1 1 0.311814551349 0.993644945843
+ OBL SG3O2 1 0.302905564168 0.857464840095
+ OBL SG3O3 1 0.302905564168 0.857464840095
+ OBL FGA1 1 0.269942311597 0.532536259047
+ OBL FGA2 1 0.269942311597 0.469652835188
+ OBL FGA3 1 0.267269615442 0.451406871724
+ OBL FGP1 1 0.267269615442 0.451406871724
+ OBL FGR1 1 0.276178602624 0.502080000000
+ OBL CLGA1 1 0.294887475704 0.848846884285
+ OBL CLGA3 1 0.294887475704 0.806980695680
+ OBL CLGR1 1 0.296669273141 0.819893206704
+ OBL BRGA1 1 0.300232868013 1.004160000000
+ OBL BRGA2 1 0.307360057758 1.055164651417
+ OBL BRGA3 1 0.302905564168 1.065072518094
+ OBL BRGR1 1 0.309141855195 0.939305670376
+ OBL IGR1 1 0.319832639812 1.074889062183
+ OBL PG0 1 0.316269044940 1.108562623941
+ OBL PG1 1 0.316269044940 1.108562623941
+ OBL PG2 1 0.316269044940 1.108562623941
+ OBL ALG1 1 0.302905564168 1.168527606863
+ OBL CC301 1 0.293996576986 0.144938011577
+ OBL CC3062 1 0.293996576986 0.144938011577
+ OBL CC311 1 0.293996576986 0.144938011577
+ OBL CC3161 1 0.293996576986 0.144938011577
+ OBL CC3162 1 0.293996576986 0.144938011577
+ OBL CC3163 1 0.293996576986 0.144938011577
+ OBL CC321 1 0.293996576986 0.144938011577
+ OBL CC3261 1 0.293996576986 0.144938011577
+ OBL CC3263 1 0.293996576986 0.144938011577
+ OBL CC331 1 0.293996576986 0.144938011577
+ OBL CC2O1 1 0.302905564168 0.480705002262
+ OBL CC2O2 1 0.302905564168 0.383469934154
+ OBL CC2O3 1 0.302905564168 0.434814034732
+ OBL CC2O4 1 0.285087589805 0.355024172698
+ OBL OC2D1 1 0.249451641079 0.502080000000
+ OBL OC2D2 1 0.276178602624 0.502080000000
+ OBL OC2D3 1 0.249451641079 0.502080000000
+ OBL OC2D4 1 0.249451641079 0.502080000000
+ OBL OC3C61 1 0.271724109033 0.458334236120
+ OBL OC311 1 0.281969444291 0.635251912639
+ OBL NC2D1 1 0.262815121851 0.648182492821
+ OBL HCP1 1 0.144726496762 0.310857403193
+ OBL HCA1 1 0.244106248770 0.307459952514
+ OBL HCA2 1 0.244106248770 0.271154190821
+ OBL HCA3 1 0.244106248770 0.224537002029
+ OBL CC312 1 0.293996576986 0.144938011577
+ OBL CC322 1 0.293996576986 0.144938011577
+ OBL HCR1 1 0.195997717991 0.310857403193
+ OBL HCA3M 1 0.244106248770 0.224537002029
+ OBL CC321C 1 0.293996576986 0.144938011577
+ OBL CC321D 1 0.293996576986 0.144938011577
+ OBL CC311C 1 0.293996576986 0.144938011577
+ OBL CC311D 1 0.293996576986 0.144938011577
+ OBL OC301 1 0.271724109033 0.458334236120
+ OBL OC302 1 0.271724109033 0.458334236120
+ OBL HCP1M 1 0.144726496762 0.310857403193
+ OBL OC311M 1 0.281969444291 0.635251912639
+ OBL OC3C5M 1 0.271724109033 0.458334236120
+ OBL CC322C 1 0.293996576986 0.144938011577
+ OBL HCA2C2 1 0.240542653898 0.271154190821
+ OBL CC312C 1 0.293996576986 0.144938011577
+ OBL HCA1C2 1 0.244106248770 0.307459952514
+ OBL OC3C51 1 0.271724109033 0.458334236120
+ OBL CC3152 1 0.293996576986 0.144938011577
+ OBL CC3051 1 0.293996576986 0.144938011577
+ OBL CC3251 1 0.293996576986 0.144938011577
+ OBL CC3151 1 0.293996576986 0.144938011577
+ OBL CC3153 1 0.293996576986 0.144938011577
+ OBL OC2DP 1 0.276178602624 0.502080000000
+ OBL OC312 1 0.282414893650 0.565258245152
+ OBL OC30P 1 0.282414893650 0.565258245152
+ OBL PC 1 0.316269044940 1.108562623941
+ OBL SC 1 0.311814551349 0.993644945843
+ OBL CC312D 1 0.293996576986 0.144938011577
+ OBL OC303 1 0.271724109033 0.458334236120
+ OBL HN1 1 0.144726496762 0.310857403193
+ OBL HN2 1 0.144726496762 0.310857403193
+ OBL HN3 1 0.222724679535 0.310857403193
+ OBL HN4 1 0.144726496762 0.310857403193
+ OBL HN5 1 0.144726496762 0.310857403193
+ OBL HN6 1 0.242324451334 0.214977812437
+ OBL HN7 1 0.242324451334 0.214977812437
+ OBL HN8 1 0.244106248770 0.242527681224
+ OBL HN9 1 0.244106248770 0.224537002029
+ OBL NN1 1 0.289542083396 0.648182492821
+ OBL NN2 1 0.289542083396 0.648182492821
+ OBL NN2B 1 0.289542083396 0.648182492821
+ OBL NN2G 1 0.289542083396 0.648182492821
+ OBL NN2U 1 0.289542083396 0.648182492821
+ OBL NN3 1 0.289542083396 0.648182492821
+ OBL NN3A 1 0.289542083396 0.648182492821
+ OBL NN3G 1 0.289542083396 0.648182492821
+ OBL NN4 1 0.289542083396 0.648182492821
+ OBL NN6 1 0.289542083396 0.648182492821
+ OBL ON1 1 0.276178602624 0.502080000000
+ OBL ON1C 1 0.276178602624 0.502080000000
+ OBL ON2 1 0.282414893650 0.565258245152
+ OBL ON3 1 0.276178602624 0.502080000000
+ OBL ON4 1 0.282414893650 0.565258245152
+ OBL ON5 1 0.282414893650 0.565258245152
+ OBL ON6 1 0.282414893650 0.565258245152
+ OBL ON6B 1 0.282414893650 0.565258245152
+ OBL CN1 1 0.293996576986 0.458334236120
+ OBL CN1T 1 0.293996576986 0.458334236120
+ OBL CN2 1 0.293996576986 0.458334236120
+ OBL CN3 1 0.293996576986 0.434814034732
+ OBL CN3T 1 0.293996576986 0.434814034732
+ OBL CN4 1 0.293996576986 0.396929091904
+ OBL CN5 1 0.293996576986 0.396929091904
+ OBL CN5G 1 0.293996576986 0.396929091904
+ OBL CN7 1 0.293996576986 0.144938011577
+ OBL CN7B 1 0.293996576986 0.144938011577
+ OBL CN8 1 0.293996576986 0.144938011577
+ OBL CN8B 1 0.293996576986 0.144938011577
+ OBL CN9 1 0.293996576986 0.144938011577
+ OBL P 1 0.316269044940 1.108562623941
+ OBL P2 1 0.316269044940 1.108562623941
+ OBL HOL 1 0.144726496762 0.310857403193
+ OBL HAL1 1 0.242324451334 0.214977812437
+ OBL HAL2 1 0.244106248770 0.242527681224
+ OBL HAL3 1 0.244106248770 0.224537002029
+ OBL HBL 1 0.242324451334 0.214977812437
+ OBL HCL 1 0.144726496762 0.310857403193
+ OBL HL 1 0.187088730809 0.310857403193
+ OBL HEL1 1 0.236088160307 0.255189702614
+ OBL HEL2 1 0.236979059025 0.233705521373
+ OBL CL 1 0.302905564168 0.383469934154
+ OBL CCL 1 0.302905564168 0.383469934154
+ OBL CTL1 1 0.293996576986 0.144938011577
+ OBL CTL2 1 0.293996576986 0.144938011577
+ OBL CTL3 1 0.293996576986 0.144938011577
+ OBL CTL5 1 0.293996576986 0.144938011577
+ OBL CEL1 1 0.310923652631 0.377952093472
+ OBL CEL2 1 0.310032753913 0.366667388896
+ OBL CRL1 1 0.293996576986 0.144938011577
+ OBL CRL2 1 0.293996576986 0.144938011577
+ OBL OBL 1 0.249451641079 0.502080000000
+ OBL OCL 1 0.276178602624 0.502080000000
+ OBL O2L 1 0.276178602624 0.502080000000
+ OBL OHL 1 0.282414893650 0.565258245152
+ OBL OSL 1 0.271724109033 0.458334236120
+ OBL OSLP 1 0.271724109033 0.458334236120
+ OBL NH3L 1 0.289542083396 0.648182492821
+ OBL NTL 1 0.289542083396 0.648182492821
+ OBL SL 1 0.311814551349 0.993644945843
+ OBL PL 1 0.316269044940 1.108562623941
+ OBL HCA1A 1 0.244106248770 0.307459952514
+ OBL HCA2A 1 0.244106248770 0.271154190821
+ OBL HCA3A 1 0.244106248770 0.224537002029
+ OBL CC30A 1 0.293996576986 0.144938011577
+ OBL CC31A 1 0.293996576986 0.144938011577
+ OBL CC32A 1 0.293996576986 0.144938011577
+ OBL CC33A 1 0.293996576986 0.144938011577
+ OBL CC326A 1 0.293996576986 0.144938011577
+ OBL HCA25A 1 0.240542653898 0.271154190821
+ OBL CC325A 1 0.293996576986 0.144938011577
+ OBL CC325B 1 0.293996576986 0.144938011577
+ OBL OC305A 1 0.271724109033 0.458334236120
+ OBL OC30A 1 0.271724109033 0.458334236120
+ OBL CPA 1 0.285087589805 0.434814034732
+ OBL CPB 1 0.285087589805 0.434814034732
+ OBL CPM 1 0.285087589805 0.434814034732
+ OBL CM 1 0.311814551349 0.480705002262
+ OBL CST 1 0.263973290185 0.349056954894
+ OBL NPH 1 0.289542083396 0.648182492821
+ OBL OM 1 0.276178602624 0.502080000000
+ OBL OST 1 0.275465883649 0.588740986173
+ OBL FE 1 0.182634237219 0.000000000000
+ OBL ON2B 1 0.282414893650 0.565258245152
+ OBL SP 1 0.320723538531 0.972273739232
+CC30A C 1 0.347450500075 0.138767581228
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+CC30A CPH1 1 0.329632525712 0.093557084179
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+CC30A CS 1 0.365268474438 0.138767581228
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+CC30A CY 1 0.346559601357 0.113045454929
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+CC30A H 1 0.189271432669 0.089736802707
+CC30A HA 1 0.286869387241 0.062058748940
+CC30A HB1 1 0.286869387241 0.062058748940
+CC30A HB2 1 0.288651184677 0.070011711020
+CC30A HE1 1 0.280633096214 0.073666921749
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+CC30A HC 1 0.189271432669 0.089736802707
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+CC30A HR1 1 0.249451641079 0.089736802707
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+CC30A HS 1 0.209361198763 0.132309697301
+CC30A HA1 1 0.288651184677 0.088756043175
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+CC30A N 1 0.334087019303 0.004184000000
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+CC30A NH1 1 0.307360057758 0.187114168357
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+CC30A NP 1 0.334087019303 0.187114168357
+CC30A NR1 1 0.334087019303 0.187114168357
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+CC30A CES 1 0.356359487256 0.182376331798
+CC30A BAR 1 0.337650614175 0.162045623205
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+CC30A CG1T1 1 0.333196120584 0.170981810495
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+CC30A CG25C1 1 0.355468588538 0.109105371453
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+CC30A CG251O 1 0.355468588538 0.109105371453
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+CC30A CG2N1 1 0.347450500075 0.138767581228
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+CC30A CG2RC0 1 0.334977918021 0.131646486622
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+CC30A CG334 1 0.338541512893 0.041840000000
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+CC30A CG3AM0 1 0.344777803920 0.110698234855
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+CC30A NG1T1 1 0.328741626994 0.177512086349
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+CC30A NG2O1 1 0.334087019303 0.187114168357
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+CC30A NG2R43 1 0.334087019303 0.187114168357
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+CC30A NG2R60 1 0.337650614175 0.102486650838
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+CC30A NG2R62 1 0.352795892384 0.093557084179
+CC30A NG2R67 1 0.334087019303 0.187114168357
+CC30A NG2RC0 1 0.334087019303 0.187114168357
+CC30A NG301 1 0.347450500075 0.078275472531
+CC30A NG311 1 0.347450500075 0.088756043175
+CC30A NG321 1 0.346559601357 0.102486650838
+CC30A NG331 1 0.345668702638 0.110698234855
+CC30A NG3C51 1 0.334087019303 0.187114168357
+CC30A NG3N1 1 0.351904993665 0.102486650838
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+CC30A NG3P1 1 0.334087019303 0.187114168357
+CC30A NG3P2 1 0.334087019303 0.187114168357
+CC30A NG3P3 1 0.334087019303 0.187114168357
+CC30A OG2D1 1 0.293996576986 0.144938011577
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+CC325B BAR 1 0.337650614175 0.162045623205
+CC325B ZN 1 0.266378716724 0.209200000000
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+CC325B CLA 1 0.371504765465 0.162045623205
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+CC325B NG2R62 1 0.352795892384 0.093557084179
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+CC325B OG3C61 1 0.316269044940 0.132309697301
+CC325B SG2D1 1 0.351904993665 0.314496560236
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+CC325B SG301 1 0.345223253279 0.257919081884
+CC325B SG302 1 0.365268474438 0.286840588481
+CC325B SG3O1 1 0.356359487256 0.286840588481
+CC325B SG3O2 1 0.347450500075 0.247528778125
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+CC325B FGA1 1 0.314487247504 0.153729976257
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+CC325B FGA3 1 0.311814551349 0.130309939452
+CC325B FGP1 1 0.311814551349 0.130309939452
+CC325B FGR1 1 0.320723538531 0.144938011577
+CC325B CLGA1 1 0.339432411611 0.245040988571
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+CC325B BRGA1 1 0.344777803920 0.289876023155
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+CC325B BRGR1 1 0.353686791102 0.271154190821
+CC325B IGR1 1 0.364377575719 0.310293744700
+CC325B PG0 1 0.360813980847 0.320014464673
+CC325B PG1 1 0.360813980847 0.320014464673
+CC325B PG2 1 0.360813980847 0.320014464673
+CC325B ALG1 1 0.347450500075 0.337324864189
+CC325B CC301 1 0.338541512893 0.041840000000
+CC325B CC3062 1 0.338541512893 0.041840000000
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+CC325B CC3161 1 0.338541512893 0.041840000000
+CC325B CC3162 1 0.338541512893 0.041840000000
+CC325B CC3163 1 0.338541512893 0.041840000000
+CC325B CC321 1 0.338541512893 0.041840000000
+CC325B CC3261 1 0.338541512893 0.041840000000
+CC325B CC3263 1 0.338541512893 0.041840000000
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+CC325B CC2O2 1 0.347450500075 0.110698234855
+CC325B CC2O3 1 0.347450500075 0.125520000000
+CC325B CC2O4 1 0.329632525712 0.102486650838
+CC325B OC2D1 1 0.293996576986 0.144938011577
+CC325B OC2D2 1 0.320723538531 0.144938011577
+CC325B OC2D3 1 0.293996576986 0.144938011577
+CC325B OC2D4 1 0.293996576986 0.144938011577
+CC325B OC3C61 1 0.316269044940 0.132309697301
+CC325B OC311 1 0.326514380198 0.183381431383
+CC325B NC2D1 1 0.307360057758 0.187114168357
+CC325B HCP1 1 0.189271432669 0.089736802707
+CC325B HCA1 1 0.288651184677 0.088756043175
+CC325B HCA2 1 0.288651184677 0.078275472531
+CC325B HCA3 1 0.288651184677 0.064818249282
+CC325B CC312 1 0.338541512893 0.041840000000
+CC325B CC322 1 0.338541512893 0.041840000000
+CC325B HCR1 1 0.240542653898 0.089736802707
+CC325B HCA3M 1 0.288651184677 0.064818249282
+CC325B CC321C 1 0.338541512893 0.041840000000
+CC325B CC321D 1 0.338541512893 0.041840000000
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+CC325B CC311D 1 0.338541512893 0.041840000000
+CC325B OC301 1 0.316269044940 0.132309697301
+CC325B OC302 1 0.316269044940 0.132309697301
+CC325B HCP1M 1 0.189271432669 0.089736802707
+CC325B OC311M 1 0.326514380198 0.183381431383
+CC325B OC3C5M 1 0.316269044940 0.132309697301
+CC325B CC322C 1 0.338541512893 0.041840000000
+CC325B HCA2C2 1 0.285087589805 0.078275472531
+CC325B CC312C 1 0.338541512893 0.041840000000
+CC325B HCA1C2 1 0.288651184677 0.088756043175
+CC325B OC3C51 1 0.316269044940 0.132309697301
+CC325B CC3152 1 0.338541512893 0.041840000000
+CC325B CC3051 1 0.338541512893 0.041840000000
+CC325B CC3251 1 0.338541512893 0.041840000000
+CC325B CC3151 1 0.338541512893 0.041840000000
+CC325B CC3153 1 0.338541512893 0.041840000000
+CC325B OC2DP 1 0.320723538531 0.144938011577
+CC325B OC312 1 0.326959829558 0.163176000000
+CC325B OC30P 1 0.326959829558 0.163176000000
+CC325B PC 1 0.360813980847 0.320014464673
+CC325B SC 1 0.356359487256 0.286840588481
+CC325B CC312D 1 0.338541512893 0.041840000000
+CC325B OC303 1 0.316269044940 0.132309697301
+CC325B HN1 1 0.189271432669 0.089736802707
+CC325B HN2 1 0.189271432669 0.089736802707
+CC325B HN3 1 0.267269615442 0.089736802707
+CC325B HN4 1 0.189271432669 0.089736802707
+CC325B HN5 1 0.189271432669 0.089736802707
+CC325B HN6 1 0.286869387241 0.062058748940
+CC325B HN7 1 0.286869387241 0.062058748940
+CC325B HN8 1 0.288651184677 0.070011711020
+CC325B HN9 1 0.288651184677 0.064818249282
+CC325B NN1 1 0.334087019303 0.187114168357
+CC325B NN2 1 0.334087019303 0.187114168357
+CC325B NN2B 1 0.334087019303 0.187114168357
+CC325B NN2G 1 0.334087019303 0.187114168357
+CC325B NN2U 1 0.334087019303 0.187114168357
+CC325B NN3 1 0.334087019303 0.187114168357
+CC325B NN3A 1 0.334087019303 0.187114168357
+CC325B NN3G 1 0.334087019303 0.187114168357
+CC325B NN4 1 0.334087019303 0.187114168357
+CC325B NN6 1 0.334087019303 0.187114168357
+CC325B ON1 1 0.320723538531 0.144938011577
+CC325B ON1C 1 0.320723538531 0.144938011577
+CC325B ON2 1 0.326959829558 0.163176000000
+CC325B ON3 1 0.320723538531 0.144938011577
+CC325B ON4 1 0.326959829558 0.163176000000
+CC325B ON5 1 0.326959829558 0.163176000000
+CC325B ON6 1 0.326959829558 0.163176000000
+CC325B ON6B 1 0.326959829558 0.163176000000
+CC325B CN1 1 0.338541512893 0.132309697301
+CC325B CN1T 1 0.338541512893 0.132309697301
+CC325B CN2 1 0.338541512893 0.132309697301
+CC325B CN3 1 0.338541512893 0.125520000000
+CC325B CN3T 1 0.338541512893 0.125520000000
+CC325B CN4 1 0.338541512893 0.114583559030
+CC325B CN5 1 0.338541512893 0.114583559030
+CC325B CN5G 1 0.338541512893 0.114583559030
+CC325B CN7 1 0.338541512893 0.041840000000
+CC325B CN7B 1 0.338541512893 0.041840000000
+CC325B CN8 1 0.338541512893 0.041840000000
+CC325B CN8B 1 0.338541512893 0.041840000000
+CC325B CN9 1 0.338541512893 0.041840000000
+CC325B P 1 0.360813980847 0.320014464673
+CC325B P2 1 0.360813980847 0.320014464673
+CC325B HOL 1 0.189271432669 0.089736802707
+CC325B HAL1 1 0.286869387241 0.062058748940
+CC325B HAL2 1 0.288651184677 0.070011711020
+CC325B HAL3 1 0.288651184677 0.064818249282
+CC325B HBL 1 0.286869387241 0.062058748940
+CC325B HCL 1 0.189271432669 0.089736802707
+CC325B HL 1 0.231633666716 0.089736802707
+CC325B HEL1 1 0.280633096214 0.073666921749
+CC325B HEL2 1 0.281523994932 0.067464972838
+CC325B CL 1 0.347450500075 0.110698234855
+CC325B CCL 1 0.347450500075 0.110698234855
+CC325B CTL1 1 0.338541512893 0.041840000000
+CC325B CTL2 1 0.338541512893 0.041840000000
+CC325B CTL3 1 0.338541512893 0.041840000000
+CC325B CTL5 1 0.338541512893 0.041840000000
+CC325B CEL1 1 0.355468588538 0.109105371453
+CC325B CEL2 1 0.354577689820 0.105847757841
+CC325B CRL1 1 0.338541512893 0.041840000000
+CC325B CRL2 1 0.338541512893 0.041840000000
+CC325B OBL 1 0.293996576986 0.144938011577
+CC325B OCL 1 0.320723538531 0.144938011577
+CC325B O2L 1 0.320723538531 0.144938011577
+CC325B OHL 1 0.326959829558 0.163176000000
+CC325B OSL 1 0.316269044940 0.132309697301
+CC325B OSLP 1 0.316269044940 0.132309697301
+CC325B NH3L 1 0.334087019303 0.187114168357
+CC325B NTL 1 0.334087019303 0.187114168357
+CC325B SL 1 0.356359487256 0.286840588481
+CC325B PL 1 0.360813980847 0.320014464673
+CC325B HCA1A 1 0.288651184677 0.088756043175
+CC325B HCA2A 1 0.288651184677 0.078275472531
+CC325B HCA3A 1 0.288651184677 0.064818249282
+CC325B CC30A 1 0.338541512893 0.041840000000
+CC325B CC31A 1 0.338541512893 0.041840000000
+CC325B CC32A 1 0.338541512893 0.041840000000
+CC325B CC33A 1 0.338541512893 0.041840000000
+CC325B CC326A 1 0.338541512893 0.041840000000
+CC325B HCA25A 1 0.285087589805 0.078275472531
+CC325B CC325A 1 0.338541512893 0.041840000000
+CC325B CC325B 1 0.338541512893 0.041840000000
+CC325B OC305A 1 0.316269044940 0.132309697301
+CC325B OC30A 1 0.316269044940 0.132309697301
+CC325B CPA 1 0.329632525712 0.125520000000
+CC325B CPB 1 0.329632525712 0.125520000000
+CC325B CPM 1 0.329632525712 0.125520000000
+CC325B CM 1 0.356359487256 0.138767581228
+CC325B CST 1 0.308518226092 0.100764063435
+CC325B NPH 1 0.334087019303 0.187114168357
+CC325B OM 1 0.320723538531 0.144938011577
+CC325B OST 1 0.320010819556 0.169954883425
+CC325B FE 1 0.227179173126 0.000000000000
+CC325B ON2B 1 0.326959829558 0.163176000000
+CC325B SP 1 0.365268474438 0.280671252536
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/forcefield.doc b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/forcefield.doc
new file mode 100644
index 0000000000000000000000000000000000000000..924151728ae49d4c7b5b31e549d679db112338e8
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/forcefield.doc
@@ -0,0 +1,152 @@
+
+
+CHARMM36 EEF1-SB all-atom force field (May 2015)
+
+*******************************************************************************
+* CHARMM36 port writted by *
+* E. Prabhu Raman, Justin A. Lemkul, Robert Best *
+* and Alexander D. MacKerell, Jr. *
+* CHARMM force field homepage: *
+* www.mackerell.umaryland.edu/CHARMM_ff_params.html *
+*******************************************************************************
+
+Parameters taken from CHARMM36 and CGenFF 3.0.1
+ Included are topologies from
+ top_all36_prot.rtf
+ top_all36_na.rtf
+ top_all36_lipid.rtf
+ top_all36_carb.rtf
+ top_all36_cgenff.rtf
+ top_all35_ethers.rtf
+ and corresponding prm files
+
+References:
+
+** Proteins
+
+Best, R. B. et al. Optimization of the Additive CHARMM All-Atom Protein
+Force Field Targeting Improved Sampling of the Backbone phi, psi and Side-Chain
+chi1 and chi2 Dihedral Angles, Journal of Chemical Theory and Computation,
+2012, 8: 3257-3273.
+
+MacKerell, Jr., A.D., Feig, M., Brooks, III, C.L. Extending the
+treatment of backbone energetics in protein force fields: limitations
+of gas-phase quantum mechanics in reproducing protein conformational
+distributions in molecular dynamics simulations, Journal of
+Computational Chemistry, 2004, 25: 1400-1415.
+
+MacKerell, Jr., A.D., et al. All-atom empirical potential for
+molecular modeling and dynamics Studies of proteins, Journal of
+Physical Chemistry B, 1998, 102, 3586-3616.
+
+! phosphotyrosine
+Feng, M.-H., Philippopoulos, M., MacKerell, Jr., A.D. and Lim, C.
+Structural Characterization of the Phosphotyrosine Binding Region of a
+High-Affinity aSH2 Domain-Phosphopeptide Complex by Molecular Dynamics
+Simulation and Chemical Shift Calculations. Journal of the American
+Chemical Society, 1996, 118: 11265-11277.
+
+** Lipids
+
+Klauda, J. B. et al. Improving the CHARMM Force Field for Polyunsaturated
+Fatty Acid Chains, Journal of Physical Chemistry B, 2012, 116: 9424-9431.
+
+Klauda, J. B. et al. Update of the CHARMM All-Atom Additive Force Field
+for Lipids: Validation on Six Lipid Types, Journal of Physical Chemistry B,
+2010, 114: 7830-7843.
+
+Feller, S. and MacKerell, Jr., A.D. An Improved Empirical Potential
+Energy Function for Molecular Simulations of Phospholipids, Journal
+of Physical Chemistry B, 2000, 104: 7510-7515.
+
+! cholesterol
+Lim, J.B., Rogaski, B. and Klauda, J.B.. "Update of the Cholesterol Force Field
+Parameters in CHARMM" 116: 203-210 (2012).
+
+! bacterial lipids
+Lim, J.B. & Klauda, J.B. Branching at the Iso- and Anteiso- Positions in Complex Chlamydia
+Membranes: A Molecular Dynamics Study. Biochimica et Biophysica Acta (BBA) - Biomembranes
+1808:323-331 (2011).
+
+Pandit, K.R. & Klauda, J.B. Membrane models of E. coli containing cyclic moieties in
+the aliphatic lipid chain. Biochimica et Biophysica Acta (BBA) - Biomembranes
+1818:1205-1210 (2012).
+
+** Nucleic Acids
+
+Denning, E.J., Priyakumar, U.D., Nilsson, L., and MacKerell Jr., A.D.,
+"Impact of 2'-hydroxyl sampling on the conformational properties of
+RNA: Update of the CHARMM all-atom additive force field for RNA,"
+JCC, 32: 1929-1943, 2011, PMC3082605
+
+Hart, K., Foloppe, N., Baker, C.M., Denning, E.J., Nilsson, L.
+and MacKerell Jr., A.D. "Optimization of the CHARMM additive force
+field for DNA: Improved treatment of the BI/BII conformational
+equilibrium," JCTC, 8:348-362, 2012, PMC3285246
+
+** Carbohydrates
+
+! pyranose monosaccharides
+Guvench, O., Greene, S.N., Kamath, G., Brady, J.W., Venable, R.M.,
+Pastor, R.W., MacKerell, Jr., A.D. "Additive empirical force field for
+hexopyranose monosaccharides," Journal of Computational Chemistry, 29:
+2543-2564, 2008. PMID: 18470966
+
+! linear sugars, sugar alcohols, and inositol
+Hatcher, E., Guvench, O., and MacKerell, Jr., A.D. "CHARMM Additive
+All-Atom Force Field for Acyclic Polyalcohols, Acyclic Carbohydrates
+and Inositol," Journal of Chemical Theory and Computation, 5:
+1315-1327, 2009, DOI: 10.1021/ct9000608.
+
+! hexopyranose glycosidic linkages
+Guvench, O., Hatcher, E. R., Venable, R. M., Pastor, R. W., MacKerell, Jr.,
+A. D. "Additive Empirical CHARMM Force Field for glycosyl linked
+hexopyranoses," Journal of Chemical Theory and Computation, 5,
+2353-2370, 2009, DOI: 10.1021/ct900242e
+
+! furanose monosaccharides
+Hatcher, E. R.; Guvench, O. and MacKerell, Jr., A.D.
+"CHARMM Additive All-Atom Force Field for Aldopentofuranose
+Carbohydrates and Fructofuranose." Journal of Physical Chemistry B.
+113:12466-76, 2009, PMID: 19694450
+
+! glycosidic linkages involving furanoses
+Raman, E. P., Guvench, O., MacKerell, Jr., A.D., "CHARMM Additive All-Atom
+Force Field for Glycosidic Linkages in Carbohydrates Involving Furanoses,"
+Journal of Physical Chemistry B, 114: 12981-12994, 2010, PMID: 20845956
+
+! carbohydrate derivatives and glycosidic linkages for glycoproteins
+Guvench, O., Mallajosyula, S.S. Raman, E.P., Hatcher, E. Vanommeslaeghe, K.,
+Foster, T.J., Jamison II, F.W., and MacKerell, Jr., A.D. "CHARMM additive
+all-atom force field for carbohydrate derivatives and their utility in
+polysaccharide and carbohydrate-protein modeling," JCTC, 7: 3162-3180, 2011.
+PMC3224046
+
+!O-glycan linkages
+Mallajosyula, S. S. and MacKerell, Jr., A.D., "Influence of Solvent and
+Intramolecular Hydrogen Bonding on the Conformational Properties of O-Linked
+Glycopeptides," Journal of Physical Chemistry B, 115: 11215-11229, 2011
+PMC3224046
+
+! Phosphates and sulfates
+Mallajosyula, S. S.; Guvench, O.; Hatcher, E. R. and MacKerell, Jr., A.D.,
+CHARMM Additive All-Atom Force Field for Phosphate and Sufate Linkages in
+carbohydrates" JCTC, 8: 759-776, 2012.
+
+** CHARMM General Force Field
+
+Vanommeslaeghe, K. et al. CHARMM General Force Field: A Force Field for Drug-Like
+Molecules Compatible with the CHARMM All-Atom Additive Biological Force Fields,
+Journal of Computational Chemistry, 2010, 31: 671-690.
+
+W. Yu, X. He, K. Vanommeslaeghe, A. D. MacKerell Jr. Extension of the CHARMM general force field to sulfonyl-containing compounds and its utility in biomolecular simulations, J. Comput. Chem. 2012, 33, 2451-2468.
+
+** Implementation of CHARMM in GROMACS
+
+Bjelkmar, P., Larsson, P., Cuendet, M. A, Bess, B., Lindahl, E.
+Implementation of the CHARMM force field in GROMACS: Analysis of protein
+stability effects from correction maps, virtual interaction sites, and
+water models, Journal of Chemical Theory and Computation, 2010, 6: 459-466.
+
+
+
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/forcefield.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/forcefield.itp
new file mode 100644
index 0000000000000000000000000000000000000000..14d7cd83e31eb3dadce2ad230c7fcd0bd1c06f5f
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/forcefield.itp
@@ -0,0 +1,17 @@
+; This force field generated by charmm2gmx.py from
+; multiple charmm parameter files
+; and multiple charmm topology files
+#define _FF_CHARMM
+
+; This gromacs version created from:
+; CHARMM parameters: multiple files
+; CHARMM topology: multiple files
+[ defaults ]
+; nbfunc comb-rule gen-pairs fudgeLJ fudgeQQ
+1 2 yes 1.0 1.0
+
+#include "ffnonbonded.itp"
+#include "ffbonded.itp"
+#include "gb.itp"
+#include "cmap.itp"
+#include "nbfix.itp"
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/gb.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/gb.itp
new file mode 100644
index 0000000000000000000000000000000000000000..dce806b5f14d8db6279f8fe73da75a04381ee56f
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/gb.itp
@@ -0,0 +1,49 @@
+
+[ implicit_genborn_params ]
+
+; Atom type sar st pi gbr hct
+ NH1 0.155 1 1.028 0.17063 0.79 ; N
+ N 0.155 1 1 0.155 0.79 ; Proline backbone N
+ NP 0.155 1 1 0.155 0.79 ; Proline backbone N for Proline N-terminus
+ H 0.1 1 1 0.115 0.85 ; H
+ CT1 0.180 1 1.276 0.190 0.72 ; C
+ HB1 0.1 1 1 0.125 0.85 ; H
+ CT3 0.200 1 0.880 0.190 0.72 ; C
+ HA 0.1 1 1 0.125 0.85 ; H
+ C 0.172 1 1.554 0.1875 0.72 ; C
+ O 0.150 1 0.926 0.148 0.85 ; O
+ CT2 0.190 1 1.045 0.190 0.72 ; C
+ NC2 0.160 1 1.215 0.17063 0.79 ; N
+ HC 0.1 1 1 0.115 0.85 ; H
+ CC 0.172 1 1.554 0.1875 0.72 ; C
+ CD 0.172 1 1.554 0.1875 0.72 ; carbonyl C (in COOH termini)
+ NH2 0.160 1 1.215 0.17063 0.79 ; N
+ OC 0.170 1 0.922 0.148 0.85 ; O
+ OB 0.170 1 0.922 0.148 0.85 ; carbonyl O (in COOH termini)
+ S 0.180 1 1.121 0.1775 0.96 ; S
+ SM 0.180 1 1.121 0.1775 0.96 ; disulfide sulfur
+ HS 0.1 1 1 0.125 0.85 ; H
+ NR1 0.155 1 1.028 0.17063 0.79 ; N
+ CPH1 0.172 1 1.554 0.1875 0.72 ; C
+ CPH2 0.180 1 1.073 0.1875 0.72 ; C
+ HR1 0.1 1 1 0.125 0.85 ; H
+ HR2 0.1 1 1 0.125 0.85 ; H
+ NR2 0.155 1 1.215 0.17063 0.79 ; N
+ HR3 0.1 1 1 0.115 0.85 ; H
+ NR3 0.155 1 1.215 0.17063 0.79 ; N
+ NH3 0.160 1 1.215 0.1625 0.79 ; N
+ HP 0.1 1 1 0.125 0.85 ; H
+ CP3 0.190 1 1.045 0.190 0.72 ; C
+ CP1 0.180 1 1.276 0.190 0.72 ; C
+ CP2 0.190 1 1.045 0.190 0.72 ; C
+ OH1 0.152 1 1.080 0.1535 0.85 ; O
+ CY 0.172 0.012 1.554 0.1875 0.72 ; C
+ CA 0.180 1 1.073 0.1875 0.72 ; C
+ HP 0.1 1 1 0.125 0.85 ; H
+ NY 0.155 1 1.028 0.17063 0.79 ; N
+ CPT 0.172 0.012 1.554 0.1875 0.72 ; C
+ MNH3 0 0 0 0 0 ; vsite (rigid tetrahedrical NH3 group)
+ MNH2 0 0 0 0 0 ; vsite
+ MCH3 0 0 0 0 0 ; vsite (rigid CH3 group)
+ MCH3S 0 0 0 0 0 ; vsite
+ MW 0 0 0 0 0 ; vsite
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/ions.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/ions.itp
new file mode 100644
index 0000000000000000000000000000000000000000..31996cee78035d58c3d93efd89f17700b1bf8723
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/ions.itp
@@ -0,0 +1,76 @@
+
+
+[ moleculetype ] ; added by Bjelkmar Jan 2010, from c32b1/toppar/stream/toppar_water_ions.str
+; molname nrexcl
+OH 1
+
+[ atoms ]
+; id at type res nr residu name at name cg nr charge mass
+1 OC 1 OH O1 1 -1.32
+2 H 1 OH H1 1 0.32
+
+[ bonds ]
+;i j funct length force.c.
+1 2 1 0.09700 456056 ; hydroxyl bond
+
+[ moleculetype ]
+; molname nrexcl
+NA 1
+
+[ atoms ]
+; id at type res nr residu name at name cg nr charge
+1 SOD 1 NA NA 1 1
+
+[ moleculetype ]
+; molname nrexcl
+MG 1
+
+[ atoms ]
+; id at type res nr residu name at name cg nr charge
+#ifdef MG_ALLNER
+; Use parameters from Allner et al. (DOI: 10.1021/ct3000734)
+1 MGA 1 MG MG 1 2
+#else
+; Standard CHARMM27 parameters
+1 MG 1 MG MG 1 2
+#endif
+
+[ moleculetype ]
+; molname nrexcl
+K 1
+
+[ atoms ]
+; id at type res nr residu name at name cg nr charge
+1 POT 1 K K 1 1
+
+[ moleculetype ]
+; molname nrexcl
+Ces 1
+
+[ atoms ]
+; id at type res nr residu name at name cg nr charge
+1 CES 1 Ces Ces 1 1
+
+[ moleculetype ]
+; molname nrexcl
+Cal 1
+
+[ atoms ]
+; id at type res nr residu name at name cg nr charge
+1 CAL 1 Cal Cal 1 2
+
+[ moleculetype ]
+; molname nrexcl
+CL 1
+
+[ atoms ]
+; id at type res nr residu name at name cg nr charge
+1 CLA 1 CL CL 1 -1
+
+[ moleculetype ]
+; molname nrexcl
+ZN 1
+
+[ atoms ]
+; id at type res nr residu name at name cg nr charge
+1 ZN 1 ZN ZN 1 2
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.arn b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.arn
new file mode 100644
index 0000000000000000000000000000000000000000..03fa15c7af46073a44d07cc2b691807d13dd6dd0
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.arn
@@ -0,0 +1,6 @@
+
+
+; atom renaming specification
+; residue gromacs forcefield
+ * H HN
+
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.c.tdb b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.c.tdb
new file mode 100644
index 0000000000000000000000000000000000000000..fa9441d5cc654790e93f853592d126101411d11f
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.c.tdb
@@ -0,0 +1,59 @@
+
+[ None ]
+
+; CHARMM CTER
+[ COO- ]
+[ replace ]
+ C C CC 12.011 1.00
+ O OT1 OC 15.9994 -0.50
+ OXT OT2 OC 15.9994 -0.50
+[ add ]
+ 2 8 OT C CA N
+ OC 15.9994 -0.50 -1
+[ impropers ]
+ C CA OT2 OT1
+
+; CHARMM CNEU
+[ COOH ]
+[ replace ]
+ C C CD 12.011 0.72
+ O OT1 OB 15.9994 -0.55
+ OXT OT2 OH1 15.9994 -0.61
+[ add ]
+ 2 8 OT C CA N
+ OB 15.9994 -0.55 -1
+ 1 2 HT2 OT2 C CA
+ H 1.008 0.44 -1
+[ replace ]
+ OT2 OT2 OH1 15.9994 -0.61
+[ impropers ]
+ C CA OT2 OT1
+
+; Created by Michel Cuendet.
+[ CT2 ]
+[ replace ]
+ C CC 12.011 0.55
+ O O 15.9994 -0.55
+[ add ]
+ 1 2 NT C CA N
+ NH2 14.0027 -0.62 -1
+ 2 3 HT NT C CA
+ H 1.008 0.00 -1
+[ replace ]
+ HT1 H 1.008 0.30 ; this one is trans to O
+ HT2 H 1.008 0.32 ; this one is cis to O
+[ impropers ]
+ C NT CA O
+ C CA NT O
+ NT C HT1 HT2
+ NT C HT2 HT1
+
+
+; added by Justin Lemkul
+[ 3TER ]
+[ replace ]
+ O3' ON5 15.9994 -0.66
+ C3' CN7 12.011 0.14
+[ add ]
+ 1 2 H3T O3' C3' C4'
+ HN5 1.008 0.43 -1
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.hdb b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.hdb
new file mode 100644
index 0000000000000000000000000000000000000000..7ea01a2a85990241b8996ccf1053288ee4327d49
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.hdb
@@ -0,0 +1,360 @@
+ACE 1
+3 4 HH3 CH3 C O
+ADE 10
+1 6 H5' C5' O5' C4'
+1 6 H5'' C5' C4' O5'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N9 C2'
+1 1 H8 C8 N9 N7
+2 3 H6 N6 C6 C5
+1 1 H2 C2 N1 N3
+1 5 H3' C3' C4' C2' O3'
+1 6 H2'' C2' C1' C3'
+1 2 H2' O2' C2' C1'
+AIB 3
+1 1 HN N -C CA
+3 4 HB1 CB1 CA N
+3 4 HB2 CB2 CA N
+ALA 3
+1 1 HN N -C CA
+1 5 HA CA N C CB
+3 4 HB CB CA N
+ARG 8
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+2 6 HG CG CD CB
+2 6 HD CD NE CG
+1 1 HE NE CD CZ
+2 3 HH1 NH1 CZ NE
+2 3 HH2 NH2 CZ NE
+ARGN 8
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+2 6 HG CG CD CB
+2 6 HD CD NE CG
+1 1 HE NE CD CZ
+1 2 HH1 NH1 CZ NE
+2 3 HH2 NH2 CZ NE
+ASN 4
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+2 3 HD2 ND2 CG CB
+ASP 3
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+ASPP 4
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+1 2 HD2 OD2 CG CB
+CYS2 3
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB SG CA
+CYS 4
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB SG CA
+1 2 HG1 SG CB CA
+CYT 10
+1 6 H5' C5' O5' C4'
+1 6 H5'' C5' C4' O5'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N1 C2'
+1 1 H6 C6 N1 C5
+1 1 H5 C5 C6 C4
+2 3 H4 N4 C4 C5
+1 5 H3' C3' C4' C2' O3'
+1 6 H2'' C2' C1' C3'
+1 1 H2' O2' C2' C1'
+DA 10
+1 6 H5' C5' O5' C4'
+1 6 H5'' C5' C4' O5'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N9 C2'
+1 1 H8 C8 N9 N7
+2 3 H6 N6 C6 C5
+1 1 H2 C2 N1 N3
+1 5 H3' C3' C4' C2' O3'
+1 6 H2' C2' C1' C3'
+1 6 H2'' C2' C3' C1'
+DT 10
+1 6 H5' C5' O5' C4'
+1 6 H5'' C5' C4' O5'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N1 C2'
+1 1 H6 C6 N1 C5
+3 4 H5 C5M C5 C6
+1 1 H3 N3 C4 C2
+1 5 H3' C3' C4' C2' O3'
+1 6 H2' C2' C1' C3'
+1 6 H2'' C2' C3' C1'
+DG 10
+1 6 H5' C5' O5' C4'
+1 6 H5'' C5' C4' O5'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N9 C2'
+1 1 H8 C8 N9 N7
+1 1 H1 N1 C6 C2
+2 3 H2 N2 C2 N1
+1 5 H3' C3' C4' C2' O3'
+1 6 H2' C2' C1' C3'
+1 6 H2'' C2' C3' C1'
+DC 10
+1 6 H5' C5' O5' C4'
+1 6 H5'' C5' C4' O5'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N1 C2'
+1 1 H6 C6 N1 C5
+1 1 H5 C5 C6 C4
+2 3 H4 N4 C4 C5
+1 5 H3' C3' C4' C2' O3'
+1 6 H2' C2' C1' C3'
+1 6 H2'' C2' C3' C1'
+GLN 5
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+2 6 HG CG CD CB
+2 3 HE2 NE2 CD CG
+GLU 4
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+2 6 HG CG CD CB
+GLUP 5
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+2 6 HG CG CD CB
+1 2 HE2 OE2 CD CG
+GLY 2
+1 1 HN N -C CA
+2 6 HA CA C N
+GUA 10
+1 6 H5' C5' O5' C4'
+1 6 H5'' C5' C4' O5'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N9 C2'
+1 1 H8 C8 N9 N7
+1 1 H1 N1 C6 C2
+2 3 H2 N2 C2 N1
+1 5 H3' C3' C4' C2' O3'
+1 6 H2'' C2' C1' C3'
+1 2 H2' O2' C2' C1'
+HIS1 6
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+1 1 HD2 CD2 CG NE2
+1 1 HE1 CE1 ND1 NE2
+1 1 HD1 ND1 CG CE1
+HSD 6
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+1 1 HD2 CD2 CG NE2
+1 1 HE1 CE1 ND1 NE2
+1 1 HD1 ND1 CG CE1
+HSE 6
+1 1 HN N -C CA
+2 6 HB CB CG CA
+1 5 HA CA N C CB
+1 1 HE2 NE2 CE1 CD2
+1 1 HD2 CD2 CG NE2
+1 1 HE1 CE1 ND1 NE2
+HSP 7
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+1 1 HD2 CD2 CG NE2
+1 1 HE1 CE1 ND1 NE2
+1 1 HD1 ND1 CG CE1
+1 1 HE2 NE2 CE1 CD2
+HO4 1
+3 10 HW OW
+HO5 1
+4 11 HW OW
+HOH 1
+2 7 HW OW
+ILE 6
+1 1 HN N -C CA
+1 5 HA CA N C CB
+1 5 HB CB CA CG1 CG2
+2 6 HG1 CG1 CD CB
+3 4 HG2 CG2 CB CA
+3 4 HD CD CG1 CB
+LEU 6
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+1 5 HG CG CB CD1 CD2
+3 4 HD1 CD1 CG CB
+3 4 HD2 CD2 CG CB
+LSN 7
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+2 6 HG CG CD CB
+2 6 HD CD CE CG
+2 6 HE CE NZ CD
+2 4 HZ NZ CE CD
+LYS 7
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+2 6 HG CG CD CB
+2 6 HD CD CE CG
+2 6 HE CE NZ CD
+3 4 HZ NZ CE CD
+MET 5
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+2 6 HG CG SD CB
+3 4 HE CE SD CG
+NMA 2
+1 1 HN N -C CH3
+3 4 HH3 CH3 N -C
+PHE 8
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+1 1 HD1 CD1 CG CE1
+1 1 HD2 CD2 CG CE2
+1 1 HE1 CE1 CD1 CZ
+1 1 HE2 CE2 CD2 CZ
+1 1 HZ CZ CE1 CE2
+PRO 4
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+2 6 HG CG CD CB
+2 6 HD CD N CG
+RA 9
+2 6 H5' C5' O5' C4'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N9 C2'
+1 1 H8 C8 N9 N7
+2 3 H6 N6 C6 C5
+1 1 H2 C2 N1 N3
+1 5 H3' C3' C4' C2' O3'
+1 5 H2'' C2' C1' C3' O2'
+1 2 H2' O2' C2' C1'
+RU 9
+2 6 H5' C5' O5' C4'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N1 C2'
+1 1 H6 C6 N1 C5
+1 1 H5 C5 C6 C4
+1 1 H3 N3 C4 C2
+1 5 H3' C3' C4' C2' O3'
+1 5 H2'' C2' C1' C3' O2'
+1 2 H2' O2' C2' C1'
+RG 9
+2 6 H5' C5' O5' C4'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N9 C2'
+1 1 H8 C8 N9 N7
+1 1 H1 N1 C6 C2
+2 3 H2 N2 C2 N1
+1 5 H3' C3' C4' C2' O3'
+1 5 H2'' C2' C1' C3' O2'
+1 2 H2' O2' C2' C1'
+RC 9
+2 6 H5' C5' O5' C4'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N1 C2'
+1 1 H6 C6 N1 C5
+1 1 H5 C5 C6 C4
+2 3 H4 N4 C4 C5
+1 5 H3' C3' C4' C2' O3'
+1 5 H2'' C2' C1' C3' O2'
+1 2 H2' O2' C2' C1'
+SER 4
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB OG CA
+1 2 HG1 OG CB CA
+SP1 4
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB OG CA
+1 2 HT OT P OG
+SP2 3
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB OG CA
+THP1 5
+1 1 HN N -C CA
+1 5 HA CA N C CB
+1 5 HB CB CA OG1 CG2
+1 2 HT OT P OG1
+3 4 HG2 CG2 CB CA
+THP2 4
+1 1 HN N -C CA
+1 5 HA CA N C CB
+1 5 HB CB CA OG1 CG2
+3 4 HG2 CG2 CB CA
+THR 5
+1 1 HN N -C CA
+1 5 HA CA N C CB
+1 5 HB CB CA OG1 CG2
+1 2 HG1 OG1 CB CA
+3 4 HG2 CG2 CB CA
+TP1 8
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+1 1 HD1 CD1 CG CE1
+1 1 HD2 CD2 CG CE2
+1 1 HE1 CE1 CD1 CZ
+1 1 HE2 CE2 CD2 CZ
+1 2 H2 O2 P1 OH
+TP2 7
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+1 1 HD1 CD1 CG CE1
+1 1 HD2 CD2 CG CE2
+1 1 HE1 CE1 CD1 CZ
+1 1 HE2 CE2 CD2 CZ
+TRP 9
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+1 1 HD1 CD1 NE1 CG
+1 1 HE1 NE1 CD1 CE2
+1 1 HE3 CE3 CD2 CZ3
+1 1 HZ3 CZ3 CE3 CH2
+1 1 HH2 CH2 CZ3 CZ2
+1 1 HZ2 CZ2 CE2 CH2
+TYR 8
+1 1 HN N -C CA
+1 5 HA CA N C CB
+2 6 HB CB CG CA
+1 1 HD1 CD1 CG CE1
+1 1 HD2 CD2 CG CE2
+1 1 HE1 CE1 CD1 CZ
+1 1 HE2 CE2 CD2 CZ
+1 2 HH OH CZ CE1
+URA 10
+1 6 H5' C5' O5' C4'
+1 6 H5'' C5' C4' O5'
+1 5 H4' C4' C5' O4' C3'
+1 5 H1' C1' O4' N1 C2'
+1 1 H6 C6 N1 C5
+1 1 H5 C5 C6 C4
+1 1 H3 N3 C4 C2
+1 5 H3' C3' C4' C2' O3'
+1 6 H2'' C2' C1' C3'
+1 2 H2' O2' C2' C1'
+VAL 5
+1 1 HN N -C CA
+1 5 HA CA N C CB
+1 5 HB CB CA CG1 CG2
+3 4 HG1 CG1 CB CA
+3 4 HG2 CG2 CB CA
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.n.tdb b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.n.tdb
new file mode 100644
index 0000000000000000000000000000000000000000..c82dfa906fbff2ea0850c8968a781c983807bf3e
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.n.tdb
@@ -0,0 +1,82 @@
+
+[ None ]
+
+[ GLY-NH3+ ]
+[ replace ]
+ N N NH3 14.0070 -0.90
+ CA CA CT2 12.011 0.20
+ HA HA HB2 1.008 0.10
+ HA HA HB2 1.008 0.10
+[ Add ]
+ 3 4 H N CA C
+ HC 1.008 0.20 -1
+[ delete ]
+ HN
+
+[ NH3+ ]
+[ replace ]
+ N N NH3 14.0070 -0.90
+ CA CA CT1 12.011 0.20
+ HA HA HB1 1.008 0.10
+[ Add ]
+ 3 4 H N CA C
+ HC 1.008 0.20 -1
+[ delete ]
+ HN
+
+[ PRO-NH2+ ]
+[ replace ]
+ N N NP 14.0070 -0.90
+ CA CA CP1 12.011 0.20
+ CD CD CP3 12.011 0.16
+[ add ]
+ 2 4 HN N CA C
+ HC 1.008 0.24 -1
+
+; Created by Michel Cuendet
+[ NH2 ]
+[ replace ]
+ N NH2 14.0070 -0.90
+ CA CT1 12.011 0.20
+ HA HB1 1.008 0.10
+[ add ]
+ 2 4 HT N CA C
+ H 1.008 0.34 -1
+[ delete ]
+ HN
+
+
+; Created by Bjelkmar
+[ GLY-NH2 ]
+[ replace ]
+ N NH2 14.0070 -0.90
+ CA CT2 12.011 0.20
+[ add ]
+ 2 4 HT N CA C
+ H 1.008 0.34 -1
+[ delete ]
+ HN
+
+
+; Created by Bjelkmar
+[ PRO-NH ]
+[ replace ]
+ N NP 14.0070 -0.90
+ CA CP1 12.011 -0.20
+ CD CP3 12.011 -0.10
+[ add ]
+ 1 4 H N CA C
+ HC 1.008 0.31 -1
+
+; added by Justin Lemkul
+[ 5TER ]
+[ replace ]
+ O5' ON5 15.9994 -0.66
+ C5' CN8B 12.011 0.05
+[ add ]
+ 1 2 H5T O5' C5' C4'
+ HN5 1.008 0.43 -1
+[ delete ]
+ P
+ O1P
+ O2P
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.r2b b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.r2b
new file mode 100644
index 0000000000000000000000000000000000000000..e20577dee29ddfcd4e6997c14a9c01ae5bee1fa3
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.r2b
@@ -0,0 +1,16 @@
+
+
+; rtp residue to rtp building block table
+;GMX Force-field
+HISD HSD
+HIS1 HSD
+HISE HSE
+HISH HSP
+LYSN LSN
+ASPH ASPP
+GLUH GLUP
+RA ADE
+RG GUA
+RU URA
+RC CYT
+
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.rtp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.rtp
new file mode 100644
index 0000000000000000000000000000000000000000..731e4f1756c68a9fa2d8de640296f9be67616970
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.rtp
@@ -0,0 +1,39826 @@
+; This force field generated by charmm2gmx.py from
+; multiple charmm parameter files
+; and multiple charmm topology files
+
+[ bondedtypes ]
+; Col 1: Type of bond
+; Col 2: Type of angles
+; Col 3: Type of proper dihedrals
+; Col 4: Type of improper dihedrals
+; Col 5: Generate all dihedrals if 1, only heavy atoms of 0.
+; Col 6: Number of excluded neighbors for nonbonded interactions
+; Col 7: Generate 1,4 interactions between pairs of hydrogens if 1
+; Col 8: Remove propers over the same bond as an improper if it is 1
+; bonds angles dihedrals impropers all_dihedrals nrexcl HH14 RemoveDih
+ 1 5 9 2 1 3 1 0
+
+[ 11BPO ]
+ [ atoms ]
+ C2 CG2R51 -0.040 0
+ H2 HGR52 0.140 1
+ N1 NG2R57 0.000 2
+ C5 CG2R51 -0.040 3
+ H5 HGR52 0.140 4
+ C4 CG2R51 -0.250 5
+ H4 HGR51 0.150 6
+ C3 CG2R51 -0.250 7
+ H3 HGR51 0.150 8
+ C8 CG2R51 -0.250 9
+ H8 HGR51 0.150 10
+ C7 CG2R51 -0.040 11
+ H7 HGR52 0.140 12
+ N6 NG2R57 0.000 13
+ C10 CG2R51 -0.040 14
+ H10 HGR52 0.140 15
+ C9 CG2R51 -0.250 16
+ H9 HGR51 0.150 17
+ [ bonds ]
+ C2 H2
+ C2 N1
+ C2 C3
+ N1 C5
+ N1 N6
+ C5 H5
+ C5 C4
+ C4 H4
+ C4 C3
+ C3 H3
+ C8 H8
+ C8 C7
+ C8 C9
+ C7 H7
+ C7 N6
+ N6 C10
+ C10 H10
+ C10 C9
+ C9 H9
+
+[ 13BPO ]
+ [ atoms ]
+ N1 NG2R57 -0.350 0
+ C2 CG2R51 -0.040 1
+ H2 HGR52 0.140 2
+ C3 CG2R51 -0.250 3
+ H3 HGR51 0.150 4
+ C4 CG2R51 -0.250 5
+ H4 HGR51 0.150 6
+ C5 CG2R51 -0.040 7
+ H5 HGR52 0.140 8
+ N6 NG2R51 -0.350 9
+ H6 HGP1 0.350 10
+ C7 CG2R51 -0.040 11
+ H7 HGR52 0.140 12
+ C8 CG2R57 0.250 13
+ C9 CG2R51 -0.250 14
+ H9 HGR51 0.150 15
+ C10 CG2R51 -0.040 16
+ H10 HGR52 0.140 17
+ [ bonds ]
+ N1 C5
+ N1 C2
+ N1 C8
+ C2 C3
+ C2 H2
+ C3 C4
+ C3 H3
+ C4 C5
+ C4 H4
+ C5 H5
+ N6 C10
+ N6 C7
+ N6 H6
+ C7 C8
+ C7 H7
+ C8 C9
+ C9 C10
+ C9 H9
+ C10 H10
+
+[ 13DB ]
+ [ atoms ]
+ C1 CG2DC3 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2DC2 -0.150 3
+ H21 HGA4 0.150 4
+ C3 CG2DC1 -0.150 5
+ H31 HGA4 0.150 6
+ C4 CG2DC3 -0.420 7
+ H41 HGA5 0.210 8
+ H42 HGA5 0.210 9
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C1 H11
+ C1 H12
+ C2 H21
+ C3 H31
+ C4 H41
+ C4 H42
+
+[ 13DP ]
+ [ atoms ]
+ C1 CG2DC3 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2DC2 -0.150 3
+ H21 HGA4 0.150 4
+ C3 CG2DC1 -0.150 5
+ H31 HGA4 0.150 6
+ C4 CG2DC1 -0.150 7
+ H41 HGA4 0.150 8
+ C5 CG331 -0.270 9
+ H51 HGA3 0.090 10
+ H52 HGA3 0.090 11
+ H53 HGA3 0.090 12
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C1 H11
+ C1 H12
+ C2 H21
+ C3 H31
+ C4 H41
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ 14MN ]
+ [ atoms ]
+ C1 CG2R61 0.000 0
+ C2 CG2R61 -0.115 1
+ H2 HGR61 0.115 2
+ C3 CG2R61 -0.115 3
+ H3 HGR61 0.115 4
+ C4 CG2R61 0.000 5
+ C5 CG2R61 0.000 6
+ C6 CG2R61 -0.115 7
+ H6 HGR61 0.115 8
+ C7 CG2R61 -0.115 9
+ H7 HGR61 0.115 10
+ C8 CG2R61 -0.115 11
+ H8 HGR61 0.115 12
+ C9 CG2R61 -0.115 13
+ H9 HGR61 0.115 14
+ C10 CG2R61 0.000 15
+ C11 CG331 -0.270 16
+ H111 HGA3 0.090 17
+ H112 HGA3 0.090 18
+ H113 HGA3 0.090 19
+ C41 CG331 -0.270 20
+ H411 HGA3 0.090 21
+ H412 HGA3 0.090 22
+ H413 HGA3 0.090 23
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C5 C10
+ C1 C10
+ C1 C11
+ C2 H2
+ C3 H3
+ C4 C41
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+ C11 H111
+ C11 H112
+ C11 H113
+ C41 H411
+ C41 H412
+ C41 H413
+
+[ 18NFD ]
+ [ atoms ]
+ N1 NG2R62 -0.660 0
+ C2 CG2R61 0.330 1
+ H2 HGR62 0.090 2
+ C3 CG2R61 -0.115 3
+ H3 HGR61 0.115 4
+ C4 CG2R61 -0.115 5
+ H4 HGR61 0.115 6
+ C5 CG2R61 0.000 7
+ C6 CG2R61 -0.115 8
+ H6 HGR61 0.115 9
+ C7 CG2R61 -0.115 10
+ H7 HGR61 0.115 11
+ C8 CG2R61 0.330 12
+ H8 HGR62 0.090 13
+ N9 NG2R62 -0.660 14
+ C10 CG2R64 0.480 15
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 N9
+ N9 C10
+ C5 C10
+ N1 C10
+ C2 H2
+ C3 H3
+ C4 H4
+ C6 H6
+ C7 H7
+ C8 H8
+
+[ 1BOX ]
+ [ atoms ]
+ O1 OG3C31 -0.400 0
+ C1 CG3C31 0.020 1
+ H11 HGA2 0.090 2
+ H12 HGA2 0.090 3
+ C2 CG3C31 0.110 4
+ H2 HGA1 0.090 5
+ C3 CG321 -0.180 6
+ H31 HGA2 0.090 7
+ H32 HGA2 0.090 8
+ C4 CG331 -0.270 9
+ H41 HGA3 0.090 10
+ H42 HGA3 0.090 11
+ H43 HGA3 0.090 12
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C2 H2
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C4 H43
+ C1 O1
+ C2 O1
+ C1 C2
+ C2 C3
+ C3 C4
+
+[ 1EOX ]
+ [ atoms ]
+ O1 OG3C31 -0.400 0
+ C1 CG3C31 0.020 1
+ H1 HGA2 0.090 2
+ H2 HGA2 0.090 3
+ C2 CG3C31 0.020 4
+ H3 HGA2 0.090 5
+ H4 HGA2 0.090 6
+ [ bonds ]
+ C1 H1
+ C1 H2
+ C2 H3
+ C2 H4
+ C1 O1
+ C2 O1
+ C1 C2
+
+[ 1MTH ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ N1 NG2R61 -0.340 4
+ C6 CG2R62 0.170 5
+ H6 HGR62 0.170 6
+ C2 CG2R63 0.510 7
+ O2 OG2D4 -0.410 8
+ N3 NG2R61 -0.460 9
+ H3 HGP1 0.360 10
+ C4 CG2R63 0.500 11
+ O4 OG2D4 -0.450 12
+ C5 CG2R62 -0.150 13
+ C5M CG331 -0.110 14
+ H51 HGA3 0.070 15
+ H52 HGA3 0.070 16
+ H53 HGA3 0.070 17
+ [ bonds ]
+ C1 N1
+ C1 H11
+ C1 H12
+ C1 H13
+ N1 C2
+ N1 C6
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 C5
+ C6 H6
+ C5 C5M
+ C5M H51
+ C5M H52
+ C5M H53
+ C2 O2
+ C4 O4
+ C5 C6
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ 1PH2PO ]
+ [ atoms ]
+ N1 NG2R67 -0.130 0
+ C2 CG2R63 0.160 1
+ O2 OG2D4 -0.480 2
+ C3 CG2R62 -0.260 3
+ H3 HGR62 0.220 4
+ C4 CG2R62 -0.220 5
+ H4 HGR62 0.220 6
+ C5 CG2R62 -0.220 7
+ H5 HGR62 0.150 8
+ C6 CG2R62 0.150 9
+ H6 HGR62 0.130 10
+ C7 CG2R67 0.280 11
+ C8 CG2R61 -0.115 12
+ C9 CG2R61 -0.115 13
+ C10 CG2R61 -0.115 14
+ C11 CG2R61 -0.115 15
+ C12 CG2R61 -0.115 16
+ H8 HGR61 0.115 17
+ H9 HGR61 0.115 18
+ H10 HGR61 0.115 19
+ H11 HGR61 0.115 20
+ H12 HGR61 0.115 21
+ [ bonds ]
+ C2 N1
+ C2 O2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 N1
+ N1 C7
+ C7 C8
+ C7 C12
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C10 H10
+ C10 C11
+ C11 H11
+ C11 C12
+ C12 H12
+ [ impropers ]
+ C2 C3 N1 O2
+
+[ 1PH4PO ]
+ [ atoms ]
+ O4 OG2D4 -0.570 0
+ C4 CG2R63 0.460 1
+ C3 CG2R62 -0.380 2
+ C2 CG2R62 -0.070 3
+ N1 NG2R67 -0.110 4
+ C6 CG2R62 -0.070 5
+ C5 CG2R62 -0.380 6
+ H3 HGR62 0.220 7
+ H5 HGR62 0.220 8
+ H6 HGR62 0.200 9
+ H2 HGR62 0.200 10
+ C7 CG2R67 0.280 11
+ C8 CG2R61 -0.115 12
+ C9 CG2R61 -0.115 13
+ C10 CG2R61 -0.115 14
+ C11 CG2R61 -0.115 15
+ C12 CG2R61 -0.115 16
+ H8 HGR61 0.115 17
+ H9 HGR61 0.115 18
+ H10 HGR61 0.115 19
+ H11 HGR61 0.115 20
+ H12 HGR61 0.115 21
+ [ bonds ]
+ O4 C4
+ C4 C3
+ C4 C5
+ C3 C2
+ C3 H3
+ C5 H5
+ C2 N1
+ C2 H2
+ C5 C6
+ C6 H6
+ C6 N1
+ N1 C7
+ C7 C8
+ C7 C12
+ C12 C11
+ C12 H12
+ C8 C9
+ C8 H8
+ C11 C10
+ C11 H11
+ C9 C10
+ C9 H9
+ C10 H10
+ [ impropers ]
+ C4 C3 C5 O4
+
+[ 21QU ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ C2 CG2R61 -0.115 1
+ C3 CG2R61 -0.115 2
+ C4 CG2R62 0.280 3
+ C5 CG2R62 -0.090 4
+ C6 CG2R61 -0.115 5
+ H11 HGP1 0.300 6
+ C8 CG2R62 -0.200 7
+ C9 CG2R62 -0.180 8
+ C10 CG2R63 0.240 9
+ N11 NG2R61 -0.260 10
+ H6 HGR61 0.115 11
+ H1 HGR61 0.115 12
+ H2 HGR61 0.115 13
+ H3 HGR61 0.115 14
+ H8 HGR62 0.220 15
+ H9 HGR62 0.180 16
+ O10 OG2D4 -0.490 17
+ [ bonds ]
+ O10 C10
+ N11 C10
+ N11 H11
+ N11 C4
+ C10 C9
+ H3 C3
+ H2 C2
+ C4 C3
+ C4 C5
+ C3 C2
+ C2 C1
+ H9 C9
+ C9 C8
+ C1 H1
+ C1 C6
+ C5 C8
+ C5 C6
+ C8 H8
+ C6 H6
+ [ impropers ]
+ C10 C9 N11 O10
+
+[ 22BPY ]
+ [ atoms ]
+ N1 NG2R60 -0.600 0
+ C2 CG2R67 0.300 1
+ C3 CG2R61 -0.115 2
+ H3 HGR61 0.115 3
+ C4 CG2R61 -0.115 4
+ H4 HGR61 0.115 5
+ C5 CG2R61 -0.115 6
+ H5 HGR61 0.115 7
+ C6 CG2R61 0.180 8
+ H6 HGR62 0.120 9
+ N7 NG2R60 -0.600 10
+ C8 CG2R67 0.300 11
+ C9 CG2R61 -0.115 12
+ H9 HGR61 0.115 13
+ C10 CG2R61 -0.115 14
+ H10 HGR61 0.115 15
+ C11 CG2R61 -0.115 16
+ H11 HGR61 0.115 17
+ C12 CG2R61 0.180 18
+ H12 HGR62 0.120 19
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 N1
+ C3 H3
+ C4 H4
+ C5 H5
+ C6 H6
+ C2 C8
+ N7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 N7
+ C9 H9
+ C10 H10
+ C11 H11
+ C12 H12
+
+[ 23MN ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ H1 HGR61 0.115 1
+ C2 CG2R61 0.000 2
+ C3 CG2R61 0.000 3
+ C4 CG2R61 -0.115 4
+ H4 HGR61 0.115 5
+ C5 CG2R61 0.000 6
+ C6 CG2R61 -0.115 7
+ H6 HGR61 0.115 8
+ C7 CG2R61 -0.115 9
+ H7 HGR61 0.115 10
+ C8 CG2R61 -0.115 11
+ H8 HGR61 0.115 12
+ C9 CG2R61 -0.115 13
+ H9 HGR61 0.115 14
+ C10 CG2R61 0.000 15
+ C21 CG331 -0.270 16
+ H211 HGA3 0.090 17
+ H212 HGA3 0.090 18
+ H213 HGA3 0.090 19
+ C31 CG331 -0.270 20
+ H311 HGA3 0.090 21
+ H312 HGA3 0.090 22
+ H313 HGA3 0.090 23
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C5 C10
+ C1 C10
+ C1 H1
+ C2 C21
+ C3 C31
+ C4 H4
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+ C21 H211
+ C21 H212
+ C21 H213
+ C31 H311
+ C31 H312
+ C31 H313
+
+[ 2AMF ]
+ [ atoms ]
+ CM CG331 -0.270 0
+ HM1 HGA3 0.090 1
+ HM2 HGA3 0.090 2
+ HM3 HGA3 0.090 3
+ C CG2O1 0.520 4
+ O OG2D1 -0.520 5
+ N NG2S1 -0.470 6
+ H HGP1 0.330 7
+ CZ CG2R61 0.140 8
+ CD1 CG2R61 0.110 9
+ OD OG311 -0.530 10
+ HOD HGP1 0.420 11
+ CE1 CG2R61 -0.115 12
+ HE1 HGR61 0.115 13
+ CP CG2R61 -0.115 14
+ HP HGR61 0.115 15
+ CE2 CG2R61 -0.115 16
+ HE2 HGR61 0.115 17
+ CD2 CG2R61 -0.115 18
+ HD2 HGR61 0.115 19
+ [ bonds ]
+ CM HM1
+ CM HM2
+ CM HM3
+ CM C
+ C O
+ C N
+ N H
+ N CZ
+ CZ CD1
+ CD1 OD
+ OD HOD
+ CD1 CE1
+ CE1 HE1
+ CE1 CP
+ CP HP
+ CP CE2
+ CE2 HE2
+ CE2 CD2
+ CD2 HD2
+ CD2 CZ
+ [ impropers ]
+ C CM N O
+
+[ 2AMP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R64 0.600 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CE2 CG2R61 0.180 4
+ HE2 HGR62 0.120 5
+ CD2 CG2R61 -0.115 6
+ HD2 HGR61 0.115 7
+ CG CG2R61 -0.115 8
+ HG HGR61 0.115 9
+ NE NG2S1 -0.620 10
+ HE HGP1 0.320 11
+ C CG2O1 0.550 12
+ O OG2D1 -0.550 13
+ CM CG331 -0.270 14
+ HM1 HGA3 0.090 15
+ HM2 HGA3 0.090 16
+ HM3 HGA3 0.090 17
+ [ bonds ]
+ CG HG
+ CG CD1
+ CD1 HD1
+ CD1 CE1
+ CE1 NZ
+ NZ CE2
+ CE2 HE2
+ CE2 CD2
+ CD2 HD2
+ CD2 CG
+ CE1 NE
+ NE HE
+ NE C
+ C O
+ C CM
+ CM HM1
+ CM HM2
+ CM HM3
+ [ impropers ]
+ C CM NE O
+ CE1 CD1 NZ NE
+
+[ 2BOH ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ O2 OG311 -0.650 4
+ HO2 HGP1 0.420 5
+ C2 CG311 0.140 6
+ H2 HGA1 0.090 7
+ C3 CG321 -0.180 8
+ H31 HGA2 0.090 9
+ H32 HGA2 0.090 10
+ C4 CG331 -0.270 11
+ H41 HGA3 0.090 12
+ H42 HGA3 0.090 13
+ H43 HGA3 0.090 14
+ [ bonds ]
+ C1 C2
+ C1 H11
+ C1 H12
+ C1 H13
+ O2 HO2
+ O2 C2
+ C2 H2
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ 2BTY ]
+ [ atoms ]
+ C1 CG331 -0.190 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG1T1 -0.080 4
+ C3 CG1T1 -0.080 5
+ C4 CG331 -0.190 6
+ H41 HGA3 0.090 7
+ H42 HGA3 0.090 8
+ H43 HGA3 0.090 9
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C1 H11
+ C1 H12
+ C1 H13
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ 2DHF ]
+ [ atoms ]
+ O1 OG3C51 -0.330 0
+ C2 CG2R51 -0.060 1
+ H2 HGR52 0.200 2
+ C3 CG2R51 -0.410 3
+ H3 HGR51 0.240 4
+ C4 CG3C52 -0.080 5
+ H41 HGA2 0.090 6
+ H42 HGA2 0.090 7
+ C5 CG3C52 0.080 8
+ H51 HGA2 0.090 9
+ H52 HGA2 0.090 10
+ [ bonds ]
+ O1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 O1
+ C2 H2
+ C3 H3
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+
+[ 2HPP ]
+ [ atoms ]
+ N1 NG2R52 -0.270 0
+ H1 HGP2 0.390 1
+ C2 CG3C54 -0.190 2
+ H21 HGA2 0.280 3
+ H22 HGA2 0.280 4
+ C3 CG2R51 -0.080 5
+ H3 HGR51 0.250 6
+ C4 CG2R51 -0.270 7
+ H4 HGR51 0.250 8
+ C5 CG2R52 0.070 9
+ H5 HGR52 0.290 10
+ [ bonds ]
+ N1 H1
+ C2 H21
+ C2 H22
+ C3 H3
+ C4 H4
+ C5 H5
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 N1
+
+[ 2HPR ]
+ [ atoms ]
+ N1 NG2R50 -0.720 0
+ C2 CG3C52 0.450 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG2R51 -0.750 4
+ H3 HGR51 0.330 5
+ C4 CG2R51 0.050 6
+ H4 HGR51 0.150 7
+ C5 CG2R52 0.200 8
+ H5 HGR52 0.110 9
+ [ bonds ]
+ C2 H21
+ C2 H22
+ C3 H3
+ C4 H4
+ C5 H5
+ N1 C2
+ C2 C3
+ C4 C5
+ C3 C4
+ C5 N1
+
+[ 2IMI ]
+ [ atoms ]
+ N1 NG3C51 -0.680 0
+ H1 HGP1 0.320 1
+ C2 CG2R53 0.610 2
+ H2 HGR52 0.060 3
+ N3 NG2R50 -0.790 4
+ C4 CG3C52 0.120 5
+ H41 HGA2 0.090 6
+ H42 HGA2 0.090 7
+ C5 CG3C52 0.000 8
+ H51 HGA2 0.090 9
+ H52 HGA2 0.090 10
+ [ bonds ]
+ N1 H1
+ C2 H2
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ N1 C2
+ N3 C4
+ C4 C5
+ C5 N1
+ C2 N3
+
+[ 2IMP ]
+ [ atoms ]
+ N1 NG2R52 -0.350 0
+ H1 HGP2 0.380 1
+ C2 CG2R53 0.520 2
+ H2 HGR53 0.120 3
+ N3 NG2R52 -0.350 4
+ H3 HGP2 0.380 5
+ C4 CG3C54 -0.410 6
+ H41 HGA2 0.280 7
+ H42 HGA2 0.280 8
+ C5 CG3C54 -0.410 9
+ H51 HGA2 0.280 10
+ H52 HGA2 0.280 11
+ [ bonds ]
+ N1 H1
+ C2 H2
+ N3 H3
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ N1 C2
+ N3 C4
+ C4 C5
+ C5 N1
+ C2 N3
+
+[ 2MPA ]
+ [ atoms ]
+ CG1 CG314 0.290 0
+ HG1 HGA1 0.090 1
+ NG2 NG3P2 -0.400 2
+ HG21 HGP2 0.320 3
+ HG22 HGP2 0.320 4
+ CG3 CG324 0.200 5
+ HG31 HGA2 0.090 6
+ HG32 HGA2 0.090 7
+ CG4 CG321 -0.180 8
+ HG41 HGA2 0.090 9
+ HG42 HGA2 0.090 10
+ CG5 CG321 -0.180 11
+ HG51 HGA2 0.090 12
+ HG52 HGA2 0.090 13
+ CG6 CG321 -0.180 14
+ HG61 HGA2 0.090 15
+ HG62 HGA2 0.090 16
+ CM CG331 -0.270 17
+ HM1 HGA3 0.090 18
+ HM2 HGA3 0.090 19
+ HM3 HGA3 0.090 20
+ CG CG2O1 0.510 21
+ OG OG2D1 -0.510 22
+ NT NG2S1 -0.470 23
+ HT HGP1 0.470 24
+ CGT CG321 -0.180 25
+ HGT1 HGA2 0.090 26
+ HGT2 HGA2 0.090 27
+ [ bonds ]
+ CM HM1
+ CM HM2
+ CM HM3
+ CM CG
+ CG OG
+ CG NT
+ NT HT
+ NT CGT
+ CGT HGT1
+ CGT HGT2
+ CGT CG1
+ CG1 HG1
+ CG1 NG2
+ NG2 HG21
+ NG2 HG22
+ NG2 CG3
+ CG3 HG31
+ CG3 HG32
+ CG3 CG4
+ CG4 HG41
+ CG4 HG42
+ CG4 CG5
+ CG5 HG51
+ CG5 HG52
+ CG5 CG6
+ CG6 HG61
+ CG6 HG62
+ CG6 CG1
+ [ impropers ]
+ CG CM NT OG
+
+[ 2PDO ]
+ [ atoms ]
+ N1 NG2R53 -0.580 0
+ H1 HGP1 0.360 1
+ C2 CG2R53 0.300 2
+ O2 OG2D1 -0.490 3
+ C3 CG3C52 -0.010 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ C4 CG3C52 -0.190 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG3C52 0.070 10
+ H51 HGA2 0.090 11
+ H52 HGA2 0.090 12
+ [ bonds ]
+ N1 H1
+ C2 O2
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 N1
+ [ impropers ]
+ C2 C3 N1 O2
+
+[ 2PRL ]
+ [ atoms ]
+ N1 NG3C51 -0.600 0
+ H1 HGP1 0.320 1
+ C2 CG2R51 -0.010 2
+ H2 HGR52 0.170 3
+ C3 CG2R51 -0.360 4
+ H3 HGR51 0.200 5
+ C4 CG3C52 -0.100 6
+ H41 HGA2 0.090 7
+ H42 HGA2 0.090 8
+ C5 CG3C52 0.020 9
+ H51 HGA2 0.090 10
+ H52 HGA2 0.090 11
+ [ bonds ]
+ N1 H1
+ C2 H2
+ C3 H3
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ N1 C2
+ C3 C4
+ C4 C5
+ C5 N1
+ C2 C3
+
+[ 2PRP ]
+ [ atoms ]
+ N1 NG3P2 -0.130 0
+ H11 HGP2 0.330 1
+ H12 HGP2 0.330 2
+ C2 CG2R51 -0.180 3
+ H2 HGR52 0.220 4
+ C3 CG2R51 -0.060 5
+ H3 HGR51 0.200 6
+ C4 CG3C52 -0.120 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG3C54 -0.330 10
+ H51 HGA2 0.280 11
+ H52 HGA2 0.280 12
+ [ bonds ]
+ N1 H11
+ N1 H12
+ C2 H2
+ C3 H3
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ N1 C2
+ C3 C4
+ C4 C5
+ C5 N1
+ C2 C3
+
+[ 2PRZ ]
+ [ atoms ]
+ N1 NG3C51 -0.460 0
+ H1 HGP1 0.340 1
+ N2 NG2R50 -0.490 2
+ C3 CG2R52 0.320 3
+ H3 HGR52 0.060 4
+ C4 CG3C52 -0.150 5
+ H41 HGA2 0.090 6
+ H42 HGA2 0.090 7
+ C5 CG3C52 0.020 8
+ H51 HGA2 0.090 9
+ H52 HGA2 0.090 10
+ [ bonds ]
+ N1 H1
+ C3 H3
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ N1 N2
+ C3 C4
+ C4 C5
+ C5 N1
+ N2 C3
+
+[ 2PYO ]
+ [ atoms ]
+ N1 NG2R61 -0.130 0
+ H1 HGP1 0.280 1
+ C2 CG2R63 0.160 2
+ O2 OG2D4 -0.480 3
+ C3 CG2R62 -0.260 4
+ H3 HGR62 0.220 5
+ C4 CG2R62 -0.220 6
+ H4 HGR62 0.220 7
+ C5 CG2R62 -0.220 8
+ H5 HGR62 0.150 9
+ C6 CG2R62 0.150 10
+ H6 HGR62 0.130 11
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C4 C5
+ C6 N1
+ N1 H1
+ C3 H3
+ C4 H4
+ C5 H5
+ C6 H6
+ C2 O2
+ C3 C4
+ C5 C6
+ [ impropers ]
+ C2 C3 N1 O2
+
+[ 2SMPYR ]
+ [ atoms ]
+ N1 NG2R62 -0.730 0
+ C2 CG2R64 0.640 1
+ N3 NG2R62 -0.730 2
+ C4 CG2R61 0.290 3
+ C5 CG2R61 -0.115 4
+ C6 CG2R61 0.290 5
+ H4 HGR62 0.120 6
+ H5 HGR61 0.115 7
+ H6 HGR62 0.120 8
+ S7 SG311 -0.070 9
+ C8 CG331 -0.200 10
+ H81 HGA3 0.090 11
+ H82 HGA3 0.090 12
+ H83 HGA3 0.090 13
+ [ bonds ]
+ N1 C2
+ N1 C6
+ C2 S7
+ C2 N3
+ N3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ S7 C8
+ C8 H81
+ C8 H82
+ C8 H83
+
+[ 33BPO ]
+ [ atoms ]
+ C5 CG2R51 -0.040 0
+ H5 HGR52 0.140 1
+ C4 CG2R57 -0.100 2
+ C3 CG2R51 -0.250 3
+ H3 HGR51 0.150 4
+ C2 CG2R51 -0.040 5
+ H2 HGR52 0.140 6
+ N1 NG2R51 -0.350 7
+ H1 HGP1 0.350 8
+ C10 CG2R51 -0.040 9
+ H10 HGR52 0.140 10
+ C9 CG2R51 -0.250 11
+ H9 HGR51 0.150 12
+ C8 CG2R57 -0.100 13
+ C7 CG2R51 -0.040 14
+ H7 HGR52 0.140 15
+ N6 NG2R51 -0.350 16
+ H6 HGP1 0.350 17
+ [ bonds ]
+ C5 H5
+ C5 C4
+ C5 N1
+ C4 C3
+ C4 C8
+ C3 H3
+ C3 C2
+ C2 H2
+ C2 N1
+ N1 H1
+ C10 H10
+ C10 C9
+ C10 N6
+ C9 H9
+ C9 C8
+ C8 C7
+ C7 H7
+ C7 N6
+ N6 H6
+
+[ 34AP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 0.120 2
+ CG CG2R61 0.070 3
+ CE2 CG2R61 0.180 4
+ CD2 CG2R61 -0.115 5
+ ND1 NG2S3 -0.850 6
+ NG NG2S3 -0.850 7
+ HE1 HGR62 0.120 8
+ HD2 HGR61 0.115 9
+ HE2 HGR62 0.120 10
+ HD11 HGP4 0.350 11
+ HD12 HGP4 0.380 12
+ HG11 HGP4 0.390 13
+ HG12 HGP4 0.390 14
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 ND1
+ ND1 HD11
+ ND1 HD12
+ CG NG
+ NG HG11
+ NG HG12
+ [ impropers ]
+ ND1 HD12 HD11 CD1
+ NG HG12 HG11 CG
+
+[ 34MP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 0.000 2
+ CG CG2R61 0.000 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HD2 HGR61 0.115 7
+ HE2 HGR62 0.120 8
+ C3 CG331 -0.270 9
+ H31 HGA3 0.090 10
+ H32 HGA3 0.090 11
+ H33 HGA3 0.090 12
+ C2 CG331 -0.270 13
+ H21 HGA3 0.090 14
+ H22 HGA3 0.090 15
+ H23 HGA3 0.090 16
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG C2
+ CD1 C3
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ 3ACP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 0.070 2
+ CG CG2R61 -0.115 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ C CG2O5 0.360 10
+ O OG2D3 -0.470 11
+ CH3 CG331 -0.230 12
+ HC1 HGA3 0.090 13
+ HC2 HGA3 0.090 14
+ HC3 HGA3 0.090 15
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 C
+ C CH3
+ HC1 CH3
+ HC2 CH3
+ HC3 CH3
+ C O
+ [ impropers ]
+ C CD1 CH3 O
+
+[ 3ALP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 0.090 2
+ CG CG2R61 -0.115 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ CD3 CG2O4 0.240 10
+ O1 OG2D1 -0.410 11
+ H3 HGR52 0.080 12
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 CD3
+ CD3 H3
+ CD3 O1
+ [ impropers ]
+ CD3 CD1 O1 H3
+
+[ 3AMP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ HE1 HGR62 0.120 2
+ CE2 CG2R61 0.180 3
+ HE2 HGR62 0.120 4
+ CD1 CG2R61 0.300 5
+ CD2 CG2R61 -0.115 6
+ HD2 HGR61 0.115 7
+ CG CG2R61 -0.115 8
+ HG HGR61 0.115 9
+ ND NG2S1 -0.620 10
+ HD HGP1 0.320 11
+ C CG2O1 0.550 12
+ O OG2D1 -0.550 13
+ CM CG331 -0.270 14
+ HM1 HGA3 0.090 15
+ HM2 HGA3 0.090 16
+ HM3 HGA3 0.090 17
+ [ bonds ]
+ CG HG
+ CG CD1
+ CD1 CE1
+ CE1 HE1
+ CE1 NZ
+ NZ CE2
+ CE2 HE2
+ CE2 CD2
+ CD2 HD2
+ CD2 CG
+ CD1 ND
+ ND HD
+ ND C
+ C O
+ C CM
+ CM HM1
+ CM HM2
+ CM HM3
+ [ impropers ]
+ C CM ND O
+
+[ 3APY ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 0.090 2
+ ND1 NG2S3 -0.840 3
+ HD11 HGP4 0.370 4
+ HD12 HGP4 0.380 5
+ CD2 CG2R61 -0.115 6
+ HD2 HGR61 0.115 7
+ CE1 CG2R61 0.180 8
+ HE1 HGR62 0.120 9
+ CE2 CG2R61 0.180 10
+ HE2 HGR62 0.120 11
+ NZ NG2R60 -0.600 12
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 ND1
+ ND1 HD11
+ ND1 HD12
+ [ impropers ]
+ ND1 HD12 HD11 CD1
+
+[ 3BNP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 0.000 2
+ CG CG2R61 -0.115 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ C CG321 -0.180 10
+ HC1 HGA2 0.090 11
+ HC2 HGA2 0.090 12
+ CA1 CG2R61 0.000 13
+ CA2 CG2R61 -0.115 14
+ CA3 CG2R61 -0.115 15
+ CA4 CG2R61 -0.115 16
+ CA5 CG2R61 -0.115 17
+ CA6 CG2R61 -0.115 18
+ HA2 HGR61 0.115 19
+ HA3 HGR61 0.115 20
+ HA4 HGR61 0.115 21
+ HA5 HGR61 0.115 22
+ HA6 HGR61 0.115 23
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 C
+ C CA1
+ C HC1
+ C HC2
+ CA1 CA2
+ CA2 CA3
+ CA3 CA4
+ CA4 CA5
+ CA6 CA5
+ CA6 CA1
+ CA2 HA2
+ CA3 HA3
+ CA4 HA4
+ CA5 HA5
+ CA6 HA6
+
+[ 3BPY ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 0.000 2
+ CG CG2R61 -0.115 3
+ CE2 CG2R61 0.180 4
+ CD2 CG2R61 -0.115 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ CD3 CG321 -0.180 10
+ H11 HGA2 0.090 11
+ H12 HGA2 0.090 12
+ C2 CG321 -0.180 13
+ H21 HGA2 0.090 14
+ H22 HGA2 0.090 15
+ C3 CG321 -0.180 16
+ H31 HGA2 0.090 17
+ H32 HGA2 0.090 18
+ C4 CG331 -0.270 19
+ H41 HGA3 0.090 20
+ H42 HGA3 0.090 21
+ H43 HGA3 0.090 22
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 CD3
+ CD3 H11
+ CD3 H12
+ CD3 C2
+ C2 C3
+ C3 C4
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ 3CAP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 0.000 2
+ CG CG2R61 -0.115 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ CD3 CG321 0.050 10
+ H11 HGA2 0.090 11
+ H12 HGA2 0.090 12
+ OH OG311 -0.650 13
+ HO HGP1 0.420 14
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 CD3
+ CD3 OH
+ OH HO
+ CD3 H11
+ CD3 H12
+
+[ 3CB ]
+ [ atoms ]
+ CZ CG2R61 -0.115 0
+ CE1 CG2R61 -0.115 1
+ CD1 CG2R61 -0.100 2
+ CG CG2R61 -0.115 3
+ CE2 CG2R61 -0.115 4
+ CD2 CG2R61 -0.115 5
+ HE1 HGR61 0.115 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR61 0.115 9
+ HZ HGR61 0.115 10
+ CD3 CG2O3 0.620 11
+ O1 OG2D2 -0.760 12
+ O2 OG2D2 -0.760 13
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 CD3
+ CD3 O1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ HZ
+ CD3 O2
+ [ impropers ]
+ CD3 O2 O1 CD1
+
+[ 3CPY ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 -0.100 2
+ CG CG2R61 -0.155 3
+ CE2 CG2R61 0.180 4
+ CD2 CG2R61 -0.115 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.155 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ CD3 CG2O3 0.620 10
+ O1 OG2D2 -0.760 11
+ O2 OG2D2 -0.760 12
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 CD3
+ CD3 O1
+ CD3 O2
+ [ impropers ]
+ CD3 O2 O1 CD1
+
+[ 3CYP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 0.100 2
+ CG CG2R61 -0.115 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ C3N CG1N1 0.360 10
+ N3C NG1T1 -0.460 11
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 C3N
+ C3N N3C
+
+[ 3ETP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 0.000 2
+ CG CG2R61 -0.115 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ CD3 CG321 -0.180 10
+ H11 HGA2 0.090 11
+ H12 HGA2 0.090 12
+ C2 CG331 -0.270 13
+ H21 HGA3 0.090 14
+ H22 HGA3 0.090 15
+ H23 HGA3 0.090 16
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD1 CD3
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD3 H11
+ CD3 H12
+ CD3 C2
+ H21 C2
+ H22 C2
+ H23 C2
+
+[ 3FLP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.220 1
+ CD1 CG2R66 0.170 2
+ CG CG2R61 -0.115 3
+ CE2 CG2R61 0.180 4
+ CD2 CG2R61 -0.115 5
+ HE1 HGR62 0.120 6
+ F1 FGR1 -0.210 7
+ HG HGR62 0.115 8
+ HD2 HGR61 0.115 9
+ HE2 HGR62 0.120 10
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD1 F1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+
+[ 3HIN ]
+ [ atoms ]
+ N1 NG2R50 -0.610 0
+ C2 CG2R52 0.180 1
+ H2 HGR52 0.110 2
+ C3 CG3C52 -0.090 3
+ H31 HGA2 0.090 4
+ H32 HGA2 0.090 5
+ C4 CG2RC0 0.250 6
+ C5 CG2R61 -0.360 7
+ H5 HGR61 0.200 8
+ C6 CG2R61 -0.220 9
+ H6 HGR61 0.210 10
+ C7 CG2R61 -0.210 11
+ H7 HGR61 0.210 12
+ C8 CG2R61 -0.340 13
+ H8 HGR61 0.260 14
+ C9 CG2RC0 0.230 15
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 N1
+ C4 C9
+ C2 H2
+ C3 H31
+ C3 H32
+ C5 H5
+ C6 H6
+ C7 H7
+ C8 H8
+
+[ 3HOP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CG CG2R61 -0.115 2
+ CD2 CG2R61 -0.115 3
+ CE2 CG2R61 0.180 4
+ HE1 HGR62 0.120 5
+ HG HGR61 0.115 6
+ HD2 HGR61 0.115 7
+ HE2 HGR62 0.120 8
+ CD1 CG2R61 0.110 9
+ OH OG311 -0.530 10
+ HO1 HGP1 0.420 11
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD1 OH
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ OH HO1
+
+[ 3HPR ]
+ [ atoms ]
+ N1 NG2R50 -0.600 0
+ C2 CG2R52 0.100 1
+ H2 HGR52 0.130 2
+ C3 CG3C52 0.050 3
+ H31 HGA2 0.090 4
+ H32 HGA2 0.090 5
+ C4 CG2R51 -0.300 6
+ H4 HGR51 0.180 7
+ C5 CG2R51 0.120 8
+ H5 HGR52 0.140 9
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 N1
+ C2 H2
+ C3 H31
+ C3 H32
+ C4 H4
+ C5 H5
+
+[ 3MEP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 0.000 2
+ CG CG2R61 -0.115 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ CD3 CG331 -0.270 10
+ H31 HGA3 0.090 11
+ H32 HGA3 0.090 12
+ H33 HGA3 0.090 13
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD1 CD3
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD3 H31
+ CD3 H32
+ CD3 H33
+
+[ 3NAP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 -0.020 2
+ CG CG2R61 -0.115 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ C CG2O1 0.630 10
+ O OG2D1 -0.460 11
+ N NG2S2 -0.900 12
+ HC HGP1 0.390 13
+ HT HGP1 0.360 14
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 C
+ C N
+ HC N
+ HT N
+ C O
+ [ impropers ]
+ C CD1 N O
+
+[ 3PH24S ]
+ [ atoms ]
+ N1 NG2R67 -0.170 0
+ C2 CG2R63 0.040 1
+ S2 SG2D1 -0.260 2
+ C3 CG2R61 -0.170 3
+ H3 HGR62 0.190 4
+ C4 CG2R61 -0.060 5
+ H4 HGR62 0.260 6
+ N5 NG2R61 -0.120 7
+ H5 HGP1 0.330 8
+ C6 CG2R63 -0.130 9
+ S6 SG2D1 -0.230 10
+ C7 CG2R67 0.320 11
+ C8 CG2R61 -0.115 12
+ C9 CG2R61 -0.115 13
+ C10 CG2R61 -0.115 14
+ C11 CG2R61 -0.115 15
+ C12 CG2R61 -0.115 16
+ H8 HGR61 0.115 17
+ H9 HGR61 0.115 18
+ H10 HGR61 0.115 19
+ H11 HGR61 0.115 20
+ H12 HGR61 0.115 21
+ [ bonds ]
+ C2 N1
+ C2 S2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 N5
+ N5 H5
+ N5 C6
+ C6 S6
+ C6 N1
+ N1 C7
+ C7 C8
+ C7 C12
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C10 H10
+ C10 C11
+ C11 H11
+ C11 C12
+ C12 H12
+ [ impropers ]
+ C2 C3 N1 S2
+ C6 N5 N1 S6
+
+[ 3PH2SR ]
+ [ atoms ]
+ N1 NG2R67 -0.380 0
+ C2 CG2R63 0.520 1
+ O2 OG2D4 -0.490 2
+ C3 CG2R62 -0.240 3
+ H3 HGR62 0.170 4
+ C4 CG2R62 0.080 5
+ H4 HGR62 0.200 6
+ N5 NG2R61 -0.220 7
+ H5 HGP1 0.330 8
+ C6 CG2R63 -0.040 9
+ S6 SG2D1 -0.300 10
+ C7 CG2R67 0.370 11
+ C8 CG2R61 -0.115 12
+ C9 CG2R61 -0.115 13
+ C10 CG2R61 -0.115 14
+ C11 CG2R61 -0.115 15
+ C12 CG2R61 -0.115 16
+ H8 HGR61 0.115 17
+ H9 HGR61 0.115 18
+ H10 HGR61 0.115 19
+ H11 HGR61 0.115 20
+ H12 HGR61 0.115 21
+ [ bonds ]
+ C2 N1
+ C2 O2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 N5
+ N5 H5
+ N5 C6
+ C6 S6
+ C6 N1
+ N1 C7
+ C7 C8
+ C7 C12
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C10 H10
+ C10 C11
+ C11 H11
+ C11 C12
+ C12 H12
+ [ impropers ]
+ C2 C3 N1 O2
+ C6 N5 N1 S6
+
+[ 3PH4SR ]
+ [ atoms ]
+ N1 NG2R67 -0.350 0
+ C2 CG2R63 0.110 1
+ S2 SG2D1 -0.280 2
+ C3 CG2R62 -0.310 3
+ H3 HGR62 0.200 4
+ C4 CG2R62 0.040 5
+ H4 HGR62 0.230 6
+ N5 NG2R61 -0.300 7
+ H5 HGP1 0.350 8
+ C6 CG2R63 0.410 9
+ O6 OG2D4 -0.440 10
+ C7 CG2R67 0.340 11
+ C8 CG2R61 -0.115 12
+ C9 CG2R61 -0.115 13
+ C10 CG2R61 -0.115 14
+ C11 CG2R61 -0.115 15
+ C12 CG2R61 -0.115 16
+ H8 HGR61 0.115 17
+ H9 HGR61 0.115 18
+ H10 HGR61 0.115 19
+ H11 HGR61 0.115 20
+ H12 HGR61 0.115 21
+ [ bonds ]
+ C2 N1
+ C2 S2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 N5
+ N5 H5
+ N5 C6
+ C6 O6
+ C6 N1
+ N1 C7
+ C7 C8
+ C7 C12
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C10 H10
+ C10 C11
+ C11 H11
+ C11 C12
+ C12 H12
+ [ impropers ]
+ C2 C3 N1 S2
+ C6 N5 N1 O6
+
+[ 3PHP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R67 0.000 2
+ CG CG2R61 -0.115 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HG HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ CA1 CG2R67 0.000 10
+ CA2 CG2R61 -0.115 11
+ CA3 CG2R61 -0.115 12
+ CA4 CG2R61 -0.115 13
+ CA5 CG2R61 -0.115 14
+ CA6 CG2R61 -0.115 15
+ HA2 HGR61 0.115 16
+ HA3 HGR61 0.115 17
+ HA4 HGR61 0.115 18
+ HA5 HGR61 0.115 19
+ HA6 HGR61 0.115 20
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG HG
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD1 CA1
+ CA1 CA2
+ CA2 CA3
+ CA3 CA4
+ CA4 CA5
+ CA6 CA5
+ CA6 CA1
+ CA2 HA2
+ CA3 HA3
+ CA4 HA4
+ CA5 HA5
+ CA6 HA6
+
+[ 3PHURA ]
+ [ atoms ]
+ N1 NG2R67 -0.530 0
+ C2 CG2R63 0.400 1
+ O2 OG2D4 -0.460 2
+ C3 CG2R62 -0.200 3
+ H3 HGR62 0.150 4
+ C4 CG2R62 0.110 5
+ H4 HGR62 0.180 6
+ N5 NG2R61 -0.370 7
+ H5 HGP1 0.350 8
+ C6 CG2R63 0.440 9
+ O6 OG2D4 -0.450 10
+ C7 CG2R67 0.380 11
+ C8 CG2R61 -0.115 12
+ C9 CG2R61 -0.115 13
+ C10 CG2R61 -0.115 14
+ C11 CG2R61 -0.115 15
+ C12 CG2R61 -0.115 16
+ H8 HGR61 0.115 17
+ H9 HGR61 0.115 18
+ H10 HGR61 0.115 19
+ H11 HGR61 0.115 20
+ H12 HGR61 0.115 21
+ [ bonds ]
+ C2 N1
+ C2 O2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 N5
+ N5 H5
+ N5 C6
+ C6 O6
+ C6 N1
+ N1 C7
+ C7 C8
+ C7 C12
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C10 H10
+ C10 C11
+ C11 H11
+ C11 C12
+ C12 H12
+ [ impropers ]
+ C2 C3 N1 O2
+ C6 N5 N1 O6
+
+[ 3PRL ]
+ [ atoms ]
+ N1 NG3C51 -0.890 0
+ H1 HGP1 0.370 1
+ C2 CG3C52 0.170 2
+ H21 HGA2 0.090 3
+ H22 HGA2 0.090 4
+ C3 CG2R51 -0.280 5
+ H3 HGR51 0.190 6
+ C4 CG2R51 -0.280 7
+ H4 HGR51 0.190 8
+ C5 CG3C52 0.170 9
+ H51 HGA2 0.090 10
+ H52 HGA2 0.090 11
+ [ bonds ]
+ N1 H1
+ C2 H21
+ C2 H22
+ C3 H3
+ C4 H4
+ C5 H51
+ C5 H52
+ N1 C2
+ C2 C3
+ C4 C5
+ C5 N1
+ C3 C4
+
+[ 3PRP ]
+ [ atoms ]
+ N1 NG3P2 -0.400 0
+ H11 HGP2 0.390 1
+ H12 HGP2 0.390 2
+ C2 CG3C54 -0.170 3
+ H21 HGA2 0.280 4
+ H22 HGA2 0.280 5
+ C3 CG2R51 -0.330 6
+ H3 HGR51 0.250 7
+ C4 CG2R51 -0.330 8
+ H4 HGR51 0.250 9
+ C5 CG3C54 -0.170 10
+ H51 HGA2 0.280 11
+ H52 HGA2 0.280 12
+ [ bonds ]
+ N1 H11
+ N1 H12
+ C2 H21
+ C2 H22
+ C3 H3
+ C4 H4
+ C5 H51
+ C5 H52
+ N1 C2
+ C2 C3
+ C4 C5
+ C5 N1
+ C3 C4
+
+[ 43HPY ]
+ [ atoms ]
+ C6 CG2R62 -0.210 0
+ C5 CG2R62 0.350 1
+ N4 NG2R62 -0.760 2
+ C3 CG2R64 0.420 3
+ N2 NG2R61 -0.300 4
+ H2 HGP1 0.330 5
+ C1 CG2R63 0.210 6
+ O1 OG2D4 -0.460 7
+ H6 HGR62 0.150 8
+ H5 HGR62 0.110 9
+ H3 HGR62 0.160 10
+ [ bonds ]
+ C6 C1
+ C6 C5
+ C6 H6
+ C5 N4
+ C5 H5
+ N4 C3
+ C3 N2
+ C3 H3
+ N2 H2
+ N2 C1
+ C1 O1
+ [ impropers ]
+ C1 C6 N2 O1
+
+[ 43HSPP ]
+ [ atoms ]
+ N1 NG2R67 -0.240 0
+ C2 CG2R63 -0.370 1
+ S2 SG2D1 -0.210 2
+ C3 CG2R61 -0.030 3
+ H3 HGR62 0.160 4
+ C4 CG2R61 0.210 5
+ H4 HGR62 0.170 6
+ N5 NG2R62 -0.730 7
+ C6 CG2R64 0.590 8
+ H6 HGR62 0.130 9
+ C7 CG2R67 0.320 10
+ C8 CG2R61 -0.115 11
+ C9 CG2R61 -0.115 12
+ C10 CG2R61 -0.115 13
+ C11 CG2R61 -0.115 14
+ C12 CG2R61 -0.115 15
+ H8 HGR61 0.115 16
+ H9 HGR61 0.115 17
+ H10 HGR61 0.115 18
+ H11 HGR61 0.115 19
+ H12 HGR61 0.115 20
+ [ bonds ]
+ N1 C7
+ N1 C2
+ N1 C6
+ C2 S2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 N5
+ N5 C6
+ C6 H6
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C10 H10
+ C10 C11
+ C11 H11
+ C11 C12
+ C12 H12
+ C12 C7
+ [ impropers ]
+ C2 C3 N1 S2
+
+[ 43HSPY ]
+ [ atoms ]
+ C6 CG2R61 -0.030 0
+ C5 CG2R61 0.210 1
+ N4 NG2R62 -0.730 2
+ C3 CG2R64 0.590 3
+ N2 NG2R61 -0.240 4
+ H2 HGP1 0.320 5
+ C1 CG2R63 -0.370 6
+ S1 SG2D1 -0.210 7
+ H6 HGR62 0.160 8
+ H5 HGR62 0.170 9
+ H3 HGR62 0.130 10
+ [ bonds ]
+ C1 S1
+ C1 N2
+ C1 C6
+ N2 H2
+ N2 C3
+ C3 H3
+ C3 N4
+ N4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ [ impropers ]
+ C1 C6 N2 S1
+
+[ 43PPY ]
+ [ atoms ]
+ N1 NG2R67 -0.300 0
+ C2 CG2R63 0.210 1
+ O2 OG2D4 -0.460 2
+ C3 CG2R62 -0.210 3
+ H3 HGR62 0.150 4
+ C4 CG2R62 0.350 5
+ H4 HGR62 0.110 6
+ N5 NG2R62 -0.760 7
+ C6 CG2R64 0.420 8
+ H6 HGR62 0.160 9
+ C7 CG2R67 0.330 10
+ C8 CG2R61 -0.115 11
+ C9 CG2R61 -0.115 12
+ C10 CG2R61 -0.115 13
+ C11 CG2R61 -0.115 14
+ C12 CG2R61 -0.115 15
+ H8 HGR61 0.115 16
+ H9 HGR61 0.115 17
+ H10 HGR61 0.115 18
+ H11 HGR61 0.115 19
+ H12 HGR61 0.115 20
+ [ bonds ]
+ N1 C7
+ N1 C2
+ N1 C6
+ C2 O2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 N5
+ N5 C6
+ C6 H6
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C10 H10
+ C10 C11
+ C11 H11
+ C11 C12
+ C12 H12
+ C12 C7
+ [ impropers ]
+ C2 C3 N1 O2
+
+[ 4AP2 ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 -0.115 2
+ CG CG2R61 0.050 3
+ CE2 CG2R61 0.180 4
+ CD2 CG2R61 -0.115 5
+ NG NG2S3 -0.850 6
+ HE1 HGR62 0.120 7
+ HD1 HGR61 0.115 8
+ HD2 HGR61 0.115 9
+ HE2 HGR62 0.120 10
+ HG11 HGP4 0.400 11
+ HG12 HGP4 0.400 12
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CG NG
+ NG HG11
+ NG HG12
+ [ impropers ]
+ NG HG12 HG11 CG
+
+[ 4CYT ]
+ [ atoms ]
+ CG CG2R61 0.100 0
+ C3N CG1N1 0.360 1
+ N3C NG1T1 -0.460 2
+ CD1 CG2R61 -0.115 3
+ HD1 HGR61 0.115 4
+ CD2 CG2R61 -0.115 5
+ HD2 HGR61 0.115 6
+ CE1 CG2R61 -0.115 7
+ HE1 HGR61 0.115 8
+ CE2 CG2R61 -0.115 9
+ HE2 HGR61 0.115 10
+ CZ CG2R61 0.000 11
+ CT CG331 -0.270 12
+ H11 HGA3 0.090 13
+ H12 HGA3 0.090 14
+ H13 HGA3 0.090 15
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ CT
+ CT H11
+ CT H12
+ CT H13
+ CG C3N
+ C3N N3C
+
+[ 4MEP ]
+ [ atoms ]
+ NZ NG2R60 -0.600 0
+ CE1 CG2R61 0.180 1
+ CD1 CG2R61 -0.115 2
+ CG CG2R61 0.000 3
+ CD2 CG2R61 -0.115 4
+ CE2 CG2R61 0.180 5
+ HE1 HGR62 0.120 6
+ HD1 HGR61 0.115 7
+ HD2 HGR61 0.115 8
+ HE2 HGR62 0.120 9
+ C2 CG331 -0.270 10
+ H21 HGA3 0.090 11
+ H22 HGA3 0.090 12
+ H23 HGA3 0.090 13
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ NZ CE1
+ NZ CE2
+ CG C2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ 4O2SM ]
+ [ atoms ]
+ N1 NG2R62 -0.760 0
+ C2 CG2R64 0.580 1
+ N3 NG2R61 -0.300 2
+ C4 CG2R63 0.210 3
+ C5 CG2R62 -0.210 4
+ C6 CG2R62 0.350 5
+ H3 HGP1 0.330 6
+ H5 HGR62 0.150 7
+ H6 HGR62 0.110 8
+ O4 OG2D4 -0.460 9
+ S2 SG311 -0.070 10
+ C7 CG331 -0.200 11
+ H71 HGA3 0.090 12
+ H72 HGA3 0.090 13
+ H73 HGA3 0.090 14
+ [ bonds ]
+ N1 C2
+ N1 C6
+ C2 S2
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 O4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ S2 C7
+ C7 H71
+ C7 H72
+ C7 H73
+ [ impropers ]
+ C4 C5 N3 O4
+
+[ 4PYO ]
+ [ atoms ]
+ O1 OG2D4 -0.570 0
+ C1 CG2R63 0.460 1
+ C21 CG2R62 -0.380 2
+ C31 CG2R62 -0.070 3
+ N1 NG2R61 -0.110 4
+ C32 CG2R62 -0.070 5
+ C22 CG2R62 -0.380 6
+ H21 HGR62 0.220 7
+ H22 HGR62 0.220 8
+ H32 HGR62 0.200 9
+ H31 HGR62 0.200 10
+ H1 HGP1 0.280 11
+ [ bonds ]
+ O1 C1
+ C1 C21
+ C21 H21
+ C21 C31
+ C31 H31
+ C31 N1
+ N1 H1
+ N1 C32
+ C32 H32
+ C32 C22
+ C22 H22
+ C22 C1
+ [ impropers ]
+ C1 C21 C22 O1
+
+[ 9MAD ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ N9 NG2R51 -0.050 4
+ C5 CG2RC0 0.280 5
+ N7 NG2R50 -0.710 6
+ C8 CG2R53 0.340 7
+ H8 HGR52 0.120 8
+ N1 NG2R62 -0.740 9
+ C2 CG2R64 0.500 10
+ H2 HGR62 0.130 11
+ N3 NG2R62 -0.750 12
+ C4 CG2RC0 0.430 13
+ C6 CG2R64 0.460 14
+ N6 NG2S3 -0.770 15
+ H61 HGP4 0.380 16
+ H62 HGP4 0.380 17
+ [ bonds ]
+ C1 N9
+ C1 H11
+ C1 H12
+ C1 H13
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C8 H8
+ C2 H2
+ N1 C6
+ C2 N3
+ C4 C5
+ N7 C8
+ [ impropers ]
+ C6 C5 N1 N6
+ N6 H62 H61 C6
+
+[ A2FO ]
+ [ atoms ]
+ O1 OG3C51 -0.230 0
+ C2 CG2R53 0.300 1
+ C3 CG3C52 0.060 2
+ H31 HGA2 0.090 3
+ H32 HGA2 0.090 4
+ C4 CG2R51 -0.280 5
+ H4 HGR51 0.210 6
+ C5 CG2R51 -0.050 7
+ H5 HGR52 0.210 8
+ O6 OG2D1 -0.400 9
+ [ bonds ]
+ O1 C2
+ O1 C5
+ C2 O6
+ C2 C3
+ C3 C4
+ C3 H31
+ C3 H32
+ C4 C5
+ C4 H4
+ C5 H5
+ [ impropers ]
+ C2 C3 O6 O1
+
+[ A3PH ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C52 0.020 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C51 0.140 7
+ H22' HGA1 0.090 8
+ O2' OG311 -0.650 9
+ H21' HGP1 0.420 10
+ C3' CG3C51 0.010 11
+ H31' HGA1 0.090 12
+ O3' OG303 -0.620 13
+ P PG1 1.500 14
+ O1P OG2P1 -0.820 15
+ O2P OG2P1 -0.820 16
+ O3T OG311 -0.670 17
+ H3T HGP1 0.330 18
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' H22'
+ C2' O2'
+ O2' H21'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3T
+ O3T H3T
+
+[ AALD ]
+ [ atoms ]
+ HA HGR52 0.090 0
+ C CG2O4 0.200 1
+ O OG2D1 -0.400 2
+ CB CG331 -0.160 3
+ HB1 HGA3 0.090 4
+ HB2 HGA3 0.090 5
+ HB3 HGA3 0.090 6
+ [ bonds ]
+ HA C
+ C CB
+ CB HB1
+ CB HB2
+ CB HB3
+ C O
+ [ impropers ]
+ C CB O HA
+
+[ AALL ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ AALT ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ AANM ]
+ [ atoms ]
+ CL CG331 -0.270 0
+ HL1 HGA3 0.090 1
+ HL2 HGA3 0.090 2
+ HL3 HGA3 0.090 3
+ CLP CG2O1 0.510 4
+ OL OG2D1 -0.510 5
+ NL NG2S1 -0.470 6
+ HL HGP1 0.310 7
+ CA CG311 0.070 8
+ HA HGA1 0.090 9
+ CB CG331 -0.270 10
+ HB1 HGA3 0.090 11
+ HB2 HGA3 0.090 12
+ HB3 HGA3 0.090 13
+ CRP CG2O1 0.510 14
+ OR OG2D1 -0.510 15
+ NR NG2S1 -0.470 16
+ HR HGP1 0.310 17
+ CR CG331 -0.110 18
+ HR1 HGA3 0.090 19
+ HR2 HGA3 0.090 20
+ HR3 HGA3 0.090 21
+ [ bonds ]
+ CL CLP
+ CLP NL
+ NL CA
+ CA CRP
+ CRP NR
+ NR CR
+ NL HL
+ NR HR
+ CA HA
+ CA CB
+ CL HL1
+ CL HL2
+ CL HL3
+ CB HB1
+ CB HB2
+ CB HB3
+ CR HR1
+ CR HR2
+ CR HR3
+ CLP OL
+ CRP OR
+ [ impropers ]
+ CLP CL NL OL
+ CRP CA NR OR
+
+[ AAPM ]
+ [ atoms ]
+ P1 PG1 1.500 0
+ OP3 OG2P1 -0.780 1
+ OP4 OG2P1 -0.780 2
+ OP1 OG303 -0.570 3
+ OP2 OG303 -0.570 4
+ CP1 CG331 -0.170 5
+ HP11 HGA3 0.090 6
+ HP12 HGA3 0.090 7
+ HP13 HGA3 0.090 8
+ C3 CG321 -0.080 9
+ H31 HGA2 0.090 10
+ H32 HGA2 0.090 11
+ C1 CG321 0.080 12
+ H11 HGA2 0.090 13
+ H12 HGA2 0.090 14
+ O4 OG302 -0.490 15
+ C5 CG2O2 0.900 16
+ O6 OG2D1 -0.630 17
+ C7 CG331 -0.310 18
+ H71 HGA3 0.090 19
+ H72 HGA3 0.090 20
+ H73 HGA3 0.090 21
+ C2 CG311 0.170 22
+ H21 HGA1 0.090 23
+ O8 OG302 -0.490 24
+ C9 CG2O2 0.900 25
+ O10 OG2D1 -0.630 26
+ C11 CG331 -0.310 27
+ H111 HGA3 0.090 28
+ H112 HGA3 0.090 29
+ H113 HGA3 0.090 30
+ [ bonds ]
+ P1 OP1
+ P1 OP2
+ P1 OP3
+ P1 OP4
+ OP1 CP1
+ CP1 HP11
+ CP1 HP12
+ CP1 HP13
+ OP2 C3
+ C1 C2
+ C2 C3
+ C1 O4
+ O4 C5
+ C5 C7
+ C5 O6
+ C2 O8
+ O8 C9
+ C9 C11
+ C9 O10
+ C1 H11
+ C1 H12
+ C2 H21
+ C3 H31
+ C3 H32
+ C7 H71
+ C7 H72
+ C7 H73
+ C11 H111
+ C11 H112
+ C11 H113
+ [ impropers ]
+ C5 C7 O6 O4
+ C9 C11 O10 O8
+
+[ AARB ]
+ [ atoms ]
+ O4 OC3C51 -0.400 0
+ C1 CC3152 0.340 1
+ H1 HCA1 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C4 CC3153 0.110 5
+ H4 HCA1 0.090 6
+ C5 CC321 0.050 7
+ H51 HCA2 0.090 8
+ H52 HCA2 0.090 9
+ O5 OC311 -0.650 10
+ HO5 HCP1 0.420 11
+ C2 CC3151 0.140 12
+ H2 HCA1 0.090 13
+ O2 OC311 -0.650 14
+ HO2 HCP1 0.420 15
+ C3 CC3151 0.140 16
+ H3 HCA1 0.090 17
+ O3 OC311 -0.650 18
+ HO3 HCP1 0.420 19
+ [ bonds ]
+ O4 C1
+ C1 H1
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 C5
+ C4 O4
+ C5 H51
+ C5 H52
+ C5 O5
+ O5 HO5
+
+[ ABNS ]
+ [ atoms ]
+ H5T HGP1 0.420 0
+ O5' OG311 -0.650 1
+ C5' CG321 0.050 2
+ H51' HGA2 0.090 3
+ H52' HGA2 0.090 4
+ C4' CG3C51 0.110 5
+ H42' HGA1 0.090 6
+ O4' OG3C51 -0.400 7
+ C1' CG3C52 0.020 8
+ H11' HGA2 0.090 9
+ H12' HGA2 0.090 10
+ C2' CG3C52 -0.180 11
+ H21' HGA2 0.090 12
+ H22' HGA2 0.090 13
+ C3' CG3C51 0.140 14
+ H31' HGA1 0.090 15
+ O3' OG311 -0.650 16
+ H32' HGP1 0.420 17
+ [ bonds ]
+ O4' C4'
+ O4' C1'
+ C4' C5'
+ C4' H42'
+ C4' C3'
+ C1' H11'
+ C1' H12'
+ C1' C2'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C3' O3'
+ O3' H32'
+ C5' O5'
+ C5' H51'
+ C5' H52'
+ O5' H5T
+ C2' C3'
+
+[ ACEH ]
+ [ atoms ]
+ C2 CG331 -0.300 0
+ C1 CG2O2 0.750 1
+ H21 HGA3 0.090 2
+ H22 HGA3 0.090 3
+ H23 HGA3 0.090 4
+ O2 OG2D1 -0.550 5
+ O1 OG311 -0.600 6
+ HO1 HGP1 0.430 7
+ [ bonds ]
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+ C1 O2
+ [ impropers ]
+ C1 C2 O2 O1
+
+[ ACEM ]
+ [ atoms ]
+ CC CG331 -0.270 0
+ C CG2O1 0.550 1
+ N NG2S2 -0.620 2
+ HC HGP1 0.320 3
+ HT HGP1 0.300 4
+ O OG2D1 -0.550 5
+ HC1 HGA3 0.090 6
+ HC2 HGA3 0.090 7
+ HC3 HGA3 0.090 8
+ [ bonds ]
+ C N
+ N HC
+ N HT
+ C CC
+ CC HC1
+ CC HC2
+ CC HC3
+ C O
+ [ impropers ]
+ C CC N O
+
+[ ACET ]
+ [ atoms ]
+ C1 CG331 -0.370 0
+ C2 CG2O3 0.620 1
+ H1 HGA3 0.090 2
+ H2 HGA3 0.090 3
+ H3 HGA3 0.090 4
+ O1 OG2D2 -0.760 5
+ O2 OG2D2 -0.760 6
+ [ bonds ]
+ C1 H1
+ C1 H2
+ C1 H3
+ C1 C2
+ C2 O1
+ C2 O2
+ [ impropers ]
+ C2 O2 O1 C1
+
+[ ACHO ]
+ [ atoms ]
+ N NG3P0 -0.600 0
+ C1 CG324 -0.100 1
+ C2 CG334 -0.350 2
+ C3 CG334 -0.350 3
+ C4 CG334 -0.350 4
+ H11 HGP5 0.250 5
+ H12 HGP5 0.250 6
+ H21 HGP5 0.250 7
+ H22 HGP5 0.250 8
+ H23 HGP5 0.250 9
+ H31 HGP5 0.250 10
+ H32 HGP5 0.250 11
+ H33 HGP5 0.250 12
+ H41 HGP5 0.250 13
+ H42 HGP5 0.250 14
+ H43 HGP5 0.250 15
+ C5 CG321 0.080 16
+ OM OG302 -0.490 17
+ C CG2O2 0.900 18
+ C7 CG331 -0.310 19
+ O OG2D1 -0.630 20
+ H51 HGA2 0.090 21
+ H52 HGA2 0.090 22
+ H71 HGA3 0.090 23
+ H72 HGA3 0.090 24
+ H73 HGA3 0.090 25
+ [ bonds ]
+ N C1
+ N C2
+ N C3
+ N C4
+ C1 H11
+ C1 H12
+ C1 C5
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+ C4 H41
+ C4 H42
+ C4 H43
+ C5 H51
+ C5 H52
+ C7 C
+ C OM
+ OM C5
+ C7 H71
+ C7 H72
+ C7 H73
+ C O
+ [ impropers ]
+ C C7 O OM
+
+[ ACN ]
+ [ atoms ]
+ C1 CG331 -0.170 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG1N1 0.360 4
+ N3 NG1T1 -0.460 5
+ [ bonds ]
+ C1 C2
+ C2 N3
+ C1 H11
+ C1 H12
+ C1 H13
+
+[ ACO ]
+ [ atoms ]
+ O1 OG2D3 -0.480 0
+ C1 CG2O5 0.400 1
+ C2 CG331 -0.230 2
+ C3 CG331 -0.230 3
+ H21 HGA3 0.090 4
+ H22 HGA3 0.090 5
+ H23 HGA3 0.090 6
+ H31 HGA3 0.090 7
+ H32 HGA3 0.090 8
+ H33 HGA3 0.090 9
+ [ bonds ]
+ C1 C2
+ C1 C3
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+ O1 C1
+ [ impropers ]
+ C1 C2 C3 O1
+
+[ ACRD ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ H1 HGR61 0.115 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 0.000 8
+ C6 CG2R61 -0.115 9
+ H6 HGR61 0.115 10
+ C7 CG2R61 0.000 11
+ C8 CG2R61 -0.115 12
+ H8 HGR61 0.115 13
+ C9 CG2R61 -0.115 14
+ H9 HGR61 0.115 15
+ C10 CG2R61 -0.115 16
+ H10 HGR61 0.115 17
+ C11 CG2R61 -0.115 18
+ H11 HGR61 0.115 19
+ C12 CG2R61 0.345 20
+ N13 NG2R60 -0.690 21
+ C14 CG2R61 0.345 22
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 N13
+ N13 C14
+ C14 C1
+ C5 C14
+ C7 C12
+ C1 H1
+ C2 H2
+ C3 H3
+ C4 H4
+ C6 H6
+ C8 H8
+ C9 H9
+ C10 H10
+ C11 H11
+
+[ ADAM ]
+ [ atoms ]
+ C1 CG311 -0.090 0
+ H1 HGA1 0.090 1
+ C2 CG321 -0.180 2
+ H21 HGA2 0.090 3
+ H22 HGA2 0.090 4
+ C3 CG311 -0.090 5
+ H3 HGA1 0.090 6
+ C4 CG321 -0.180 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG311 -0.090 10
+ H5 HGA1 0.090 11
+ C6 CG321 -0.180 12
+ H61 HGA2 0.090 13
+ H62 HGA2 0.090 14
+ C7 CG311 -0.090 15
+ H7 HGA1 0.090 16
+ C8 CG321 -0.180 17
+ H81 HGA2 0.090 18
+ H82 HGA2 0.090 19
+ C9 CG321 -0.180 20
+ H91 HGA2 0.090 21
+ H92 HGA2 0.090 22
+ C10 CG321 -0.180 23
+ H101 HGA2 0.090 24
+ H102 HGA2 0.090 25
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C1
+ C3 C9
+ C9 C7
+ C5 C10
+ C10 C1
+ C1 H1
+ C3 H3
+ C5 H5
+ C7 H7
+ C2 H21
+ C2 H22
+ C4 H41
+ C4 H42
+ C6 H61
+ C6 H62
+ C8 H81
+ C8 H82
+ C9 H91
+ C9 H92
+ C10 H101
+ C10 H102
+
+[ ADE ]
+ [ atoms ]
+ P P 1.500 0
+ O1P ON3 -0.780 1
+ O2P ON3 -0.780 2
+ O5' ON2 -0.570 3
+ C5' CN8B -0.080 4
+ H5' HN8 0.090 5
+ H5'' HN8 0.090 6
+ C4' CN7 0.160 7
+ H4' HN7 0.090 8
+ O4' ON6B -0.500 9
+ C1' CN7B 0.160 10
+ H1' HN7 0.090 11
+ N9 NN2 -0.050 12
+ C5 CN5 0.280 13
+ N7 NN4 -0.710 14
+ C8 CN4 0.340 15
+ H8 HN3 0.120 16
+ N1 NN3A -0.740 17
+ C2 CN4 0.500 18
+ H2 HN3 0.130 19
+ N3 NN3A -0.750 20
+ C4 CN5 0.430 21
+ C6 CN2 0.460 22
+ N6 NN1 -0.770 23
+ H61 HN1 0.380 24
+ H62 HN1 0.380 25
+ C2' CN7B 0.140 26
+ H2'' HN7 0.090 27
+ O2' ON5 -0.660 28
+ H2' HN5 0.430 29
+ C3' CN7 0.010 30
+ H3' HN7 0.090 31
+ O3' ON2 -0.570 32
+ [ bonds ]
+ P O1P
+ P O2P
+ P O5'
+ O5' C5'
+ C5' C4'
+ C4' O4'
+ C4' C3'
+ O4' C1'
+ C1' N9
+ C1' C2'
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C2' C3'
+ C2' O2'
+ O2' H2'
+ C3' O3'
+ O3' +P
+ C1' H1'
+ C2' H2''
+ C3' H3'
+ C4' H4'
+ C5' H5'
+ C5' H5''
+ C8 H8
+ C2 H2
+ N1 C6
+ C2 N3
+ C4 C5
+ N7 C8
+ [ impropers ]
+ N6 C6 H61 H62
+ C6 N1 C5 N6
+
+[ ADEO ]
+ [ atoms ]
+ O4 OC3C51 -0.400 0
+ C1 CC3152 0.340 1
+ H1 HCA1 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C4 CC3153 0.110 5
+ H4 HCA1 0.090 6
+ C5 CC321 0.050 7
+ H51 HCA2 0.090 8
+ H52 HCA2 0.090 9
+ O5 OC311 -0.650 10
+ HO5 HCP1 0.420 11
+ C2 CC3251 -0.180 12
+ H21 HCA2 0.090 13
+ H22 HCA2 0.090 14
+ C3 CC3151 0.140 15
+ H3 HCA1 0.090 16
+ O3 OC311 -0.650 17
+ HO3 HCP1 0.420 18
+ [ bonds ]
+ O4 C1
+ C1 H1
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 O5
+ O5 HO5
+
+[ ADP ]
+ [ atoms ]
+ C4' CG3C51 0.110 0
+ H4' HGA1 0.090 1
+ O4' OG3C51 -0.400 2
+ C1' CG3C51 0.110 3
+ H1' HGA1 0.090 4
+ C5 CG2RC0 0.280 5
+ N7 NG2R50 -0.710 6
+ C8 CG2R53 0.340 7
+ H8 HGR52 0.120 8
+ N9 NG2R51 -0.050 9
+ N1 NG2R62 -0.740 10
+ C2 CG2R64 0.500 11
+ H2 HGR62 0.130 12
+ N3 NG2R62 -0.750 13
+ C4 CG2RC0 0.430 14
+ C6 CG2R64 0.460 15
+ N6 NG2S3 -0.770 16
+ H61 HGP4 0.380 17
+ H62 HGP4 0.380 18
+ C2' CG3C51 0.140 19
+ H2'' HGA1 0.090 20
+ O2' OG311 -0.650 21
+ H2' HGP1 0.420 22
+ C3' CG3C51 0.140 23
+ H3' HGA1 0.090 24
+ O3' OG311 -0.650 25
+ H3T HGP1 0.420 26
+ C5' CG321 -0.080 27
+ H5' HGA2 0.090 28
+ H5'' HGA2 0.090 29
+ O5' OG303 -0.620 30
+ PA PG1 1.500 31
+ O1A OG2P1 -0.820 32
+ O2A OG2P1 -0.820 33
+ O3A OG304 -0.740 34
+ PB PG2 1.100 35
+ O1B OG2P1 -0.900 36
+ O2B OG2P1 -0.900 37
+ O3B OG2P1 -0.900 38
+ [ bonds ]
+ PB O3A
+ PB O1B
+ PB O2B
+ PB O3B
+ O3A PA
+ PA O1A
+ PA O2A
+ PA O5'
+ O3' H3T
+ O5' C5'
+ C5' C4'
+ C4' O4'
+ C4' C3'
+ O4' C1'
+ C1' N9
+ C1' C2'
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C2' C3'
+ C2' O2'
+ O2' H2'
+ C3' O3'
+ C1' H1'
+ C2' H2''
+ C3' H3'
+ C4' H4'
+ C5' H5'
+ C5' H5''
+ C8 H8
+ C2 H2
+ N1 C6
+ N3 C2
+ C4 C5
+ N7 C8
+ [ impropers ]
+ C6 C5 N1 N6
+ N6 H62 H61 C6
+
+[ AFRU ]
+ [ atoms ]
+ O5 OC3C51 -0.400 0
+ C2 CC3051 0.430 1
+ O2 OC311 -0.650 2
+ HO2 HCP1 0.420 3
+ C5 CC3153 0.110 4
+ H5 HCA1 0.090 5
+ C6 CC321 0.050 6
+ H61 HCA2 0.090 7
+ H62 HCA2 0.090 8
+ O6 OC311 -0.650 9
+ HO6 HCP1 0.420 10
+ C1 CC321 0.050 11
+ H11 HCA2 0.090 12
+ H12 HCA2 0.090 13
+ O1 OC311 -0.650 14
+ HO1 HCP1 0.420 15
+ C3 CC3151 0.140 16
+ H3 HCA1 0.090 17
+ O3 OC311 -0.650 18
+ HO3 HCP1 0.420 19
+ C4 CC3151 0.140 20
+ H4 HCA1 0.090 21
+ O4 OC311 -0.650 22
+ HO4 HCP1 0.420 23
+ [ bonds ]
+ O5 C2
+ C2 C1
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C5 O5
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C1 H11
+ C1 H12
+ C1 O1
+ O1 HO1
+
+[ AFUC ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC331 -0.270 19
+ H61 HCA3 0.090 20
+ H62 HCA3 0.090 21
+ H63 HCA3 0.090 22
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+ C5 O5
+
+[ AGAL ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ AGALNA ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.070 7
+ H2 HCA1 0.090 8
+ N NC2D1 -0.470 9
+ HN HCP1 0.310 10
+ C CC2O1 0.510 11
+ O OC2D1 -0.510 12
+ CT CC331 -0.270 13
+ HT1 HCA3 0.090 14
+ HT2 HCA3 0.090 15
+ HT3 HCA3 0.090 16
+ C3 CC3161 0.140 17
+ H3 HCA1 0.090 18
+ O3 OC311 -0.650 19
+ HO3 HCP1 0.420 20
+ C4 CC3161 0.140 21
+ H4 HCA1 0.090 22
+ O4 OC311 -0.650 23
+ HO4 HCP1 0.420 24
+ C6 CC321 0.050 25
+ H61 HCA2 0.090 26
+ H62 HCA2 0.090 27
+ O6 OC311 -0.650 28
+ HO6 HCP1 0.420 29
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 N
+ N HN
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ N C
+ C O
+ C CT
+ CT HT1
+ CT HT2
+ CT HT3
+ [ impropers ]
+ C CT N O
+ N C C2 HN
+
+[ AGLC ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ AGLCA ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC2O2 0.520 19
+ O61 OC2D2 -0.760 20
+ O62 OC2D2 -0.760 21
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 O61
+ C6 O62
+ C5 O5
+ [ impropers ]
+ C6 C5 O62 O61
+
+[ AGLCNA ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.070 7
+ H2 HCA1 0.090 8
+ N NC2D1 -0.470 9
+ HN HCP1 0.310 10
+ C CC2O1 0.510 11
+ O OC2D1 -0.510 12
+ CT CC331 -0.270 13
+ HT1 HCA3 0.090 14
+ HT2 HCA3 0.090 15
+ HT3 HCA3 0.090 16
+ C3 CC3161 0.140 17
+ H3 HCA1 0.090 18
+ O3 OC311 -0.650 19
+ HO3 HCP1 0.420 20
+ C4 CC3161 0.140 21
+ H4 HCA1 0.090 22
+ O4 OC311 -0.650 23
+ HO4 HCP1 0.420 24
+ C6 CC321 0.050 25
+ H61 HCA2 0.090 26
+ H62 HCA2 0.090 27
+ O6 OC311 -0.650 28
+ HO6 HCP1 0.420 29
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 N
+ N HN
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ N C
+ C O
+ C CT
+ CT HT1
+ CT HT2
+ CT HT3
+ [ impropers ]
+ C CT N O
+ N C C2 HN
+
+[ AGUL ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ AIDO ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ AIDOA ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC2O2 0.520 19
+ O61 OC2D2 -0.760 20
+ O62 OC2D2 -0.760 21
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 O61
+ C6 O62
+ C5 O5
+
+[ ALA ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT3 -0.270 4
+ HB1 HA3 0.090 5
+ HB2 HA3 0.090 6
+ HB3 HA3 0.090 7
+ C C 0.510 8
+ O O -0.510 9
+ [ bonds ]
+ CB CA
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CB HB3
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ ALAD ]
+ [ atoms ]
+ CL CT3 -0.270 0
+ HL1 HA3 0.090 1
+ HL2 HA3 0.090 2
+ HL3 HA3 0.090 3
+ CLP C 0.510 4
+ OL O -0.510 5
+ NL NH1 -0.470 6
+ HL H 0.310 7
+ CA CT1 0.070 8
+ HA HB1 0.090 9
+ CB CT3 -0.270 10
+ HB1 HA3 0.090 11
+ HB2 HA3 0.090 12
+ HB3 HA3 0.090 13
+ CRP C 0.510 14
+ OR O -0.510 15
+ NR NH1 -0.470 16
+ HR H 0.310 17
+ CR CT3 -0.110 18
+ HR1 HA3 0.090 19
+ HR2 HA3 0.090 20
+ HR3 HA3 0.090 21
+ [ bonds ]
+ CL CLP
+ CLP NL
+ NL CA
+ CA CRP
+ CRP NR
+ NR CR
+ NL HL
+ NR HR
+ CA HA
+ CA CB
+ CL HL1
+ CL HL2
+ CL HL3
+ CB HB1
+ CB HB2
+ CB HB3
+ CR HR1
+ CR HR2
+ CR HR3
+ CLP OL
+ CRP OR
+ [ impropers ]
+ CLP CL NL OL
+ NL CLP CA HL
+ CRP CA NR OR
+ NR CRP CR HR
+ [ cmap ]
+ CLP NL CA CRP NR
+
+[ ALF4 ]
+ [ atoms ]
+ AL1 ALG1 1.160 0
+ F1 FGP1 -0.540 1
+ F2 FGP1 -0.540 2
+ F3 FGP1 -0.540 3
+ F4 FGP1 -0.540 4
+ [ bonds ]
+ AL1 F1
+ AL1 F2
+ AL1 F3
+ AL1 F4
+
+[ ALLOSE ]
+ [ atoms ]
+ C1 CC2O4 0.200 0
+ O1 OC2D4 -0.400 1
+ H1 HCR1 0.060 2
+ C2 CC312 0.280 3
+ H2 HCA1 0.090 4
+ O2 OC311 -0.650 5
+ HO2 HCP1 0.420 6
+ C3 CC312 0.140 7
+ H3 HCA1 0.090 8
+ O3 OC311 -0.650 9
+ HO3 HCP1 0.420 10
+ C4 CC312 0.140 11
+ H4 HCA1 0.090 12
+ O4 OC311 -0.650 13
+ HO4 HCP1 0.420 14
+ C5 CC312 0.140 15
+ H5 HCA1 0.090 16
+ O5 OC311 -0.650 17
+ HO5 HCP1 0.420 18
+ C6 CC322 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+ [ impropers ]
+ C1 C2 O1 H1
+
+[ ALYF ]
+ [ atoms ]
+ O4 OC3C51 -0.400 0
+ C1 CC3152 0.340 1
+ H1 HCA1 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C4 CC3153 0.110 5
+ H4 HCA1 0.090 6
+ C5 CC321 0.050 7
+ H51 HCA2 0.090 8
+ H52 HCA2 0.090 9
+ O5 OC311 -0.650 10
+ HO5 HCP1 0.420 11
+ C2 CC3151 0.140 12
+ H2 HCA1 0.090 13
+ O2 OC311 -0.650 14
+ HO2 HCP1 0.420 15
+ C3 CC3151 0.140 16
+ H3 HCA1 0.090 17
+ O3 OC311 -0.650 18
+ HO3 HCP1 0.420 19
+ [ bonds ]
+ O4 C1
+ C1 H1
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 C5
+ C4 O4
+ C5 H51
+ C5 H52
+ C5 O5
+ O5 HO5
+
+[ AMAN ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ AMCP ]
+ [ atoms ]
+ C1 CG3C31 -0.090 0
+ H2 HGA1 0.090 1
+ C3 CG3C31 -0.180 2
+ H4 HGA2 0.090 3
+ H5 HGA2 0.090 4
+ C6 CG3C31 -0.180 5
+ H7 HGA2 0.090 6
+ H8 HGA2 0.090 7
+ C9 CG324 0.210 8
+ H10 HGA2 0.050 9
+ H11 HGA2 0.050 10
+ N12 NG3P3 -0.300 11
+ H13 HGP2 0.330 12
+ H14 HGP2 0.330 13
+ H15 HGP2 0.330 14
+ [ bonds ]
+ C1 C3
+ C1 C6
+ C1 C9
+ C1 H2
+ C3 C6
+ C3 H4
+ C3 H5
+ C6 H7
+ C6 H8
+ C9 N12
+ C9 H10
+ C9 H11
+ N12 H13
+ N12 H14
+ N12 H15
+
+[ AMDN ]
+ [ atoms ]
+ C1 CG2N2 0.660 0
+ C2 CG331 -0.150 1
+ H3 HGA3 0.090 2
+ H4 HGA3 0.090 3
+ H5 HGA3 0.090 4
+ N6 NG2P1 -0.690 5
+ H7 HGP2 0.400 6
+ H8 HGP2 0.400 7
+ N9 NG2P1 -0.690 8
+ H10 HGP2 0.400 9
+ H11 HGP2 0.400 10
+ [ bonds ]
+ C1 C2
+ C2 H3
+ C2 H4
+ C2 H5
+ C1 N6
+ N6 H7
+ N6 H8
+ C1 N9
+ N9 H10
+ N9 H11
+ [ impropers ]
+ C1 N6 N9 C2
+
+[ AMET ]
+ [ atoms ]
+ C1 CG2D2 -0.500 0
+ H2 HGA5 0.210 1
+ H3 HGA5 0.210 2
+ C4 CG2D1O -0.130 3
+ H5 HGA4 0.240 4
+ N6 NG321 -0.810 5
+ H7 HGPAM2 0.390 6
+ H8 HGPAM2 0.390 7
+ [ bonds ]
+ C1 H2
+ C1 H3
+ C1 C4
+ C4 H5
+ C4 N6
+ N6 H7
+ N6 H8
+ [ impropers ]
+ C4 C1 N6 H5
+
+[ AMM1 ]
+ [ atoms ]
+ N1 NG331 -1.125 0
+ H11 HGPAM3 0.375 1
+ H12 HGPAM3 0.375 2
+ H13 HGPAM3 0.375 3
+ [ bonds ]
+ N1 H11
+ N1 H12
+ N1 H13
+
+[ AMOL ]
+ [ atoms ]
+ C1 CG301 0.300 0
+ C2 CG2O3 0.300 1
+ OH OG311 -0.650 2
+ HO HGP1 0.420 3
+ OM OG301 -0.340 4
+ CM CG331 -0.100 5
+ HM1 HGA3 0.090 6
+ HM2 HGA3 0.090 7
+ HM3 HGA3 0.090 8
+ O1 OG2D2 -0.600 9
+ O2 OG2D2 -0.600 10
+ C0 CG331 -0.270 11
+ H01 HGA3 0.090 12
+ H02 HGA3 0.090 13
+ H03 HGA3 0.090 14
+ [ bonds ]
+ C1 OH
+ OH HO
+ C1 OM
+ C1 C0
+ C1 C2
+ C2 O1
+ C0 H01
+ C0 H02
+ C0 H03
+ OM CM
+ CM HM1
+ CM HM2
+ CM HM3
+ C2 O2
+ [ impropers ]
+ C2 O2 O1 C1
+
+[ AMOP ]
+ [ atoms ]
+ C1 CG311 -0.020 0
+ C2 CG2O3 0.620 1
+ H1 HGA1 0.090 2
+ OM OG301 -0.340 3
+ CM CG331 -0.100 4
+ HM1 HGA3 0.090 5
+ HM2 HGA3 0.090 6
+ HM3 HGA3 0.090 7
+ O1 OG2D2 -0.760 8
+ O2 OG2D2 -0.760 9
+ C0 CG331 -0.270 10
+ H01 HGA3 0.090 11
+ H02 HGA3 0.090 12
+ H03 HGA3 0.090 13
+ [ bonds ]
+ C1 H1
+ C1 OM
+ C1 C0
+ C1 C2
+ C2 O1
+ C0 H01
+ C0 H02
+ C0 H03
+ OM CM
+ CM HM1
+ CM HM2
+ CM HM3
+ C2 O2
+ [ impropers ]
+ C2 O2 O1 C1
+
+[ AMP ]
+ [ atoms ]
+ C4' CG3C51 0.110 0
+ H4' HGA1 0.090 1
+ O4' OG3C51 -0.400 2
+ C1' CG3C51 0.110 3
+ H1' HGA1 0.090 4
+ C5 CG2RC0 0.280 5
+ N7 NG2R50 -0.710 6
+ C8 CG2R53 0.340 7
+ H8 HGR52 0.120 8
+ N9 NG2R51 -0.050 9
+ N1 NG2R62 -0.740 10
+ C2 CG2R64 0.500 11
+ H2 HGR62 0.130 12
+ N3 NG2R62 -0.750 13
+ C4 CG2RC0 0.430 14
+ C6 CG2R64 0.460 15
+ N6 NG2S3 -0.770 16
+ H61 HGP4 0.380 17
+ H62 HGP4 0.380 18
+ C2' CG3C51 0.140 19
+ H2'' HGA1 0.090 20
+ O2' OG311 -0.650 21
+ H2' HGP1 0.420 22
+ C3' CG3C51 0.140 23
+ H3' HGA1 0.090 24
+ O3' OG311 -0.650 25
+ H3T HGP1 0.420 26
+ C5' CG321 -0.180 27
+ H5' HGA2 0.090 28
+ H5'' HGA2 0.090 29
+ O5' OG303 -0.400 30
+ PA PG2 1.100 31
+ O1A OG2P1 -0.900 32
+ O2A OG2P1 -0.900 33
+ O3A OG2P1 -0.900 34
+ [ bonds ]
+ PA O1A
+ PA O2A
+ PA O3A
+ PA O5'
+ O3' H3T
+ O5' C5'
+ C5' C4'
+ C4' O4'
+ C4' C3'
+ O4' C1'
+ C1' N9
+ C1' C2'
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C2' C3'
+ C2' O2'
+ O2' H2'
+ C3' O3'
+ C1' H1'
+ C2' H2''
+ C3' H3'
+ C4' H4'
+ C5' H5'
+ C5' H5''
+ C8 H8
+ C2 H2
+ N1 C6
+ N3 C2
+ C4 C5
+ N7 C8
+ [ impropers ]
+ C6 C5 N1 N6
+ N6 H62 H61 C6
+
+[ ANE5AC ]
+ [ atoms ]
+ C1 CC2O2 0.300 0
+ O11 OC2D2 -0.600 1
+ O12 OC2D2 -0.600 2
+ C2 CC3062 0.330 3
+ O2 OC311 -0.650 4
+ HO2 HCP1 0.420 5
+ C6 CC3163 0.110 6
+ H6 HCA1 0.090 7
+ O6 OC3C61 -0.400 8
+ C3 CC3261 -0.180 9
+ H31 HCA2 0.090 10
+ H32 HCA2 0.090 11
+ C4 CC3161 0.140 12
+ H4 HCA1 0.090 13
+ O4 OC311 -0.650 14
+ HO4 HCP1 0.420 15
+ C5 CC3161 0.070 16
+ H5 HCA1 0.090 17
+ N NC2D1 -0.470 18
+ HN HCP1 0.310 19
+ C CC2O1 0.510 20
+ O OC2D1 -0.510 21
+ CT CC331 -0.270 22
+ HT1 HCA3 0.090 23
+ HT2 HCA3 0.090 24
+ HT3 HCA3 0.090 25
+ C7 CC312 0.140 26
+ H7 HCA1 0.090 27
+ O7 OC311 -0.650 28
+ HO7 HCP1 0.420 29
+ C8 CC312 0.140 30
+ H8 HCA1 0.090 31
+ O8 OC311 -0.650 32
+ HO8 HCP1 0.420 33
+ C9 CC322 0.050 34
+ H91 HCA2 0.090 35
+ H92 HCA2 0.090 36
+ O9 OC311 -0.650 37
+ HO9 HCP1 0.420 38
+ [ bonds ]
+ C1 O11
+ C1 O12
+ C2 O2
+ C2 C1
+ O2 HO2
+ C2 O6
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 N
+ N HN
+ N C
+ C O
+ C CT
+ CT HT1
+ CT HT2
+ CT HT3
+ C5 C6
+ C6 H6
+ C6 C7
+ C7 O7
+ C7 H7
+ C6 O6
+ O7 HO7
+ C7 C8
+ C8 H8
+ C8 O8
+ O8 HO8
+ C8 C9
+ C9 H91
+ C9 H92
+ C9 O9
+ O9 HO9
+ [ impropers ]
+ C CT N O
+ N C C5 HN
+
+[ ANTR ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ H1 HGR61 0.115 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 0.000 8
+ C6 CG2R61 -0.115 9
+ H6 HGR61 0.115 10
+ C7 CG2R61 0.000 11
+ C8 CG2R61 -0.115 12
+ H8 HGR61 0.115 13
+ C9 CG2R61 -0.115 14
+ H9 HGR61 0.115 15
+ C10 CG2R61 -0.115 16
+ H10 HGR61 0.115 17
+ C11 CG2R61 -0.115 18
+ H11 HGR61 0.115 19
+ C12 CG2R61 0.000 20
+ C13 CG2R61 -0.115 21
+ H13 HGR61 0.115 22
+ C14 CG2R61 0.000 23
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 C13
+ C13 C14
+ C14 C1
+ C5 C14
+ C7 C12
+ C1 H1
+ C2 H2
+ C3 H3
+ C4 H4
+ C6 H6
+ C8 H8
+ C9 H9
+ C10 H10
+ C11 H11
+ C13 H13
+
+[ AOBT ]
+ [ atoms ]
+ S1 SG3O2 0.560 0
+ N2 NG311 -0.600 1
+ H2 HGP1 0.370 2
+ O11 OG2P1 -0.430 3
+ O12 OG2P1 -0.430 4
+ C3 CG321 0.210 5
+ H31 HGA2 0.090 6
+ H32 HGA2 0.090 7
+ N4 NG311 -0.560 8
+ H4 HGPAM1 0.370 9
+ C5 CG2R61 0.050 10
+ C6 CG2R61 -0.115 11
+ H6 HGR61 0.115 12
+ C7 CG2R61 -0.115 13
+ H7 HGR61 0.115 14
+ C8 CG2R61 -0.115 15
+ H8 HGR61 0.115 16
+ C9 CG2R61 -0.115 17
+ H9 HGR61 0.115 18
+ C10 CG2R61 -0.115 19
+ H10 HGR61 0.115 20
+ CS CG331 0.010 21
+ HS1 HGA3 0.090 22
+ HS2 HGA3 0.090 23
+ HS3 HGA3 0.090 24
+ [ bonds ]
+ S1 N2
+ N2 C3
+ C3 N4
+ N4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 H10
+ C5 C10
+ S1 O11
+ S1 O12
+ N2 H2
+ C3 H31
+ C3 H32
+ N4 H4
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+ S1 CS
+ CS HS1
+ CS HS2
+ CS HS3
+
+[ APNH ]
+ [ atoms ]
+ N NG2S0 -0.290 0
+ CA CG3C51 0.020 1
+ CB CG3C52 -0.180 2
+ CG CG3C52 -0.180 3
+ CD CG3C52 0.000 4
+ CY CG2O1 0.510 5
+ OY OG2D1 -0.510 6
+ C CG2O1 0.510 7
+ HA HGA1 0.090 8
+ HB1 HGA2 0.090 9
+ HB2 HGA2 0.090 10
+ HG1 HGA2 0.090 11
+ HG2 HGA2 0.090 12
+ HD1 HGA2 0.090 13
+ HD2 HGA2 0.090 14
+ CAY CG331 -0.270 15
+ HY1 HGA3 0.090 16
+ HY2 HGA3 0.090 17
+ HY3 HGA3 0.090 18
+ O OG2D1 -0.510 19
+ NT NG2S2 -0.620 20
+ HT1 HGP1 0.310 21
+ HT2 HGP1 0.310 22
+ [ bonds ]
+ CY N
+ CAY HY1
+ CAY HY2
+ CAY HY3
+ CY CAY
+ N CA
+ CA CB
+ CB CG
+ CG CD
+ CD N
+ HA CA
+ HG1 CG
+ HG2 CG
+ HD1 CD
+ HD2 CD
+ HB1 CB
+ HB2 CB
+ C CA
+ C NT
+ NT HT1
+ NT HT2
+ C O
+ CY OY
+ [ impropers ]
+ CY CAY N OY
+ C CA NT O
+
+[ APPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C13 CTL5 -0.350 1
+ H13A HL 0.250 2
+ H13B HL 0.250 3
+ H13C HL 0.250 4
+ C14 CTL5 -0.350 5
+ H14A HL 0.250 6
+ H14B HL 0.250 7
+ H14C HL 0.250 8
+ C15 CTL5 -0.350 9
+ H15A HL 0.250 10
+ H15B HL 0.250 11
+ H15C HL 0.250 12
+ C12 CTL2 -0.100 13
+ H12A HL 0.250 14
+ H12B HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O11 OSLP -0.570 22
+ O12 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CTL2 -0.180 50
+ H5R HAL2 0.090 51
+ H5S HAL2 0.090 52
+ C26 CTL2 -0.180 53
+ H6R HAL2 0.090 54
+ H6S HAL2 0.090 55
+ C27 CTL2 -0.180 56
+ H7R HAL2 0.090 57
+ H7S HAL2 0.090 58
+ C28 CTL2 -0.180 59
+ H8R HAL2 0.090 60
+ H8S HAL2 0.090 61
+ C29 CTL2 -0.180 62
+ H9R HAL2 0.090 63
+ H9S HAL2 0.090 64
+ C210 CTL2 -0.180 65
+ H10R HAL2 0.090 66
+ H10S HAL2 0.090 67
+ C211 CTL2 -0.180 68
+ H11R HAL2 0.090 69
+ H11S HAL2 0.090 70
+ C212 CTL2 -0.180 71
+ H12R HAL2 0.090 72
+ H12S HAL2 0.090 73
+ C213 CTL1 -0.090 74
+ H13R HAL1 0.090 75
+ C216 CTL3 -0.270 76
+ H16R HAL3 0.090 77
+ H16S HAL3 0.090 78
+ H16T HAL3 0.090 79
+ C214 CTL2 -0.180 80
+ H14R HAL2 0.090 81
+ H14S HAL2 0.090 82
+ C215 CTL3 -0.270 83
+ H15R HAL3 0.090 84
+ H15S HAL3 0.090 85
+ H15T HAL3 0.090 86
+ C33 CTL2 -0.180 87
+ H3X HAL2 0.090 88
+ H3Y HAL2 0.090 89
+ C34 CTL2 -0.180 90
+ H4X HAL2 0.090 91
+ H4Y HAL2 0.090 92
+ C35 CTL2 -0.180 93
+ H5X HAL2 0.090 94
+ H5Y HAL2 0.090 95
+ C36 CTL2 -0.180 96
+ H6X HAL2 0.090 97
+ H6Y HAL2 0.090 98
+ C37 CTL2 -0.180 99
+ H7X HAL2 0.090 100
+ H7Y HAL2 0.090 101
+ C38 CTL2 -0.180 102
+ H8X HAL2 0.090 103
+ H8Y HAL2 0.090 104
+ C39 CTL2 -0.180 105
+ H9X HAL2 0.090 106
+ H9Y HAL2 0.090 107
+ C310 CTL2 -0.180 108
+ H10X HAL2 0.090 109
+ H10Y HAL2 0.090 110
+ C311 CTL2 -0.180 111
+ H11X HAL2 0.090 112
+ H11Y HAL2 0.090 113
+ C312 CTL2 -0.180 114
+ H12X HAL2 0.090 115
+ H12Y HAL2 0.090 116
+ C313 CTL2 -0.180 117
+ H13X HAL2 0.090 118
+ H13Y HAL2 0.090 119
+ C314 CTL2 -0.180 120
+ H14X HAL2 0.090 121
+ H14Y HAL2 0.090 122
+ C315 CTL2 -0.180 123
+ H15X HAL2 0.090 124
+ H15Y HAL2 0.090 125
+ C316 CTL3 -0.270 126
+ H16X HAL3 0.090 127
+ H16Y HAL3 0.090 128
+ H16Z HAL3 0.090 129
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 C214
+ C213 C216
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 H15T
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ AR3P ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ C4' CG3C52 0.020 2
+ H11' HGA2 0.090 3
+ H12' HGA2 0.090 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C51 0.140 7
+ H22' HGA1 0.090 8
+ O2' OG311 -0.650 9
+ H21' HGP1 0.420 10
+ C3' CG3C51 -0.090 11
+ H31' HGA1 0.090 12
+ O3' OG303 -0.400 13
+ P PG2 1.100 14
+ O1P OG2P1 -0.900 15
+ O2P OG2P1 -0.900 16
+ O3P OG2P1 -0.900 17
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' O2'
+ C2' H22'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O2' H21'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+
+[ ARAO ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C52 0.020 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C51 0.140 7
+ H22' HGA1 0.090 8
+ O2' OG311 -0.650 9
+ H21' HGP1 0.420 10
+ C3' CG3C51 0.140 11
+ H31' HGA1 0.090 12
+ O3' OG311 -0.650 13
+ H32' HGP1 0.420 14
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' O2'
+ C2' H22'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O2' H21'
+ O3' H32'
+
+[ ARG ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CT2 -0.180 7
+ HG1 HA2 0.090 8
+ HG2 HA2 0.090 9
+ CD CT2 -0.300 10
+ HD1 HA2 0.050 11
+ HD2 HA2 0.050 12
+ NE NC2 -0.280 13
+ HE HC 0.120 14
+ CZ C -0.200 15
+ NH1 NC2 -0.121 16
+ HH11 HC 0.2005 17
+ HH12 HC 0.2005 18
+ NH2 NC2 -0.121 19
+ HH21 HC 0.2005 20
+ HH22 HC 0.2005 21
+ C C 0.510 22
+ O O -0.510 23
+ [ bonds ]
+ CB CA
+ CG CB
+ CD CG
+ NE CD
+ CZ NE
+ NH2 CZ
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CG HG1
+ CG HG2
+ CD HD1
+ CD HD2
+ NE HE
+ NH1 HH11
+ NH1 HH12
+ NH2 HH21
+ NH2 HH22
+ O C
+ CZ NH1
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ CZ NH1 NH2 NE
+ NH1 HH11 HH12 CZ
+ NH2 HH21 HH22 CZ
+ [ cmap ]
+ -C N CA C +N
+
+[ ARHM ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC331 -0.270 19
+ H61 HCA3 0.090 20
+ H62 HCA3 0.090 21
+ H63 HCA3 0.090 22
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+ C5 O5
+
+[ ARIB ]
+ [ atoms ]
+ O4 OC3C51 -0.400 0
+ C1 CC3152 0.340 1
+ H1 HCA1 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C4 CC3153 0.110 5
+ H4 HCA1 0.090 6
+ C5 CC321 0.050 7
+ H51 HCA2 0.090 8
+ H52 HCA2 0.090 9
+ O5 OC311 -0.650 10
+ HO5 HCP1 0.420 11
+ C2 CC3151 0.140 12
+ H2 HCA1 0.090 13
+ O2 OC311 -0.650 14
+ HO2 HCP1 0.420 15
+ C3 CC3151 0.140 16
+ H3 HCA1 0.090 17
+ O3 OC311 -0.650 18
+ HO3 HCP1 0.420 19
+ [ bonds ]
+ O4 C1
+ C1 H1
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 C5
+ C4 O4
+ C5 H51
+ C5 H52
+ C5 O5
+ O5 HO5
+
+[ ARIM ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C51 0.110 1
+ H12' HGA1 0.090 2
+ C4' CG3C52 0.020 3
+ H41' HGA2 0.090 4
+ H42' HGA2 0.090 5
+ C3' CG3C52 -0.180 6
+ H31' HGA2 0.090 7
+ H32' HGA2 0.090 8
+ C2' CG3C51 0.140 9
+ H22' HGA1 0.090 10
+ O2' OG311 -0.650 11
+ H21' HGP1 0.420 12
+ CG CG2R51 -0.050 13
+ HG HGR52 0.090 14
+ CD2 CG2R51 0.220 15
+ HD2 HGR52 0.100 16
+ ND1 NG2R51 -0.040 17
+ CE1 CG2R53 0.250 18
+ HE1 HGR52 0.130 19
+ NE2 NG2R50 -0.700 20
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' ND1
+ C2' O2'
+ C1' H12'
+ C2' H22'
+ C3' H31'
+ C3' H32'
+ O2' H21'
+ C4' H41'
+ C4' H42'
+ ND1 CE1
+ NE2 CD2
+ CG ND1
+ CE1 HE1
+ CD2 HD2
+ CG HG
+ CG CD2
+ CE1 NE2
+
+[ ARMO ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C51 0.110 4
+ H42' HGA1 0.090 5
+ C2' CG3C51 0.140 6
+ H22' HGA1 0.090 7
+ O2' OG311 -0.650 8
+ H21' HGP1 0.420 9
+ C3' CG3C51 0.140 10
+ H31' HGA1 0.090 11
+ O3' OG311 -0.650 12
+ H32' HGP1 0.420 13
+ C5' CG331 -0.270 14
+ H51' HGA3 0.090 15
+ H52' HGA3 0.090 16
+ H53' HGA3 0.090 17
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' H11'
+ C1' H12'
+ C2' O2'
+ C2' H22'
+ O2' H21'
+ C3' O3'
+ O3' H32'
+ C3' H31'
+ C4' C5'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+ C4' H42'
+
+[ ASN ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CC 0.550 7
+ OD1 O -0.550 8
+ ND2 NH2 -0.620 9
+ HD21 H 0.320 10
+ HD22 H 0.300 11
+ C C 0.510 12
+ O O -0.510 13
+ [ bonds ]
+ CB CA
+ CG CB
+ ND2 CG
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ ND2 HD21
+ ND2 HD22
+ C O
+ CG OD1
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ CG ND2 CB OD1
+ CG CB ND2 OD1
+ ND2 CG HD21 HD22
+ ND2 CG HD22 HD21
+ [ cmap ]
+ -C N CA C +N
+
+
+
+[ ASPP ] ; protonated ASP
+ [ atoms ]
+ N NH1 -0.47 0
+ HN H 0.31 1
+ CA CT1 0.07 2
+ HA HB1 0.09 3
+ CB CT2 -0.21 4
+ HB1 HA2 0.09 5
+ HB2 HA2 0.09 6
+ CG CD 0.75 7
+ OD1 OB -0.55 8
+ OD2 OH1 -0.61 9
+ HD2 H 0.44 10
+ C C 0.51 11
+ O O -0.51 12
+ [ bonds ]
+ CB CA
+ CG CB
+ OD2 CG
+ OD2 HD2
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ O C
+ CG OD1
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ CG CB OD2 OD1
+ [ cmap ]
+ -C N CA C +N
+
+[ ASP ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2A -0.280 4
+ HB1 HA2 0.140 5
+ HB2 HA2 0.140 6
+ CG CC 0.380 7
+ OD1 OC -0.190 8
+ OD2 OC -0.190 9
+ C C 0.510 10
+ O O -0.510 11
+ [ bonds ]
+ CB CA
+ CG CB
+ OD2 CG
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ O C
+ CG OD1
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ CG CB OD2 OD1
+ [ cmap ]
+ -C N CA C +N
+
+[ ATAL ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ ATP ]
+ [ atoms ]
+ C4' CG3C51 0.110 0
+ H4' HGA1 0.090 1
+ O4' OG3C51 -0.400 2
+ C1' CG3C51 0.110 3
+ H1' HGA1 0.090 4
+ C5 CG2RC0 0.280 5
+ N7 NG2R50 -0.710 6
+ C8 CG2R53 0.340 7
+ H8 HGR52 0.120 8
+ N9 NG2R51 -0.050 9
+ N1 NG2R62 -0.740 10
+ C2 CG2R64 0.500 11
+ H2 HGR62 0.130 12
+ N3 NG2R62 -0.750 13
+ C4 CG2RC0 0.430 14
+ C6 CG2R64 0.460 15
+ N6 NG2S3 -0.770 16
+ H61 HGP4 0.380 17
+ H62 HGP4 0.380 18
+ C2' CG3C51 0.140 19
+ H2'' HGA1 0.090 20
+ O2' OG311 -0.650 21
+ H2' HGP1 0.420 22
+ C3' CG3C51 0.140 23
+ H3' HGA1 0.090 24
+ O3' OG311 -0.650 25
+ H3T HGP1 0.420 26
+ C5' CG321 -0.080 27
+ H5' HGA2 0.090 28
+ H5'' HGA2 0.090 29
+ O5' OG303 -0.620 30
+ PA PG1 1.500 31
+ O1A OG2P1 -0.820 32
+ O2A OG2P1 -0.820 33
+ O3A OG304 -0.740 34
+ PB PG1 1.500 35
+ O1B OG2P1 -0.820 36
+ O2B OG2P1 -0.820 37
+ O3B OG304 -0.860 38
+ PG PG2 1.100 39
+ O1G OG2P1 -0.900 40
+ O2G OG2P1 -0.900 41
+ O3G OG2P1 -0.900 42
+ [ bonds ]
+ O5' C5'
+ O5' PA
+ PA O1A
+ PA O2A
+ PA O3A
+ O3A PB
+ PB O1B
+ PB O2B
+ PB O3B
+ O3B PG
+ PG O1G
+ PG O2G
+ PG O3G
+ C5' C4'
+ C4' O4'
+ C4' C3'
+ O4' C1'
+ C1' N9
+ C1' C2'
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C2' C3'
+ C2' O2'
+ O2' H2'
+ C3' O3'
+ O3' H3T
+ C1' H1'
+ C2' H2''
+ C3' H3'
+ C4' H4'
+ C5' H5'
+ C5' H5''
+ C8 H8
+ C2 H2
+ N1 C6
+ N3 C2
+ C4 C5
+ N7 C8
+ [ impropers ]
+ C6 C5 N1 N6
+ N6 H62 H61 C6
+
+[ AXYF ]
+ [ atoms ]
+ O4 OC3C51 -0.400 0
+ C1 CC3152 0.340 1
+ H1 HCA1 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C4 CC3153 0.110 5
+ H4 HCA1 0.090 6
+ C5 CC321 0.050 7
+ H51 HCA2 0.090 8
+ H52 HCA2 0.090 9
+ O5 OC311 -0.650 10
+ HO5 HCP1 0.420 11
+ C2 CC3151 0.140 12
+ H2 HCA1 0.090 13
+ O2 OC311 -0.650 14
+ HO2 HCP1 0.420 15
+ C3 CC3151 0.140 16
+ H3 HCA1 0.090 17
+ O3 OC311 -0.650 18
+ HO3 HCP1 0.420 19
+ [ bonds ]
+ O4 C1
+ C1 H1
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 C5
+ C4 O4
+ C5 H51
+ C5 H52
+ C5 O5
+ O5 HO5
+
+[ AXYL ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3263 0.020 4
+ H51 HCA2 0.090 5
+ H52 HCA2 0.090 6
+ O5 OC3C61 -0.400 7
+ C2 CC3161 0.140 8
+ H2 HCA1 0.090 9
+ O2 OC311 -0.650 10
+ HO2 HCP1 0.420 11
+ C3 CC3161 0.140 12
+ H3 HCA1 0.090 13
+ O3 OC311 -0.650 14
+ HO3 HCP1 0.420 15
+ C4 CC3161 0.140 16
+ H4 HCA1 0.090 17
+ O4 OC311 -0.650 18
+ HO4 HCP1 0.420 19
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 O5
+
+[ AZDO ]
+ [ atoms ]
+ N1 NG2R43 -0.540 0
+ H1 HGP1 0.360 1
+ C2 CG2R53 0.290 2
+ O2 OG2D1 -0.470 3
+ C3 CG3C41 -0.010 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ C4 CG3C41 0.010 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ [ bonds ]
+ N1 H1
+ C2 O2
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 N1
+ [ impropers ]
+ C2 C3 N1 O2
+
+[ AZUL ]
+ [ atoms ]
+ C1 CG2R51 -0.300 0
+ H1 HGR51 0.200 1
+ C2 CG2R51 -0.170 2
+ H2 HGR51 0.200 3
+ C3 CG2R51 -0.300 4
+ H3 HGR51 0.200 5
+ C4 CG2RC7 0.070 6
+ C5 CG2R71 -0.240 7
+ H5 HGR71 0.230 8
+ C6 CG2R71 -0.150 9
+ H6 HGR71 0.180 10
+ C7 CG2R71 -0.220 11
+ H7 HGR71 0.210 12
+ C8 CG2R71 -0.150 13
+ H8 HGR71 0.180 14
+ C9 CG2R71 -0.240 15
+ H9 HGR71 0.230 16
+ C10 CG2RC7 0.070 17
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C1
+ C4 C10
+ C1 H1
+ C2 H2
+ C3 H3
+ C5 H5
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+
+[ B2FO ]
+ [ atoms ]
+ O1 OG3C51 -0.310 0
+ C2 CG2R53 0.290 1
+ C3 CG2R51 -0.140 2
+ H3 HGR51 0.220 3
+ C4 CG2R51 -0.220 4
+ H4 HGR51 0.220 5
+ C5 CG3C52 0.190 6
+ H51 HGA2 0.090 7
+ H52 HGA2 0.090 8
+ O6 OG2D1 -0.430 9
+ [ bonds ]
+ O1 C2
+ O1 C5
+ C2 C3
+ C2 O6
+ C3 C4
+ C3 H3
+ C4 C5
+ C4 H4
+ C5 H51
+ C5 H52
+ [ impropers ]
+ C2 C3 O6 O1
+
+[ B5NP ]
+ [ atoms ]
+ C5' CG321 -0.080 0
+ H51' HGA2 0.090 1
+ H52' HGA2 0.090 2
+ O5' OG303 -0.570 3
+ P PG1 1.500 4
+ O1P OG2P1 -0.780 5
+ O2P OG2P1 -0.780 6
+ O3' OG303 -0.570 7
+ C3' CG331 -0.170 8
+ H31' HGA3 0.090 9
+ H32' HGA3 0.090 10
+ H33' HGA3 0.090 11
+ C4 CG3C52 -0.180 12
+ H41 HGA2 0.090 13
+ H42 HGA2 0.090 14
+ C3 CG3C52 -0.180 15
+ H31 HGA2 0.090 16
+ H32 HGA2 0.090 17
+ C1 CG3RC1 0.000 18
+ C2 CG3C51 0.140 19
+ H21 HGA1 0.090 20
+ O3T OG311 -0.650 21
+ H3T HGP1 0.420 22
+ C5 CG3RC1 -0.090 23
+ H51 HGA1 0.090 24
+ C6 CG3C31 -0.180 25
+ H61 HGA2 0.090 26
+ H62 HGA2 0.090 27
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C1
+ C5 C6
+ C6 C1
+ C5 H51
+ C2 H21
+ C4 H42
+ C3 H31
+ C3 H32
+ C4 H41
+ C6 H61
+ C1 C5'
+ C2 O3T
+ C6 H62
+ C5' O5'
+ O5' P
+ P O1P
+ P O2P
+ P O3'
+ O3' C3'
+ C3' H31'
+ C3' H32'
+ C3' H33'
+ C5' H51'
+ C5' H52'
+ O3T H3T
+
+[ B5SP ]
+ [ atoms ]
+ C1 CG3RC1 -0.090 0
+ H11 HGA1 0.090 1
+ C3 CG3C51 0.140 2
+ H31 HGA1 0.090 3
+ O3T OG311 -0.650 4
+ H3T HGP1 0.420 5
+ C6 CG3C31 -0.180 6
+ H61 HGA2 0.090 7
+ H62 HGA2 0.090 8
+ C4 CG3C52 -0.180 9
+ H41 HGA2 0.090 10
+ H42 HGA2 0.090 11
+ C5 CG3RC1 -0.090 12
+ H51 HGA1 0.090 13
+ C2 CG3C51 -0.090 14
+ H21 HGA1 0.090 15
+ C5' CG321 -0.080 16
+ H51' HGA2 0.090 17
+ H52' HGA2 0.090 18
+ O5' OG303 -0.570 19
+ P PG1 1.500 20
+ O1P OG2P1 -0.780 21
+ O2P OG2P1 -0.780 22
+ O3' OG303 -0.570 23
+ C3' CG331 -0.170 24
+ H31' HGA3 0.090 25
+ H32' HGA3 0.090 26
+ H33' HGA3 0.090 27
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C1
+ C5 C6
+ C6 C1
+ C2 C5'
+ C4 H41
+ C4 H42
+ C5' H51'
+ C1 H11
+ C5' H52'
+ C6 H61
+ C6 H62
+ C2 H21
+ C5 H51
+ C3 H31
+ C3 O3T
+ C5' O5'
+ O5' P
+ O3T H3T
+ P O1P
+ P O2P
+ P O3'
+ O3' C3'
+ C3' H31'
+ C3' H32'
+ C3' H33'
+
+[ BAB1 ]
+ [ atoms ]
+ C3 CG311 0.140 0
+ O3 OG311 -0.650 1
+ H3' HGP1 0.420 2
+ H3 HGA1 0.090 3
+ C4 CG321 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CG311 -0.090 7
+ H5 HGA1 0.090 8
+ C6 CG321 -0.180 9
+ H6A HGA2 0.090 10
+ H6B HGA2 0.090 11
+ C7 CG311 0.140 12
+ O7 OG311 -0.650 13
+ H7' HGP1 0.420 14
+ H7 HGA1 0.090 15
+ C8 CG311 -0.090 16
+ H8 HGA1 0.090 17
+ C14 CG3RC1 -0.090 18
+ H14 HGA1 0.090 19
+ C15 CG3C52 -0.180 20
+ H15A HGA2 0.090 21
+ H15B HGA2 0.090 22
+ C16 CG3C52 -0.180 23
+ H16A HGA2 0.090 24
+ H16B HGA2 0.090 25
+ C17 CG3C51 -0.090 26
+ H17 HGA1 0.090 27
+ C13 CG3RC1 0.000 28
+ C18 CG331 -0.270 29
+ H18A HGA3 0.090 30
+ H18B HGA3 0.090 31
+ H18C HGA3 0.090 32
+ C12 CG321 -0.180 33
+ H12A HGA2 0.090 34
+ H12B HGA2 0.090 35
+ C11 CG321 -0.180 36
+ H11A HGA2 0.090 37
+ H11B HGA2 0.090 38
+ C9 CG311 -0.090 39
+ H9 HGA1 0.090 40
+ C10 CG301 0.000 41
+ C19 CG331 -0.270 42
+ H19A HGA3 0.090 43
+ H19B HGA3 0.090 44
+ H19C HGA3 0.090 45
+ C1 CG321 -0.180 46
+ H1A HGA2 0.090 47
+ H1B HGA2 0.090 48
+ C2 CG321 -0.180 49
+ H2A HGA2 0.090 50
+ H2B HGA2 0.090 51
+ C20 CG311 -0.090 52
+ H20 HGA1 0.090 53
+ C21 CG331 -0.270 54
+ H21A HGA3 0.090 55
+ H21B HGA3 0.090 56
+ H21C HGA3 0.090 57
+ C22 CG321 -0.180 58
+ H22A HGA2 0.090 59
+ H22B HGA2 0.090 60
+ C23 CG321 -0.180 61
+ H23A HGA2 0.090 62
+ H23B HGA2 0.090 63
+ C24 CG2O1 0.510 64
+ O24 OG2D1 -0.510 65
+ N NG2S1 -0.470 66
+ HN HGP1 0.470 67
+ CC1 CG311 -0.190 68
+ HC1 HGA1 0.090 69
+ CA CG2O3 0.620 70
+ OA1 OG2D2 -0.760 71
+ OA2 OG2D2 -0.760 72
+ CC2 CG321 -0.180 73
+ HC2A HGA2 0.090 74
+ HC2B HGA2 0.090 75
+ CC3 CG321 -0.180 76
+ HC3A HGA2 0.090 77
+ HC3B HGA2 0.090 78
+ CG CG2O1 0.550 79
+ OG OG2D1 -0.550 80
+ NT NG2S2 -0.620 81
+ HT1 HGP1 0.320 82
+ HT2 HGP1 0.300 83
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 H3'
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5
+ C5 C10
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C10 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C7
+ C7 H7
+ C7 O7
+ O7 H7'
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C13 C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 C24
+ C24 O24
+ C24 N
+ N HN
+ N CC1
+ CC1 HC1
+ CC1 CC2
+ CC1 CA
+ CA OA1
+ CA OA2
+ CC2 HC2A
+ CC2 HC2B
+ CC2 CC3
+ CC3 HC3A
+ CC3 HC3B
+ CC3 CG
+ CG OG
+ CG NT
+ NT HT1
+ NT HT2
+ [ impropers ]
+ C24 C23 N O24
+ CA OA2 OA1 CC1
+ CG CC3 NT OG
+
+[ BAB2 ]
+ [ atoms ]
+ C3 CG311 0.140 0
+ O3 OG311 -0.650 1
+ H3' HGP1 0.420 2
+ H3 HGA1 0.090 3
+ C4 CG321 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CG311 -0.090 7
+ H5 HGA1 0.090 8
+ C6 CG321 -0.180 9
+ H6A HGA2 0.090 10
+ H6B HGA2 0.090 11
+ C7 CG311 0.140 12
+ O7 OG311 -0.650 13
+ H7' HGP1 0.420 14
+ H7 HGA1 0.090 15
+ C8 CG311 -0.090 16
+ H8 HGA1 0.090 17
+ C14 CG3RC1 -0.090 18
+ H14 HGA1 0.090 19
+ C15 CG3C52 -0.180 20
+ H15A HGA2 0.090 21
+ H15B HGA2 0.090 22
+ C16 CG3C52 -0.180 23
+ H16A HGA2 0.090 24
+ H16B HGA2 0.090 25
+ C17 CG3C51 -0.090 26
+ H17 HGA1 0.090 27
+ C13 CG3RC1 0.000 28
+ C18 CG331 -0.270 29
+ H18A HGA3 0.090 30
+ H18B HGA3 0.090 31
+ H18C HGA3 0.090 32
+ C12 CG321 -0.180 33
+ H12A HGA2 0.090 34
+ H12B HGA2 0.090 35
+ C11 CG321 -0.180 36
+ H11A HGA2 0.090 37
+ H11B HGA2 0.090 38
+ C9 CG311 -0.090 39
+ H9 HGA1 0.090 40
+ C10 CG301 0.000 41
+ C19 CG331 -0.270 42
+ H19A HGA3 0.090 43
+ H19B HGA3 0.090 44
+ H19C HGA3 0.090 45
+ C1 CG321 -0.180 46
+ H1A HGA2 0.090 47
+ H1B HGA2 0.090 48
+ C2 CG321 -0.180 49
+ H2A HGA2 0.090 50
+ H2B HGA2 0.090 51
+ C20 CG311 -0.090 52
+ H20 HGA1 0.090 53
+ C21 CG331 -0.270 54
+ H21A HGA3 0.090 55
+ H21B HGA3 0.090 56
+ H21C HGA3 0.090 57
+ C22 CG321 -0.180 58
+ H22A HGA2 0.090 59
+ H22B HGA2 0.090 60
+ C23 CG321 -0.180 61
+ H23A HGA2 0.090 62
+ H23B HGA2 0.090 63
+ C24 CG2O1 0.510 64
+ O24 OG2D1 -0.510 65
+ N NG2S1 -0.470 66
+ HN HGP1 0.470 67
+ CC1 CG311 -0.190 68
+ HC1 HGA1 0.090 69
+ CA CG2O3 0.620 70
+ OA1 OG2D2 -0.760 71
+ OA2 OG2D2 -0.760 72
+ CC2 CG321 -0.180 73
+ HC2A HGA2 0.090 74
+ HC2B HGA2 0.090 75
+ CC3 CG321 -0.180 76
+ HC3A HGA2 0.090 77
+ HC3B HGA2 0.090 78
+ CG CG2O1 0.550 79
+ OG OG2D1 -0.550 80
+ NT NG2S2 -0.620 81
+ HT1 HGP1 0.320 82
+ HT2 HGP1 0.300 83
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 H3'
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5
+ C5 C10
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C10 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C7
+ C7 H7
+ C7 O7
+ O7 H7'
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C13 C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 C24
+ C24 O24
+ C24 N
+ N HN
+ N CC1
+ CC1 HC1
+ CC1 CC2
+ CC1 CA
+ CA OA1
+ CA OA2
+ CC2 HC2A
+ CC2 HC2B
+ CC2 CC3
+ CC3 HC3A
+ CC3 HC3B
+ CC3 CG
+ CG OG
+ CG NT
+ NT HT1
+ NT HT2
+ [ impropers ]
+ C24 C23 N O24
+ CA OA2 OA1 CC1
+ CG CC3 NT OG
+
+[ BALD ]
+ [ atoms ]
+ HA HGR52 0.080 0
+ C CG2O4 0.240 1
+ O OG2D1 -0.410 2
+ CG CG2R61 0.090 3
+ CD1 CG2R61 -0.115 4
+ HD1 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CZ CG2R61 -0.115 8
+ HZ HGR61 0.115 9
+ CD2 CG2R61 -0.115 10
+ HD2 HGR61 0.115 11
+ CE2 CG2R61 -0.115 12
+ HE2 HGR61 0.115 13
+ [ bonds ]
+ HA C
+ C CG
+ CG CD1
+ CG CD2
+ CD1 HD1
+ CD2 HD2
+ CD1 CE1
+ CD2 CE2
+ CE1 HE1
+ CE2 HE2
+ CE1 CZ
+ CE2 CZ
+ CZ HZ
+ C O
+ [ impropers ]
+ C CG O HA
+
+[ BALL ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ BALT ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ BAM1 ]
+ [ atoms ]
+ C12 CG321 -0.180 0
+ H12A HGA2 0.090 1
+ H12B HGA2 0.090 2
+ C11 CG321 -0.180 3
+ H11A HGA2 0.090 4
+ H11B HGA2 0.090 5
+ C9 CG321 -0.180 6
+ H9A HGA2 0.090 7
+ H9B HGA2 0.090 8
+ C8 CG321 -0.180 9
+ H8A HGA2 0.090 10
+ H8B HGA2 0.090 11
+ C14 CG3RC1 -0.090 12
+ H14 HGA1 0.090 13
+ C13 CG3RC1 0.000 14
+ C15 CG3C52 -0.180 15
+ H15A HGA2 0.090 16
+ H15B HGA2 0.090 17
+ C16 CG3C52 -0.180 18
+ H16A HGA2 0.090 19
+ H16B HGA2 0.090 20
+ C17 CG3C51 -0.090 21
+ H17 HGA1 0.090 22
+ C18 CG331 -0.270 23
+ H18A HGA3 0.090 24
+ H18B HGA3 0.090 25
+ H18C HGA3 0.090 26
+ C20 CG311 -0.090 27
+ H20 HGA1 0.090 28
+ C21 CG331 -0.270 29
+ H21A HGA3 0.090 30
+ H21B HGA3 0.090 31
+ H21C HGA3 0.090 32
+ C22 CG331 -0.270 33
+ H22A HGA3 0.090 34
+ H22B HGA3 0.090 35
+ H22C HGA3 0.090 36
+ [ bonds ]
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C9 H9A
+ C9 H9B
+ C9 C8
+ C8 H8A
+ C8 H8B
+ C8 C14
+ C14 H14
+ C14 C13
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C13 C12
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 H22C
+
+[ BAMI ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ H2 HGR61 0.115 1
+ C3 CG2R61 -0.115 2
+ H4 HGR61 0.115 3
+ C5 CG2R61 -0.115 4
+ H6 HGR61 0.115 5
+ C7 CG2R61 -0.115 6
+ H8 HGR61 0.115 7
+ C9 CG2R61 -0.115 8
+ H10 HGR61 0.115 9
+ C11 CG2R61 0.190 10
+ C12 CG2N2 0.730 11
+ N13 NG2P1 -0.600 12
+ H14 HGP2 0.320 13
+ H15 HGP2 0.320 14
+ N16 NG2P1 -0.600 15
+ H17 HGP2 0.320 16
+ H18 HGP2 0.320 17
+ [ bonds ]
+ C1 H2
+ C1 C3
+ C3 H4
+ C3 C5
+ C5 H6
+ C1 C7
+ C7 H8
+ C7 C9
+ C9 H10
+ C11 C5
+ C11 C12
+ C11 C9
+ C12 N13
+ N13 H14
+ N13 H15
+ C12 N16
+ N16 H17
+ N16 H18
+ [ impropers ]
+ C12 N13 N16 C11
+
+[ BAR ]
+ [ atoms ]
+ BAR BAR 2.000 0
+
+[ BARB ]
+ [ atoms ]
+ O4 OC3C51 -0.400 0
+ C1 CC3152 0.340 1
+ H1 HCA1 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C4 CC3153 0.110 5
+ H4 HCA1 0.090 6
+ C5 CC321 0.050 7
+ H51 HCA2 0.090 8
+ H52 HCA2 0.090 9
+ O5 OC311 -0.650 10
+ HO5 HCP1 0.420 11
+ C2 CC3151 0.140 12
+ H2 HCA1 0.090 13
+ O2 OC311 -0.650 14
+ HO2 HCP1 0.420 15
+ C3 CC3151 0.140 16
+ H3 HCA1 0.090 17
+ O3 OC311 -0.650 18
+ HO3 HCP1 0.420 19
+ [ bonds ]
+ O4 C1
+ C1 H1
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 C5
+ C4 O4
+ C5 H51
+ C5 H52
+ C5 O5
+ O5 HO5
+
+[ BBEN ]
+ [ atoms ]
+ CG CG2R61 0.000 0
+ CD1 CG2R61 -0.115 1
+ HD1 HGR61 0.115 2
+ CD2 CG2R61 -0.115 3
+ HD2 HGR61 0.115 4
+ CE1 CG2R61 -0.115 5
+ HE1 HGR61 0.115 6
+ CE2 CG2R61 -0.115 7
+ HE2 HGR61 0.115 8
+ CZ CG2R61 -0.115 9
+ HZ HGR61 0.115 10
+ C1 CG321 -0.180 11
+ H11 HGA2 0.090 12
+ H12 HGA2 0.090 13
+ C2 CG321 -0.180 14
+ H21 HGA2 0.090 15
+ H22 HGA2 0.090 16
+ C3 CG321 -0.180 17
+ H31 HGA2 0.090 18
+ H32 HGA2 0.090 19
+ C4 CG331 -0.270 20
+ H41 HGA3 0.090 21
+ H42 HGA3 0.090 22
+ H43 HGA3 0.090 23
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG C1
+ C1 C2
+ C2 C3
+ C3 C4
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ HZ
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ BCA ]
+ [ atoms ]
+ CG1 CG2R67 0.000 0
+ CG2 CG2R67 0.000 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CD3 CG2R61 -0.115 10
+ HD3 HGR61 0.115 11
+ CD4 CG2R61 -0.115 12
+ HD4 HGR61 0.115 13
+ CE3 CG2R61 -0.115 14
+ HE3 HGR61 0.115 15
+ CE4 CG2R61 -0.115 16
+ HE4 HGR61 0.115 17
+ CZ1 CG2R61 -0.100 18
+ C1 CG2O3 0.620 19
+ O1A OG2D2 -0.760 20
+ O1B OG2D2 -0.760 21
+ CZ2 CG2R61 -0.100 22
+ C2 CG2O3 0.620 23
+ O2A OG2D2 -0.760 24
+ O2B OG2D2 -0.760 25
+ [ bonds ]
+ CD1 CG1
+ CG1 CD2
+ CG1 CG2
+ CD2 CE2
+ CE2 CZ1
+ CZ1 CE1
+ CE1 CD1
+ CG2 CD3
+ CD3 CE3
+ CE3 CZ2
+ CZ2 CE4
+ CE4 CD4
+ CD4 CG2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD3 HD3
+ CD4 HD4
+ CE3 HE3
+ CE4 HE4
+ CZ1 C1
+ C1 O1A
+ C1 O1B
+ CZ2 C2
+ C2 O2A
+ C2 O2B
+ [ impropers ]
+ C1 O1B O1A CZ1
+ C2 O2B O2A CZ2
+
+[ BDEO ]
+ [ atoms ]
+ O4 OC3C51 -0.400 0
+ C1 CC3152 0.340 1
+ H1 HCA1 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C4 CC3153 0.110 5
+ H4 HCA1 0.090 6
+ C5 CC321 0.050 7
+ H51 HCA2 0.090 8
+ H52 HCA2 0.090 9
+ O5 OC311 -0.650 10
+ HO5 HCP1 0.420 11
+ C2 CC3251 -0.180 12
+ H21 HCA2 0.090 13
+ H22 HCA2 0.090 14
+ C3 CC3151 0.140 15
+ H3 HCA1 0.090 16
+ O3 OC311 -0.650 17
+ HO3 HCP1 0.420 18
+ [ bonds ]
+ O4 C1
+ C1 H1
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 O5
+ O5 HO5
+
+[ BDFD ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.240 6
+ HE1 HGR61 0.260 7
+ CE2 CG2R61 -0.240 8
+ HE2 HGR61 0.260 9
+ CZ CG2R61 -0.360 10
+ CF CG312 0.240 11
+ F1 FGA2 -0.280 12
+ F2 FGA2 -0.280 13
+ P1 PG2 2.000 14
+ O2 OG2P1 -1.120 15
+ O3 OG2P1 -1.120 16
+ O4 OG2P1 -1.120 17
+ [ bonds ]
+ CG CD1
+ CG CD2
+ CD1 CE1
+ CD2 CE2
+ CE1 CZ
+ CE2 CZ
+ CZ CF
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CF F1
+ CF F2
+ CF P1
+ P1 O2
+ P1 O3
+ P1 O4
+
+[ BDFP ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.210 6
+ HE1 HGR61 0.240 7
+ CE2 CG2R61 -0.210 8
+ HE2 HGR61 0.240 9
+ CZ CG2R61 -0.400 10
+ CF CG312 0.210 11
+ F1 FGA2 -0.170 12
+ F2 FGA2 -0.170 13
+ P1 PG1 1.430 14
+ O2 OG311 -0.720 15
+ H2 HGP1 0.360 16
+ O3 OG2P1 -0.800 17
+ O4 OG2P1 -0.800 18
+ [ bonds ]
+ CG CD1
+ CG CD2
+ CD1 CE1
+ CD2 CE2
+ CE1 CZ
+ CE2 CZ
+ CZ CF
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CF F1
+ CF F2
+ CF P1
+ P1 O2
+ P1 O3
+ P1 O4
+ O2 H2
+
+[ BENZ ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ CG2R61 -0.115 10
+ HZ HGR61 0.115 11
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ HZ
+
+[ BEON ]
+ [ atoms ]
+ C1 CG331 -0.230 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG2O5 0.380 4
+ O2 OG2D3 -0.460 5
+ C3 CG2DC1 -0.110 6
+ H3 HGA4 0.150 7
+ C4 CG2DC3 -0.420 8
+ H41 HGA5 0.210 9
+ H42 HGA5 0.210 10
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 O2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H41
+ C4 H42
+ [ impropers ]
+ C2 C3 C1 O2
+
+[ BF6 ]
+ [ atoms ]
+ CG1 CG2R67 0.000 0
+ CG2 CG2R67 0.000 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ1 CG2R61 0.000 10
+ CD3 CG2R61 -0.115 11
+ HD3 HGR61 0.115 12
+ CD4 CG2R61 -0.115 13
+ HD4 HGR61 0.115 14
+ CE3 CG2R61 -0.115 15
+ HE3 HGR61 0.115 16
+ CE4 CG2R61 -0.115 17
+ HE4 HGR61 0.115 18
+ CZ2 CG2R61 0.000 19
+ C1 CG2O5 0.380 20
+ O1 OG2D3 -0.480 21
+ C2 CG311 0.170 22
+ H2 HGA1 0.090 23
+ O2A OG311 -0.600 24
+ H2A HGP1 0.320 25
+ O2B OG312 -0.880 26
+ C3 CG2O5 0.380 27
+ O3 OG2D3 -0.480 28
+ C4 CG311 0.170 29
+ H4 HGA1 0.090 30
+ O4A OG311 -0.600 31
+ H4A HGP1 0.320 32
+ O4B OG312 -0.880 33
+ [ bonds ]
+ CD1 CG1
+ CG1 CD2
+ CG1 CG2
+ CD2 CE2
+ CE2 CZ1
+ CZ1 CE1
+ CE1 CD1
+ CG2 CD3
+ CD3 CE3
+ CE3 CZ2
+ CZ2 CE4
+ CE4 CD4
+ CD4 CG2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD3 HD3
+ CD4 HD4
+ CE3 HE3
+ CE4 HE4
+ CZ1 C1
+ C1 O1
+ C1 C2
+ C2 H2
+ C2 O2A
+ O2A H2A
+ C2 O2B
+ CZ2 C3
+ C3 O3
+ C3 C4
+ C4 H4
+ C4 O4A
+ O4A H4A
+ C4 O4B
+ [ impropers ]
+ C1 CZ1 C2 O1
+ C3 CZ2 C4 O3
+
+[ BF7 ]
+ [ atoms ]
+ CG1 CG2R67 0.000 0
+ CG2 CG2R67 0.000 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ1 CG2R61 0.000 10
+ CD3 CG2R61 -0.115 11
+ HD3 HGR61 0.115 12
+ CD4 CG2R61 -0.115 13
+ HD4 HGR61 0.115 14
+ CE3 CG2R61 -0.115 15
+ HE3 HGR61 0.115 16
+ CE4 CG2R61 -0.115 17
+ HE4 HGR61 0.115 18
+ CZ2 CG2R61 0.000 19
+ C1 CG2O5 0.380 20
+ O1 OG2D3 -0.480 21
+ C2 CG2O3 0.620 22
+ O2A OG2D2 -0.760 23
+ O2B OG2D2 -0.760 24
+ C3 CG2O5 0.380 25
+ O3 OG2D3 -0.480 26
+ C4 CG2O3 0.620 27
+ O4A OG2D2 -0.760 28
+ O4B OG2D2 -0.760 29
+ [ bonds ]
+ CD1 CG1
+ CG1 CD2
+ CG1 CG2
+ CD2 CE2
+ CE2 CZ1
+ CZ1 CE1
+ CE1 CD1
+ CG2 CD3
+ CD3 CE3
+ CE3 CZ2
+ CZ2 CE4
+ CE4 CD4
+ CD4 CG2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD3 HD3
+ CD4 HD4
+ CE3 HE3
+ CE4 HE4
+ CZ1 C1
+ CZ2 C3
+ C1 O1
+ C1 C2
+ C2 O2A
+ C2 O2B
+ C3 O3
+ C3 C4
+ C4 O4A
+ C4 O4B
+ [ impropers ]
+ C1 C2 CZ1 O1
+ C2 O2B O2A C1
+ C3 C4 CZ2 O3
+ C4 O4B O4A C3
+
+[ BFL ]
+ [ atoms ]
+ CG1 CG2R67 0.000 0
+ CG2 CG2R67 0.000 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ1 CG2R61 -0.115 10
+ HZ1 HGR61 0.115 11
+ CD3 CG2R61 -0.115 12
+ HD3 HGR61 0.115 13
+ CD4 CG2R61 -0.115 14
+ HD4 HGR61 0.115 15
+ CE3 CG2R61 -0.115 16
+ HE3 HGR61 0.115 17
+ CE4 CG2R61 -0.115 18
+ HE4 HGR61 0.115 19
+ CZ2 CG2R61 -0.115 20
+ HZ2 HGR61 0.115 21
+ [ bonds ]
+ CD1 CG1
+ CG1 CD2
+ CG1 CG2
+ CD2 CE2
+ CE2 CZ1
+ CZ1 CE1
+ CE1 CD1
+ CG2 CD3
+ CD3 CE3
+ CE3 CZ2
+ CZ2 CE4
+ CE4 CD4
+ CD4 CG2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD3 HD3
+ CD4 HD4
+ CE3 HE3
+ CE4 HE4
+ CZ1 HZ1
+ CZ2 HZ2
+
+[ BFRU ]
+ [ atoms ]
+ O5 OC3C51 -0.400 0
+ C2 CC3051 0.430 1
+ O2 OC311 -0.650 2
+ HO2 HCP1 0.420 3
+ C5 CC3153 0.110 4
+ H5 HCA1 0.090 5
+ C6 CC321 0.050 6
+ H61 HCA2 0.090 7
+ H62 HCA2 0.090 8
+ O6 OC311 -0.650 9
+ HO6 HCP1 0.420 10
+ C1 CC321 0.050 11
+ H11 HCA2 0.090 12
+ H12 HCA2 0.090 13
+ O1 OC311 -0.650 14
+ HO1 HCP1 0.420 15
+ C3 CC3151 0.140 16
+ H3 HCA1 0.090 17
+ O3 OC311 -0.650 18
+ HO3 HCP1 0.420 19
+ C4 CC3151 0.140 20
+ H4 HCA1 0.090 21
+ O4 OC311 -0.650 22
+ HO4 HCP1 0.420 23
+ [ bonds ]
+ O5 C2
+ C2 C1
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C5 O5
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C1 H11
+ C1 H12
+ C1 O1
+ O1 HO1
+
+[ BFUC ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC331 -0.270 19
+ H61 HCA3 0.090 20
+ H62 HCA3 0.090 21
+ H63 HCA3 0.090 22
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+ C5 O5
+
+[ BGAL ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ BGALNA ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.070 7
+ H2 HCA1 0.090 8
+ N NC2D1 -0.470 9
+ HN HCP1 0.310 10
+ C CC2O1 0.510 11
+ O OC2D1 -0.510 12
+ CT CC331 -0.270 13
+ HT1 HCA3 0.090 14
+ HT2 HCA3 0.090 15
+ HT3 HCA3 0.090 16
+ C3 CC3161 0.140 17
+ H3 HCA1 0.090 18
+ O3 OC311 -0.650 19
+ HO3 HCP1 0.420 20
+ C4 CC3161 0.140 21
+ H4 HCA1 0.090 22
+ O4 OC311 -0.650 23
+ HO4 HCP1 0.420 24
+ C6 CC321 0.050 25
+ H61 HCA2 0.090 26
+ H62 HCA2 0.090 27
+ O6 OC311 -0.650 28
+ HO6 HCP1 0.420 29
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 N
+ N HN
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ N C
+ C O
+ C CT
+ CT HT1
+ CT HT2
+ CT HT3
+ [ impropers ]
+ C CT N O
+ N C C2 HN
+
+[ BGLC ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ BGLCA ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC2O2 0.520 19
+ O61 OC2D2 -0.760 20
+ O62 OC2D2 -0.760 21
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 O61
+ C6 O62
+ C5 O5
+ [ impropers ]
+ C6 C5 O62 O61
+
+[ BGLCA0 ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC2O2 0.000 19
+ O61 OC2D2 0.000 20
+ O62 OC2D2 0.000 21
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 O61
+ C6 O62
+ C5 O5
+ [ impropers ]
+ C6 C5 O62 O61
+
+[ BGLCN0 ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 -0.090 7
+ H2 HCA1 0.090 8
+ N NC2D1 0.000 9
+ HN HCP1 0.000 10
+ C CC2O1 0.000 11
+ O OC2D1 0.000 12
+ CT CC331 -0.270 13
+ HT1 HCA3 0.090 14
+ HT2 HCA3 0.090 15
+ HT3 HCA3 0.090 16
+ C3 CC3161 0.140 17
+ H3 HCA1 0.090 18
+ O3 OC311 -0.650 19
+ HO3 HCP1 0.420 20
+ C4 CC3161 0.140 21
+ H4 HCA1 0.090 22
+ O4 OC311 -0.650 23
+ HO4 HCP1 0.420 24
+ C6 CC321 0.050 25
+ H61 HCA2 0.090 26
+ H62 HCA2 0.090 27
+ O6 OC311 -0.650 28
+ HO6 HCP1 0.420 29
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 N
+ N HN
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ N C
+ C O
+ C CT
+ CT HT1
+ CT HT2
+ CT HT3
+ [ impropers ]
+ C CT N O
+ N C C2 HN
+
+[ BGLCNA ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.070 7
+ H2 HCA1 0.090 8
+ N NC2D1 -0.470 9
+ HN HCP1 0.310 10
+ C CC2O1 0.510 11
+ O OC2D1 -0.510 12
+ CT CC331 -0.270 13
+ HT1 HCA3 0.090 14
+ HT2 HCA3 0.090 15
+ HT3 HCA3 0.090 16
+ C3 CC3161 0.140 17
+ H3 HCA1 0.090 18
+ O3 OC311 -0.650 19
+ HO3 HCP1 0.420 20
+ C4 CC3161 0.140 21
+ H4 HCA1 0.090 22
+ O4 OC311 -0.650 23
+ HO4 HCP1 0.420 24
+ C6 CC321 0.050 25
+ H61 HCA2 0.090 26
+ H62 HCA2 0.090 27
+ O6 OC311 -0.650 28
+ HO6 HCP1 0.420 29
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 N
+ N HN
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ N C
+ C O
+ C CT
+ CT HT1
+ CT HT2
+ CT HT3
+ [ impropers ]
+ C CT N O
+ N C C2 HN
+
+[ BGUL ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ BIDO ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ BIDOA ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC2O2 0.520 19
+ O61 OC2D2 -0.760 20
+ O62 OC2D2 -0.760 21
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 O61
+ C6 O62
+ C5 O5
+
+[ BLYF ]
+ [ atoms ]
+ O4 OC3C51 -0.400 0
+ C1 CC3152 0.340 1
+ H1 HCA1 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C4 CC3153 0.110 5
+ H4 HCA1 0.090 6
+ C5 CC321 0.050 7
+ H51 HCA2 0.090 8
+ H52 HCA2 0.090 9
+ O5 OC311 -0.650 10
+ HO5 HCP1 0.420 11
+ C2 CC3151 0.140 12
+ H2 HCA1 0.090 13
+ O2 OC311 -0.650 14
+ HO2 HCP1 0.420 15
+ C3 CC3151 0.140 16
+ H3 HCA1 0.090 17
+ O3 OC311 -0.650 18
+ HO3 HCP1 0.420 19
+ [ bonds ]
+ O4 C1
+ C1 H1
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 C5
+ C4 O4
+ C5 H51
+ C5 H52
+ C5 O5
+ O5 HO5
+
+[ BMAN ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ BMPD ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.240 6
+ HE1 HGR61 0.260 7
+ CE2 CG2R61 -0.240 8
+ HE2 HGR61 0.260 9
+ CZ CG2R61 -0.450 10
+ CH CG321 -0.280 11
+ HH1 HGA2 0.090 12
+ HH2 HGA2 0.090 13
+ P1 PG2 1.900 14
+ O2 OG2P1 -1.130 15
+ O3 OG2P1 -1.130 16
+ O4 OG2P1 -1.130 17
+ [ bonds ]
+ CG CD1
+ CG CD2
+ CD1 CE1
+ CD2 CE2
+ CE1 CZ
+ CE2 CZ
+ CZ CH
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CH HH1
+ CH HH2
+ CH P1
+ P1 O2
+ P1 O3
+ P1 O4
+
+[ BMPH ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.210 6
+ HE1 HGR61 0.240 7
+ CE2 CG2R61 -0.210 8
+ HE2 HGR61 0.240 9
+ CZ CG2R61 -0.440 10
+ CH CG321 -0.180 11
+ HH1 HGA2 0.090 12
+ HH2 HGA2 0.090 13
+ P1 PG1 1.530 14
+ O2 OG311 -0.790 15
+ H2 HGP1 0.360 16
+ O3 OG2P1 -0.860 17
+ O4 OG2P1 -0.860 18
+ [ bonds ]
+ CG CD1
+ CG CD2
+ CD1 CE1
+ CD2 CE2
+ CE1 CZ
+ CE2 CZ
+ CZ CH
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CH HH1
+ CH HH2
+ CH P1
+ P1 O2
+ P1 O3
+ P1 O4
+ O2 H2
+
+[ BNE5AC ]
+ [ atoms ]
+ C1 CC2O2 0.300 0
+ O11 OC2D2 -0.600 1
+ O12 OC2D2 -0.600 2
+ C2 CC3062 0.330 3
+ O2 OC311 -0.650 4
+ HO2 HCP1 0.420 5
+ C6 CC3163 0.110 6
+ H6 HCA1 0.090 7
+ O6 OC3C61 -0.400 8
+ C3 CC3261 -0.180 9
+ H31 HCA2 0.090 10
+ H32 HCA2 0.090 11
+ C4 CC3161 0.140 12
+ H4 HCA1 0.090 13
+ O4 OC311 -0.650 14
+ HO4 HCP1 0.420 15
+ C5 CC3161 0.070 16
+ H5 HCA1 0.090 17
+ N NC2D1 -0.470 18
+ HN HCP1 0.310 19
+ C CC2O1 0.510 20
+ O OC2D1 -0.510 21
+ CT CC331 -0.270 22
+ HT1 HCA3 0.090 23
+ HT2 HCA3 0.090 24
+ HT3 HCA3 0.090 25
+ C7 CC312 0.140 26
+ H7 HCA1 0.090 27
+ O7 OC311 -0.650 28
+ HO7 HCP1 0.420 29
+ C8 CC312 0.140 30
+ H8 HCA1 0.090 31
+ O8 OC311 -0.650 32
+ HO8 HCP1 0.420 33
+ C9 CC322 0.050 34
+ H91 HCA2 0.090 35
+ H92 HCA2 0.090 36
+ O9 OC311 -0.650 37
+ HO9 HCP1 0.420 38
+ [ bonds ]
+ C1 O11
+ C1 O12
+ C2 O2
+ C2 C1
+ O2 HO2
+ C2 O6
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 N
+ N HN
+ N C
+ C O
+ C CT
+ CT HT1
+ CT HT2
+ CT HT3
+ C5 C6
+ C6 H6
+ C6 C7
+ C7 O7
+ C7 H7
+ C6 O6
+ O7 HO7
+ C7 C8
+ C8 H8
+ C8 O8
+ O8 HO8
+ C8 C9
+ C9 H91
+ C9 H92
+ C9 O9
+ O9 HO9
+ [ impropers ]
+ C CT N O
+ N C C5 HN
+
+[ BPET ]
+ [ atoms ]
+ C1 CG331 -0.170 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ O2 OG303 -0.570 4
+ P3 PG1 1.500 5
+ O31 OG2P1 -0.780 6
+ O32 OG2P1 -0.780 7
+ O4 OG303 -0.570 8
+ C5 CG321 -0.080 9
+ H51 HGA2 0.090 10
+ H52 HGA2 0.090 11
+ C6 CG321 -0.080 12
+ H61 HGA2 0.090 13
+ H62 HGA2 0.090 14
+ O7 OG303 -0.570 15
+ P8 PG1 1.500 16
+ O81 OG2P1 -0.780 17
+ O82 OG2P1 -0.780 18
+ O9 OG303 -0.570 19
+ C10 CG331 -0.170 20
+ H101 HGA3 0.090 21
+ H102 HGA3 0.090 22
+ H103 HGA3 0.090 23
+ [ bonds ]
+ C1 O2
+ O2 P3
+ P3 O4
+ O4 C5
+ C5 C6
+ C6 O7
+ O7 P8
+ P8 O9
+ O9 C10
+ P3 O31
+ P3 O32
+ P8 O81
+ P8 O82
+ C1 H11
+ C1 H12
+ C1 H13
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+ C10 H101
+ C10 H102
+ C10 H103
+
+[ BPIP ]
+ [ atoms ]
+ CB CG324 0.150 0
+ HB1 HGA2 0.090 1
+ HB2 HGA2 0.090 2
+ N1 NG3P1 -0.400 3
+ H1 HGP2 0.320 4
+ C2 CG324 0.150 5
+ H21 HGA2 0.090 6
+ H22 HGA2 0.090 7
+ C6 CG324 0.150 8
+ H61 HGA2 0.090 9
+ H62 HGA2 0.090 10
+ C3 CG321 -0.180 11
+ H31 HGA2 0.090 12
+ H32 HGA2 0.090 13
+ C4 CG321 -0.180 14
+ H41 HGA2 0.090 15
+ H42 HGA2 0.090 16
+ C5 CG321 -0.180 17
+ H51 HGA2 0.090 18
+ H52 HGA2 0.090 19
+ CZ CG2R61 0.090 20
+ CD1 CG2R61 -0.115 21
+ HD1 HGR61 0.115 22
+ CD2 CG2R61 -0.115 23
+ HD2 HGR61 0.115 24
+ CE1 CG2R61 -0.115 25
+ HE1 HGR61 0.115 26
+ CE2 CG2R61 -0.115 27
+ HE2 HGR61 0.115 28
+ CP CG2R61 -0.115 29
+ HP HGR61 0.115 30
+ [ bonds ]
+ N1 H1
+ N1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 N1
+ N1 CB
+ CB HB1
+ CB HB2
+ CB CZ
+ CZ CD1
+ CD1 HD1
+ CD1 CE1
+ CE1 HE1
+ CZ CD2
+ CD2 HD2
+ CD2 CE2
+ CE2 HE2
+ CE1 CP
+ CP HP
+ CP CE2
+
+[ BPNP ]
+ [ atoms ]
+ C2 CG3C51 0.010 0
+ H21 HGA1 0.090 1
+ O3' OG303 -0.570 2
+ P PG1 1.500 3
+ O1P OG2P1 -0.780 4
+ O2P OG2P1 -0.780 5
+ O5' OG303 -0.570 6
+ C5' CG331 -0.170 7
+ H51' HGA3 0.090 8
+ H52' HGA3 0.090 9
+ H53' HGA3 0.090 10
+ C4 CG3C52 -0.180 11
+ H41 HGA2 0.090 12
+ H42 HGA2 0.090 13
+ C3 CG3C52 -0.180 14
+ H31 HGA2 0.090 15
+ H32 HGA2 0.090 16
+ C1 CG3RC1 -0.090 17
+ H11 HGA1 0.090 18
+ C5 CG3RC1 -0.090 19
+ H51 HGA1 0.090 20
+ C6 CG3C31 -0.180 21
+ H61 HGA2 0.090 22
+ H62 HGA2 0.090 23
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C1
+ C5 C6
+ C6 C1
+ C5 H51
+ C2 H21
+ C4 H42
+ C3 H31
+ C3 H32
+ C4 H41
+ C6 H61
+ C1 H11
+ C6 H62
+ C2 O3'
+ O3' P
+ P O1P
+ P O2P
+ P O5'
+ O5' C5'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+
+[ BPSP ]
+ [ atoms ]
+ C1 CG3RC1 -0.090 0
+ H11 HGA1 0.090 1
+ C2 CG3C52 -0.180 2
+ H21 HGA2 0.090 3
+ H22 HGA2 0.090 4
+ C6 CG3C31 -0.180 5
+ H61 HGA2 0.090 6
+ H62 HGA2 0.090 7
+ C4 CG3C52 -0.180 8
+ H41 HGA2 0.090 9
+ H42 HGA2 0.090 10
+ C5 CG3RC1 -0.090 11
+ H51 HGA1 0.090 12
+ C3 CG3C51 0.010 13
+ H31 HGA1 0.090 14
+ O3' OG303 -0.570 15
+ P PG1 1.500 16
+ O1P OG2P1 -0.780 17
+ O2P OG2P1 -0.780 18
+ O5' OG303 -0.570 19
+ C5' CG331 -0.170 20
+ H51' HGA3 0.090 21
+ H52' HGA3 0.090 22
+ H53' HGA3 0.090 23
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C1
+ C5 C6
+ C6 C1
+ C4 H42
+ C1 H11
+ C2 H21
+ C2 H22
+ C6 H61
+ C6 H62
+ C4 H41
+ C5 H51
+ C3 H31
+ C3 O3'
+ O3' P
+ P O1P
+ P O2P
+ P O5'
+ O5' C5'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+
+[ BRET ]
+ [ atoms ]
+ C1 CG321 0.070 0
+ BR11 BRGA1 -0.100 1
+ H12 HGA2 0.140 2
+ H13 HGA2 0.140 3
+ C2 CG331 -0.520 4
+ H21 HGA3 0.090 5
+ H22 HGA3 0.090 6
+ H23 HGA3 0.090 7
+ [ bonds ]
+ C1 BR11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ BRHM ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC331 -0.270 19
+ H61 HCA3 0.090 20
+ H62 HCA3 0.090 21
+ H63 HCA3 0.090 22
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+ C5 O5
+
+[ BRIB ]
+ [ atoms ]
+ O4 OC3C51 -0.400 0
+ C1 CC3152 0.340 1
+ H1 HCA1 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C4 CC3153 0.110 5
+ H4 HCA1 0.090 6
+ C5 CC321 0.050 7
+ H51 HCA2 0.090 8
+ H52 HCA2 0.090 9
+ O5 OC311 -0.650 10
+ HO5 HCP1 0.420 11
+ C2 CC3151 0.140 12
+ H2 HCA1 0.090 13
+ O2 OC311 -0.650 14
+ HO2 HCP1 0.420 15
+ C3 CC3151 0.140 16
+ H3 HCA1 0.090 17
+ O3 OC311 -0.650 18
+ HO3 HCP1 0.420 19
+ [ bonds ]
+ O4 C1
+ C1 H1
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 C5
+ C4 O4
+ C5 H51
+ C5 H52
+ C5 O5
+ O5 HO5
+
+[ BROB ]
+ [ atoms ]
+ C1 CG2R61 -0.060 0
+ H1 HGR62 0.150 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 -0.060 8
+ H5 HGR62 0.150 9
+ C6 CG2R61 -0.080 10
+ BR BRGR1 -0.100 11
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 C1
+ C6 BR
+
+[ BSAM ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CE1 CG2R61 -0.115 4
+ HE1 HGR61 0.115 5
+ CD2 CG2R61 -0.115 6
+ HD2 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ CG2R61 0.240 10
+ S1 SG3O2 0.610 11
+ O11 OG2P1 -0.420 12
+ O12 OG2P1 -0.420 13
+ N2 NG321 -0.770 14
+ H21 HGP1 0.380 15
+ H22 HGP1 0.380 16
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ S1
+ S1 N2
+ S1 O11
+ S1 O12
+ N2 H21
+ N2 H22
+
+[ BSAT ]
+ [ atoms ]
+ S SG3O1 1.350 0
+ O1 OG2P1 -0.650 1
+ O2 OG2P1 -0.650 2
+ O3 OG2P1 -0.650 3
+ CA1 CG2R61 -0.400 4
+ CA2 CG2R61 -0.210 5
+ HA2 HGR61 0.210 6
+ CA3 CG2R61 -0.115 7
+ HA3 HGR61 0.115 8
+ CA4 CG2R61 -0.115 9
+ HA4 HGR61 0.115 10
+ CA5 CG2R61 -0.115 11
+ HA5 HGR61 0.115 12
+ CA6 CG2R61 -0.210 13
+ HA6 HGR61 0.210 14
+ [ bonds ]
+ S O1
+ S O2
+ S O3
+ S CA1
+ CA1 CA2
+ CA2 HA2
+ CA3 HA3
+ CA3 CA4
+ CA4 HA4
+ CA5 HA5
+ CA5 CA6
+ CA6 HA6
+ CA6 CA1
+ CA4 CA5
+ CA2 CA3
+
+[ BTAL ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3163 0.110 4
+ H5 HCA1 0.090 5
+ O5 OC3C61 -0.400 6
+ C2 CC3161 0.140 7
+ H2 HCA1 0.090 8
+ O2 OC311 -0.650 9
+ HO2 HCP1 0.420 10
+ C3 CC3161 0.140 11
+ H3 HCA1 0.090 12
+ O3 OC311 -0.650 13
+ HO3 HCP1 0.420 14
+ C4 CC3161 0.140 15
+ H4 HCA1 0.090 16
+ O4 OC311 -0.650 17
+ HO4 HCP1 0.420 18
+ C6 CC321 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+
+[ BTE1 ]
+ [ atoms ]
+ C1 CG2D2 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2D1 -0.150 3
+ H21 HGA4 0.150 4
+ C3 CG321 -0.180 5
+ H31 HGA2 0.090 6
+ H32 HGA2 0.090 7
+ C4 CG331 -0.270 8
+ H41 HGA3 0.090 9
+ H42 HGA3 0.090 10
+ H43 HGA3 0.090 11
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 H43
+ C1 C2
+
+[ BTE2 ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG2D1 -0.150 4
+ H21 HGA4 0.150 5
+ C3 CG2D1 -0.150 6
+ H31 HGA4 0.150 7
+ C4 CG331 -0.270 8
+ H41 HGA3 0.090 9
+ H42 HGA3 0.090 10
+ H43 HGA3 0.090 11
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 H21
+ C3 H31
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 H43
+ C2 C3
+
+[ BTON ]
+ [ atoms ]
+ O1 OG2D3 -0.480 0
+ C1 CG2O5 0.400 1
+ C2 CG331 -0.230 2
+ C3 CG321 -0.140 3
+ H21 HGA3 0.090 4
+ H22 HGA3 0.090 5
+ H23 HGA3 0.090 6
+ H31 HGA2 0.090 7
+ H32 HGA2 0.090 8
+ C4 CG331 -0.270 9
+ H41 HGA3 0.090 10
+ H42 HGA3 0.090 11
+ H43 HGA3 0.090 12
+ [ bonds ]
+ C1 C2
+ C1 C3
+ C3 C4
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C4 H43
+ O1 C1
+ [ impropers ]
+ C1 C3 C2 O1
+
+[ BUTA ]
+ [ atoms ]
+ H11 HCA3A 0.090 0
+ H12 HCA3A 0.090 1
+ H13 HCA3A 0.090 2
+ C1 CC33A -0.270 3
+ H21 HCA2A 0.090 4
+ H22 HCA2A 0.090 5
+ C2 CC32A -0.180 6
+ H31 HCA2A 0.090 7
+ H32 HCA2A 0.090 8
+ C3 CC32A -0.180 9
+ H41 HCA3A 0.090 10
+ H42 HCA3A 0.090 11
+ H43 HCA3A 0.090 12
+ C4 CC33A -0.270 13
+ [ bonds ]
+ h11 c1
+ h12 c1
+ h13 c1
+ c1 c2
+ h21 c2
+ h22 c2
+ c2 c3
+ h31 c3
+ h32 c3
+ c3 c4
+ h41 c4
+ h42 c4
+ h43 c4
+
+[ BXYF ]
+ [ atoms ]
+ O4 OC3C51 -0.400 0
+ C1 CC3152 0.340 1
+ H1 HCA1 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C4 CC3153 0.110 5
+ H4 HCA1 0.090 6
+ C5 CC321 0.050 7
+ H51 HCA2 0.090 8
+ H52 HCA2 0.090 9
+ O5 OC311 -0.650 10
+ HO5 HCP1 0.420 11
+ C2 CC3151 0.140 12
+ H2 HCA1 0.090 13
+ O2 OC311 -0.650 14
+ HO2 HCP1 0.420 15
+ C3 CC3151 0.140 16
+ H3 HCA1 0.090 17
+ O3 OC311 -0.650 18
+ HO3 HCP1 0.420 19
+ [ bonds ]
+ O4 C1
+ C1 H1
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 C5
+ C4 O4
+ C5 H51
+ C5 H52
+ C5 O5
+ O5 HO5
+
+[ BXYL ]
+ [ atoms ]
+ C1 CC3162 0.340 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3263 0.020 4
+ H51 HCA2 0.090 5
+ H52 HCA2 0.090 6
+ O5 OC3C61 -0.400 7
+ C2 CC3161 0.140 8
+ H2 HCA1 0.090 9
+ O2 OC311 -0.650 10
+ HO2 HCP1 0.420 11
+ C3 CC3161 0.140 12
+ H3 HCA1 0.090 13
+ O3 OC311 -0.650 14
+ HO3 HCP1 0.420 15
+ C4 CC3161 0.140 16
+ H4 HCA1 0.090 17
+ O4 OC311 -0.650 18
+ HO4 HCP1 0.420 19
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 O5
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 O5
+
+[ C3 ]
+ [ atoms ]
+ C1 CG3C31 -0.180 0
+ H11 HGA2 0.090 1
+ H12 HGA2 0.090 2
+ C2 CG3C31 -0.180 3
+ H21 HGA2 0.090 4
+ H22 HGA2 0.090 5
+ C3 CG3C31 -0.180 6
+ H31 HGA2 0.090 7
+ H32 HGA2 0.090 8
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C1
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+
+[ C36 ]
+ [ atoms ]
+ CG1 CG2R61 0.215 0
+ O OG301 -0.430 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ1 CG2R61 0.000 10
+ CG2 CG2R61 0.215 11
+ CD3 CG2R61 -0.115 12
+ HD3 HGR61 0.115 13
+ CD4 CG2R61 -0.115 14
+ HD4 HGR61 0.115 15
+ CE3 CG2R61 -0.115 16
+ HE3 HGR61 0.115 17
+ CE4 CG2R61 -0.115 18
+ HE4 HGR61 0.115 19
+ CZ2 CG2R61 0.000 20
+ C1 CG2O5 0.380 21
+ O1 OG2D3 -0.480 22
+ C2 CG311 0.170 23
+ H2 HGA1 0.090 24
+ O2A OG311 -0.600 25
+ H2A HGP1 0.320 26
+ O2B OG312 -0.880 27
+ C3 CG2O5 0.380 28
+ O3 OG2D3 -0.480 29
+ C4 CG311 0.170 30
+ H4 HGA1 0.090 31
+ O4A OG311 -0.600 32
+ H4A HGP1 0.320 33
+ O4B OG312 -0.880 34
+ [ bonds ]
+ CD1 CG1
+ CG1 CD2
+ CG1 O
+ CD2 CE2
+ CE2 CZ1
+ CZ1 CE1
+ CE1 CD1
+ CG2 CD3
+ CD3 CE3
+ CE3 CZ2
+ CZ2 CE4
+ CE4 CD4
+ CD4 CG2
+ CG2 O
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD3 HD3
+ CD4 HD4
+ CE3 HE3
+ CE4 HE4
+ CZ1 C1
+ C1 O1
+ C1 C2
+ C2 H2
+ C2 O2A
+ O2A H2A
+ C2 O2B
+ CZ2 C3
+ C3 O3
+ C3 C4
+ C4 H4
+ C4 O4A
+ O4A H4A
+ C4 O4B
+ [ impropers ]
+ C1 CZ1 C2 O1
+ C3 CZ2 C4 O3
+
+[ C37 ]
+ [ atoms ]
+ CG1 CG2R61 0.215 0
+ O OG301 -0.430 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ1 CG2R61 0.000 10
+ CG2 CG2R61 0.215 11
+ CD3 CG2R61 -0.115 12
+ HD3 HGR61 0.115 13
+ CD4 CG2R61 -0.115 14
+ HD4 HGR61 0.115 15
+ CE3 CG2R61 -0.115 16
+ HE3 HGR61 0.115 17
+ CE4 CG2R61 -0.115 18
+ HE4 HGR61 0.115 19
+ CZ2 CG2R61 0.000 20
+ C1 CG2O5 0.380 21
+ O1 OG2D3 -0.480 22
+ C2 CG2O3 0.620 23
+ O2A OG2D2 -0.760 24
+ O2B OG2D2 -0.760 25
+ C3 CG2O5 0.380 26
+ O3 OG2D3 -0.480 27
+ C4 CG2O3 0.620 28
+ O4A OG2D2 -0.760 29
+ O4B OG2D2 -0.760 30
+ [ bonds ]
+ CD1 CG1
+ CG1 CD2
+ CG1 O
+ CD2 CE2
+ CE2 CZ1
+ CZ1 CE1
+ CE1 CD1
+ CG2 CD3
+ CD3 CE3
+ CE3 CZ2
+ CZ2 CE4
+ CE4 CD4
+ CD4 CG2
+ CG2 O
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD3 HD3
+ CD4 HD4
+ CE3 HE3
+ CE4 HE4
+ CZ1 C1
+ C1 O1
+ C1 C2
+ C2 O2A
+ C2 O2B
+ CZ2 C3
+ C3 O3
+ C3 C4
+ C4 O4A
+ C4 O4B
+ [ impropers ]
+ C1 C2 CZ1 O1
+ C2 O2B O2A C1
+ C3 C4 CZ2 O3
+ C4 O4B O4A C3
+
+[ C3C ]
+ [ atoms ]
+ CG1 CG2R61 0.215 0
+ O OG301 -0.430 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ1 CG2R61 -0.100 10
+ CG2 CG2R61 0.215 11
+ CD3 CG2R61 -0.115 12
+ HD3 HGR61 0.115 13
+ CD4 CG2R61 -0.115 14
+ HD4 HGR61 0.115 15
+ CE3 CG2R61 -0.115 16
+ HE3 HGR61 0.115 17
+ CE4 CG2R61 -0.115 18
+ HE4 HGR61 0.115 19
+ CZ2 CG2R61 -0.100 20
+ C1 CG2O3 0.620 21
+ O1A OG2D2 -0.760 22
+ O1B OG2D2 -0.760 23
+ C2 CG2O3 0.620 24
+ O2A OG2D2 -0.760 25
+ O2B OG2D2 -0.760 26
+ [ bonds ]
+ CD1 CG1
+ CG1 CD2
+ CG1 O
+ CD2 CE2
+ CE2 CZ1
+ CZ1 CE1
+ CE1 CD1
+ CG2 CD3
+ CD3 CE3
+ CE3 CZ2
+ CZ2 CE4
+ CE4 CD4
+ CD4 CG2
+ CG2 O
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CD3 HD3
+ CD4 HD4
+ CE3 HE3
+ CE4 HE4
+ CZ1 C1
+ C1 O1A
+ C1 O1B
+ CZ2 C2
+ C2 O2A
+ C2 O2B
+ [ impropers ]
+ C1 O1B O1A CZ1
+ C2 O2B O2A CZ2
+
+[ CA ]
+ [ atoms ]
+ C3 CG311 0.140 0
+ O3 OG311 -0.650 1
+ H3' HGP1 0.420 2
+ H3 HGA1 0.090 3
+ C4 CG321 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CG311 -0.090 7
+ H5 HGA1 0.090 8
+ C6 CG321 -0.180 9
+ H6A HGA2 0.090 10
+ H6B HGA2 0.090 11
+ C7 CG311 0.140 12
+ O7 OG311 -0.650 13
+ H7' HGP1 0.420 14
+ H7 HGA1 0.090 15
+ C8 CG311 -0.090 16
+ H8 HGA1 0.090 17
+ C14 CG3RC1 -0.090 18
+ H14 HGA1 0.090 19
+ C15 CG3C52 -0.180 20
+ H15A HGA2 0.090 21
+ H15B HGA2 0.090 22
+ C16 CG3C52 -0.180 23
+ H16A HGA2 0.090 24
+ H16B HGA2 0.090 25
+ C17 CG3C51 -0.090 26
+ H17 HGA1 0.090 27
+ C13 CG3RC1 0.000 28
+ C18 CG331 -0.270 29
+ H18A HGA3 0.090 30
+ H18B HGA3 0.090 31
+ H18C HGA3 0.090 32
+ C12 CG311 0.140 33
+ H12 HGA1 0.090 34
+ O12 OG311 -0.650 35
+ H12' HGP1 0.420 36
+ C11 CG321 -0.180 37
+ H11A HGA2 0.090 38
+ H11B HGA2 0.090 39
+ C9 CG311 -0.090 40
+ H9 HGA1 0.090 41
+ C10 CG301 0.000 42
+ C19 CG331 -0.270 43
+ H19A HGA3 0.090 44
+ H19B HGA3 0.090 45
+ H19C HGA3 0.090 46
+ C1 CG321 -0.180 47
+ H1A HGA2 0.090 48
+ H1B HGA2 0.090 49
+ C2 CG321 -0.180 50
+ H2A HGA2 0.090 51
+ H2B HGA2 0.090 52
+ C20 CG311 -0.090 53
+ H20 HGA1 0.090 54
+ C21 CG331 -0.270 55
+ H21A HGA3 0.090 56
+ H21B HGA3 0.090 57
+ H21C HGA3 0.090 58
+ C22 CG321 -0.180 59
+ H22A HGA2 0.090 60
+ H22B HGA2 0.090 61
+ C23 CG321 -0.180 62
+ H23A HGA2 0.090 63
+ H23B HGA2 0.090 64
+ CD CG2O3 0.520 65
+ OE1 OG2D2 -0.760 66
+ OE2 OG2D2 -0.760 67
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 H3'
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5
+ C5 C10
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C10 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C7
+ C7 H7
+ C7 O7
+ O7 H7'
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C13 C12
+ C12 H12
+ C12 O12
+ O12 H12'
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 CD
+ CD OE1
+ CD OE2
+ [ impropers ]
+ CD OE2 OE1 C23
+
+[ CAL ]
+ [ atoms ]
+ CAL CAL 2.000 0
+
+[ CALD ]
+ [ atoms ]
+ O OG2D1 -0.400 0
+ C CG2O4 0.200 1
+ CB CG321 -0.030 2
+ HB1 HGA2 0.090 3
+ HB2 HGA2 0.090 4
+ CL CLGA1 -0.040 5
+ HA HGR52 0.090 6
+ [ bonds ]
+ HA C
+ C CB
+ CB HB1
+ CB HB2
+ CB CL
+ C O
+ [ impropers ]
+ C CB O HA
+
+[ CBU ]
+ [ atoms ]
+ C1 CG3C41 -0.180 0
+ H11 HGA2 0.090 1
+ H12 HGA2 0.090 2
+ C2 CG3C41 -0.180 3
+ H21 HGA2 0.090 4
+ H22 HGA2 0.090 5
+ C3 CG3C41 -0.180 6
+ H31 HGA2 0.090 7
+ H32 HGA2 0.090 8
+ C4 CG3C41 -0.180 9
+ H41 HGA2 0.090 10
+ H42 HGA2 0.090 11
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C1
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+
+[ CD2 ]
+ [ atoms ]
+ CD CAD 2.000 0
+
+[ CDCA ]
+ [ atoms ]
+ C3 CG311 0.140 0
+ O3 OG311 -0.650 1
+ H3' HGP1 0.420 2
+ H3 HGA1 0.090 3
+ C4 CG321 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CG311 -0.090 7
+ H5 HGA1 0.090 8
+ C6 CG321 -0.180 9
+ H6A HGA2 0.090 10
+ H6B HGA2 0.090 11
+ C7 CG311 0.140 12
+ O7 OG311 -0.650 13
+ H7' HGP1 0.420 14
+ H7 HGA1 0.090 15
+ C8 CG311 -0.090 16
+ H8 HGA1 0.090 17
+ C14 CG3RC1 -0.090 18
+ H14 HGA1 0.090 19
+ C15 CG3C52 -0.180 20
+ H15A HGA2 0.090 21
+ H15B HGA2 0.090 22
+ C16 CG3C52 -0.180 23
+ H16A HGA2 0.090 24
+ H16B HGA2 0.090 25
+ C17 CG3C51 -0.090 26
+ H17 HGA1 0.090 27
+ C13 CG3RC1 0.000 28
+ C18 CG331 -0.270 29
+ H18A HGA3 0.090 30
+ H18B HGA3 0.090 31
+ H18C HGA3 0.090 32
+ C12 CG321 -0.180 33
+ H12A HGA2 0.090 34
+ H12B HGA2 0.090 35
+ C11 CG321 -0.180 36
+ H11A HGA2 0.090 37
+ H11B HGA2 0.090 38
+ C9 CG311 -0.090 39
+ H9 HGA1 0.090 40
+ C10 CG301 0.000 41
+ C19 CG331 -0.270 42
+ H19A HGA3 0.090 43
+ H19B HGA3 0.090 44
+ H19C HGA3 0.090 45
+ C1 CG321 -0.180 46
+ H1A HGA2 0.090 47
+ H1B HGA2 0.090 48
+ C2 CG321 -0.180 49
+ H2A HGA2 0.090 50
+ H2B HGA2 0.090 51
+ C20 CG311 -0.090 52
+ H20 HGA1 0.090 53
+ C21 CG331 -0.270 54
+ H21A HGA3 0.090 55
+ H21B HGA3 0.090 56
+ H21C HGA3 0.090 57
+ C22 CG321 -0.180 58
+ H22A HGA2 0.090 59
+ H22B HGA2 0.090 60
+ C23 CG321 -0.180 61
+ H23A HGA2 0.090 62
+ H23B HGA2 0.090 63
+ CD CG2O3 0.520 64
+ OE1 OG2D2 -0.760 65
+ OE2 OG2D2 -0.760 66
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 H3'
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5
+ C5 C10
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C10 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C7
+ C7 H7
+ C7 O7
+ O7 H7'
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C13 C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 CD
+ CD OE1
+ CD OE2
+ [ impropers ]
+ CD OE2 OE1 C23
+
+[ CES ]
+ [ atoms ]
+ CES CES 1.000 0
+
+[ CHEX ]
+ [ atoms ]
+ C1 CC32A -0.180 0
+ H1A HCA2A 0.090 1
+ H1B HCA2A 0.090 2
+ C2 CC32A -0.180 3
+ H2A HCA2A 0.090 4
+ H2B HCA2A 0.090 5
+ C3 CC32A -0.180 6
+ H3A HCA2A 0.090 7
+ H3B HCA2A 0.090 8
+ C4 CC32A -0.180 9
+ H4A HCA2A 0.090 10
+ H4B HCA2A 0.090 11
+ C5 CC32A -0.180 12
+ H5A HCA2A 0.090 13
+ H5B HCA2A 0.090 14
+ C6 CC32A -0.180 15
+ H6A HCA2A 0.090 16
+ H6B HCA2A 0.090 17
+ [ bonds ]
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C3 H3A
+ C3 H3B
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5A
+ C5 H5B
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C1
+
+[ CHL1 ]
+ [ atoms ]
+ C3 CRL1 0.140 0
+ O3 OHL -0.660 1
+ H3' HOL 0.430 2
+ H3 HGA1 0.090 3
+ C4 CRL2 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CEL1 0.000 7
+ C6 CEL1 -0.150 8
+ H6 HEL1 0.150 9
+ C7 CRL2 -0.180 10
+ H7A HGA2 0.090 11
+ H7B HGA2 0.090 12
+ C8 CRL1 -0.090 13
+ H8 HGA1 0.090 14
+ C14 CRL1 -0.090 15
+ H14 HGA1 0.090 16
+ C15 CRL2 -0.180 17
+ H15A HGA2 0.090 18
+ H15B HGA2 0.090 19
+ C16 CRL2 -0.180 20
+ H16A HGA2 0.090 21
+ H16B HGA2 0.090 22
+ C17 CRL1 -0.090 23
+ H17 HGA1 0.090 24
+ C13 CRL1 0.000 25
+ C18 CTL3 -0.270 26
+ H18A HAL3 0.090 27
+ H18B HAL3 0.090 28
+ H18C HAL3 0.090 29
+ C12 CRL2 -0.180 30
+ H12A HGA2 0.090 31
+ H12B HGA2 0.090 32
+ C11 CRL2 -0.180 33
+ H11A HGA2 0.090 34
+ H11B HGA2 0.090 35
+ C9 CRL1 -0.090 36
+ H9 HGA1 0.090 37
+ C10 CRL1 0.000 38
+ C19 CTL3 -0.270 39
+ H19A HAL3 0.090 40
+ H19B HAL3 0.090 41
+ H19C HAL3 0.090 42
+ C1 CRL2 -0.180 43
+ H1A HGA2 0.090 44
+ H1B HGA2 0.090 45
+ C2 CRL2 -0.180 46
+ H2A HGA2 0.090 47
+ H2B HGA2 0.090 48
+ C20 CTL1 -0.090 49
+ H20 HAL1 0.090 50
+ C21 CTL3 -0.270 51
+ H21A HAL3 0.090 52
+ H21B HAL3 0.090 53
+ H21C HAL3 0.090 54
+ C22 CTL2 -0.180 55
+ H22A HAL2 0.090 56
+ H22B HAL2 0.090 57
+ C23 CTL2 -0.180 58
+ H23A HAL2 0.090 59
+ H23B HAL2 0.090 60
+ C24 CTL2 -0.180 61
+ H24A HAL2 0.090 62
+ H24B HAL2 0.090 63
+ C25 CTL1 -0.090 64
+ H25 HAL1 0.090 65
+ C26 CTL3 -0.270 66
+ H26A HAL3 0.090 67
+ H26B HAL3 0.090 68
+ H26C HAL3 0.090 69
+ C27 CTL3 -0.270 70
+ H27A HAL3 0.090 71
+ H27B HAL3 0.090 72
+ H27C HAL3 0.090 73
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 H3'
+ C3 C2
+ C2 H2A
+ C2 H2B
+ C2 C1
+ C1 H1A
+ C1 H1B
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 C10
+ C10 C1
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C6 H6
+ C6 C7
+ C7 H7A
+ C7 H7B
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 C24
+ C24 H24A
+ C24 H24B
+ C24 C25
+ C25 H25
+ C25 C26
+ C26 H26A
+ C26 H26B
+ C26 H26C
+ C25 C27
+ C27 H27A
+ C27 H27B
+ C27 H27C
+ C5 C6
+
+[ CHLB ]
+ [ atoms ]
+ C1 CG2R61 -0.100 0
+ H1 HGR62 0.150 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 -0.100 8
+ H5 HGR62 0.150 9
+ C6 CG2R61 0.030 10
+ CL CLGR1 -0.130 11
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 C1
+ C6 CL
+
+[ CHM1 ]
+ [ atoms ]
+ C1 CRL1 0.140 0
+ O1 OHL -0.660 1
+ HO1 HOL 0.430 2
+ H1 HGA1 0.090 3
+ C2 CRL2 -0.180 4
+ H2 HGA2 0.090 5
+ H2' HGA2 0.090 6
+ C3 CEL1 0.000 7
+ C15 CRL1 0.000 8
+ C16 CRL2 -0.180 9
+ H16 HGA2 0.090 10
+ H16' HGA2 0.090 11
+ C17 CRL2 -0.180 12
+ H17 HGA2 0.090 13
+ H17' HGA2 0.090 14
+ CC15 CTL3 -0.270 15
+ H151 HAL3 0.090 16
+ H152 HAL3 0.090 17
+ H153 HAL3 0.090 18
+ C4 CEL1 -0.150 19
+ H4 HEL1 0.150 20
+ C5 CRL2 -0.180 21
+ H5 HGA2 0.090 22
+ H5' HGA2 0.090 23
+ C6 CRL2 -0.180 24
+ H6 HGA2 0.090 25
+ H6' HGA2 0.090 26
+ C14 CRL2 -0.180 27
+ H14 HGA2 0.090 28
+ H14' HGA2 0.090 29
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C15
+ C15 C16
+ C16 C17
+ C17 C1
+ C1 O1
+ O1 HO1
+ C1 H1
+ C2 H2
+ C2 H2'
+ C15 CC15
+ CC15 H151
+ CC15 H152
+ CC15 H153
+ C16 H16
+ C16 H16'
+ C17 H17
+ C17 H17'
+ C4 C5
+ C5 C6
+ C6 C14
+ C14 C15
+ C4 H4
+ C5 H5
+ C5 H5'
+ C6 H6
+ C6 H6'
+ C14 H14
+ C14 H14'
+ C3 C4
+
+[ CHNS ]
+ [ atoms ]
+ C1 CRL1 0.140 0
+ O1 OHL -0.660 1
+ HO1 HOL 0.430 2
+ H1 HGA1 0.090 3
+ C2 CRL2 -0.180 4
+ H2 HGA2 0.090 5
+ H2' HGA2 0.090 6
+ C3 CEL1 0.000 7
+ C4 CEL1 -0.150 8
+ H4 HEL1 0.150 9
+ C5 CRL2 -0.180 10
+ H5 HGA2 0.090 11
+ H5' HGA2 0.090 12
+ C6 CRL1 -0.090 13
+ H6 HGA1 0.090 14
+ C7 CRL1 -0.090 15
+ H7 HGA1 0.090 16
+ C8 CRL2 -0.180 17
+ H8 HGA2 0.090 18
+ H8' HGA2 0.090 19
+ C9 CRL2 -0.180 20
+ H9 HGA2 0.090 21
+ H9' HGA2 0.090 22
+ C10 CRL1 -0.090 23
+ H10 HGA1 0.090 24
+ C11 CRL1 0.000 25
+ Cc11 CTL3 -0.270 26
+ H111 HAL3 0.090 27
+ H112 HAL3 0.090 28
+ H113 HAL3 0.090 29
+ C12 CRL2 -0.180 30
+ H12 HGA2 0.090 31
+ H12' HGA2 0.090 32
+ C13 CRL2 -0.180 33
+ H13 HGA2 0.090 34
+ H13' HGA2 0.090 35
+ C14 CRL1 -0.090 36
+ H14 HGA1 0.090 37
+ C15 CRL1 0.000 38
+ CC15 CTL3 -0.270 39
+ H151 HAL3 0.090 40
+ H152 HAL3 0.090 41
+ H153 HAL3 0.090 42
+ C16 CRL2 -0.180 43
+ H16 HGA2 0.090 44
+ H16' HGA2 0.090 45
+ C17 CRL2 -0.180 46
+ H17 HGA2 0.090 47
+ H17' HGA2 0.090 48
+ C18 CTL3 -0.270 49
+ H181 HAL3 0.090 50
+ H182 HAL3 0.090 51
+ H183 HAL3 0.090 52
+ [ bonds ]
+ C1 O1
+ C1 H1
+ C1 C2
+ O1 HO1
+ C2 C3
+ C2 H2
+ C2 H2'
+ C4 C5
+ C4 H4
+ C5 C6
+ C5 H5
+ C5 H5'
+ C6 C7
+ C6 H6
+ C7 C8
+ C7 H7
+ C8 C9
+ C8 H8
+ C8 H8'
+ C9 C10
+ C9 H9
+ C9 H9'
+ C10 C18
+ C10 C11
+ C10 H10
+ C11 CC11
+ C11 C7
+ C11 C12
+ CC11 H111
+ CC11 H112
+ CC11 H113
+ C12 C13
+ C12 H12
+ C12 H12'
+ C13 C14
+ C13 H13
+ C13 H13'
+ C14 C15
+ C14 C6
+ C14 H14
+ C15 C16
+ C15 C3
+ C15 CC15
+ CC15 H151
+ CC15 H152
+ CC15 H153
+ C16 C17
+ C16 H16
+ C16 H16'
+ C17 C1
+ C17 H17
+ C17 H17'
+ C18 H181
+ C18 H182
+ C18 H183
+ C3 C4
+
+[ CHOL ]
+ [ atoms ]
+ N NG3P0 -0.600 0
+ C1 CG324 -0.100 1
+ C2 CG334 -0.350 2
+ C3 CG334 -0.350 3
+ C4 CG334 -0.350 4
+ H11 HGP5 0.250 5
+ H12 HGP5 0.250 6
+ H21 HGP5 0.250 7
+ H22 HGP5 0.250 8
+ H23 HGP5 0.250 9
+ H31 HGP5 0.250 10
+ H32 HGP5 0.250 11
+ H33 HGP5 0.250 12
+ H41 HGP5 0.250 13
+ H42 HGP5 0.250 14
+ H43 HGP5 0.250 15
+ C5 CG321 0.050 16
+ H51 HGA2 0.090 17
+ H52 HGA2 0.090 18
+ OH1 OG311 -0.650 19
+ HO1 HGP1 0.420 20
+ [ bonds ]
+ N C1
+ N C2
+ N C3
+ N C4
+ C1 H11
+ C1 H12
+ C1 C5
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+ C4 H41
+ C4 H42
+ C4 H43
+ C5 H51
+ C5 H52
+ C5 OH1
+ OH1 HO1
+
+[ CHON ]
+ [ atoms ]
+ O1 OG2D3 -0.480 0
+ C1 CG2O5 0.400 1
+ C6 CG321 -0.140 2
+ C2 CG321 -0.140 3
+ H6A HGA2 0.090 4
+ H6B HGA2 0.090 5
+ H2A HGA2 0.090 6
+ H2B HGA2 0.090 7
+ C3 CG321 -0.180 8
+ H3A HGA2 0.090 9
+ H3B HGA2 0.090 10
+ C4 CG321 -0.180 11
+ H4A HGA2 0.090 12
+ H4B HGA2 0.090 13
+ C5 CG321 -0.180 14
+ H5A HGA2 0.090 15
+ H5B HGA2 0.090 16
+ [ bonds ]
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C3 H3A
+ C3 H3B
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5A
+ C5 H5B
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C1
+ O1 C1
+ [ impropers ]
+ C1 C2 C6 O1
+
+[ CHXE ]
+ [ atoms ]
+ C1 CG321 -0.180 0
+ H11 HGA2 0.090 1
+ H12 HGA2 0.090 2
+ C2 CG321 -0.180 3
+ H21 HGA2 0.090 4
+ H22 HGA2 0.090 5
+ C3 CG321 -0.180 6
+ H31 HGA2 0.090 7
+ H32 HGA2 0.090 8
+ C4 CG321 -0.180 9
+ H41 HGA2 0.090 10
+ H42 HGA2 0.090 11
+ C5 CG2D1 -0.150 12
+ H5 HGA4 0.150 13
+ C6 CG2D1 -0.150 14
+ H6 HGA4 0.150 15
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C1
+ C6 H6
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H5
+
+[ CINL ]
+ [ atoms ]
+ N1 NG2R62 -0.500 0
+ N2 NG2R62 -0.450 1
+ C3 CG2R61 0.350 2
+ H3 HGR62 0.070 3
+ C4 CG2R61 -0.160 4
+ H4 HGR61 0.180 5
+ C5 CG2R61 0.000 6
+ C6 CG2R61 -0.115 7
+ H6 HGR61 0.115 8
+ C7 CG2R61 -0.115 9
+ H7 HGR61 0.115 10
+ C8 CG2R61 -0.115 11
+ H8 HGR61 0.115 12
+ C9 CG2R61 -0.160 13
+ H9 HGR61 0.180 14
+ C10 CG2R61 0.490 15
+ [ bonds ]
+ N1 N2
+ N2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C5 C10
+ N1 C10
+ C3 H3
+ C4 H4
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+
+[ CLA ]
+ [ atoms ]
+ CLA CLA -1.000 0
+
+[ CLET ]
+ [ atoms ]
+ C1 CG321 0.070 0
+ CL11 CLGA1 -0.100 1
+ H12 HGA2 0.140 2
+ H13 HGA2 0.140 3
+ C2 CG331 -0.520 4
+ H21 HGA3 0.090 5
+ H22 HGA3 0.090 6
+ H23 HGA3 0.090 7
+ [ bonds ]
+ C1 CL11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ CLM1 ]
+ [ atoms ]
+ C1 CG311 0.140 0
+ O1 OG311 -0.650 1
+ HO1 HGP1 0.420 2
+ H1 HGA1 0.090 3
+ C2 CG321 -0.180 4
+ H2 HGA2 0.090 5
+ H2' HGA2 0.090 6
+ C3 CG2D1 0.000 7
+ C15 CG301 0.000 8
+ C16 CG321 -0.180 9
+ H16 HGA2 0.090 10
+ H16' HGA2 0.090 11
+ C17 CG321 -0.180 12
+ H17 HGA2 0.090 13
+ H17' HGA2 0.090 14
+ CC15 CG331 -0.270 15
+ H151 HGA3 0.090 16
+ H152 HGA3 0.090 17
+ H153 HGA3 0.090 18
+ C4 CG2D1 -0.150 19
+ H4 HGA4 0.150 20
+ C5 CG321 -0.180 21
+ H5 HGA2 0.090 22
+ H5' HGA2 0.090 23
+ C6 CG321 -0.180 24
+ H6 HGA2 0.090 25
+ H6' HGA2 0.090 26
+ C14 CG321 -0.180 27
+ H14 HGA2 0.090 28
+ H14' HGA2 0.090 29
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C15
+ C15 C16
+ C16 C17
+ C17 C1
+ C1 O1
+ O1 HO1
+ C1 H1
+ C2 H2
+ C2 H2'
+ C15 CC15
+ CC15 H151
+ CC15 H152
+ CC15 H153
+ C16 H16
+ C16 H16'
+ C17 H17
+ C17 H17'
+ C4 C5
+ C5 C6
+ C6 C14
+ C14 C15
+ C4 H4
+ C5 H5
+ C5 H5'
+ C6 H6
+ C6 H6'
+ C14 H14
+ C14 H14'
+ C3 C4
+
+[ CLNS ]
+ [ atoms ]
+ C1 CG311 0.140 0
+ O1 OG311 -0.650 1
+ HO1 HGP1 0.420 2
+ H1 HGA1 0.090 3
+ C2 CG321 -0.180 4
+ H2 HGA2 0.090 5
+ H2' HGA2 0.090 6
+ C3 CG2D1 0.000 7
+ C4 CG2D1 -0.150 8
+ H4 HGA4 0.150 9
+ C5 CG321 -0.180 10
+ H5 HGA2 0.090 11
+ H5' HGA2 0.090 12
+ C6 CG311 -0.090 13
+ H6 HGA1 0.090 14
+ C7 CG3RC1 -0.090 15
+ H7 HGA1 0.090 16
+ C8 CG3C52 -0.180 17
+ H8 HGA2 0.090 18
+ H8' HGA2 0.090 19
+ C9 CG3C52 -0.180 20
+ H9 HGA2 0.090 21
+ H9' HGA2 0.090 22
+ C10 CG3C51 -0.090 23
+ H10 HGA1 0.090 24
+ C11 CG3RC1 0.000 25
+ CC11 CG331 -0.270 26
+ H111 HGA3 0.090 27
+ H112 HGA3 0.090 28
+ H113 HGA3 0.090 29
+ C12 CG321 -0.180 30
+ H12 HGA2 0.090 31
+ H12' HGA2 0.090 32
+ C13 CG321 -0.180 33
+ H13 HGA2 0.090 34
+ H13' HGA2 0.090 35
+ C14 CG311 -0.090 36
+ H14 HGA1 0.090 37
+ C15 CG301 0.000 38
+ CC15 CG331 -0.270 39
+ H151 HGA3 0.090 40
+ H152 HGA3 0.090 41
+ H153 HGA3 0.090 42
+ C16 CG321 -0.180 43
+ H16 HGA2 0.090 44
+ H16' HGA2 0.090 45
+ C17 CG321 -0.180 46
+ H17 HGA2 0.090 47
+ H17' HGA2 0.090 48
+ C18 CG331 -0.270 49
+ H181 HGA3 0.090 50
+ H182 HGA3 0.090 51
+ H183 HGA3 0.090 52
+ [ bonds ]
+ C1 O1
+ C1 H1
+ C1 C2
+ O1 HO1
+ C2 C3
+ C2 H2
+ C2 H2'
+ C4 C5
+ C4 H4
+ C5 C6
+ C5 H5
+ C5 H5'
+ C6 C7
+ C6 H6
+ C7 C8
+ C7 H7
+ C8 C9
+ C8 H8
+ C8 H8'
+ C9 C10
+ C9 H9
+ C9 H9'
+ C10 C18
+ C10 C11
+ C10 H10
+ C11 CC11
+ C11 C7
+ C11 C12
+ CC11 H111
+ CC11 H112
+ CC11 H113
+ C12 C13
+ C12 H12
+ C12 H12'
+ C13 C14
+ C13 H13
+ C13 H13'
+ C14 C15
+ C14 C6
+ C14 H14
+ C15 C16
+ C15 C3
+ C15 CC15
+ CC15 H151
+ CC15 H152
+ CC15 H153
+ C16 C17
+ C16 H16
+ C16 H16'
+ C17 C1
+ C17 H17
+ C17 H17'
+ C18 H181
+ C18 H182
+ C18 H183
+ C3 C4
+
+[ CLOL ]
+ [ atoms ]
+ C3 CG311 0.140 0
+ O3 OG311 -0.650 1
+ H3' HGP1 0.420 2
+ H3 HGA1 0.090 3
+ C4 CG321 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CG2D1 0.000 7
+ C6 CG2D1 -0.150 8
+ H6 HGA4 0.150 9
+ C7 CG321 -0.180 10
+ H7A HGA2 0.090 11
+ H7B HGA2 0.090 12
+ C8 CG311 -0.090 13
+ H8 HGA1 0.090 14
+ C14 CG3RC1 -0.090 15
+ H14 HGA1 0.090 16
+ C15 CG3C52 -0.180 17
+ H15A HGA2 0.090 18
+ H15B HGA2 0.090 19
+ C16 CG3C52 -0.180 20
+ H16A HGA2 0.090 21
+ H16B HGA2 0.090 22
+ C17 CG3C51 -0.090 23
+ H17 HGA1 0.090 24
+ C13 CG3RC1 0.000 25
+ C18 CG331 -0.270 26
+ H18A HGA3 0.090 27
+ H18B HGA3 0.090 28
+ H18C HGA3 0.090 29
+ C12 CG321 -0.180 30
+ H12A HGA2 0.090 31
+ H12B HGA2 0.090 32
+ C11 CG321 -0.180 33
+ H11A HGA2 0.090 34
+ H11B HGA2 0.090 35
+ C9 CG311 -0.090 36
+ H9 HGA1 0.090 37
+ C10 CG301 0.000 38
+ C19 CG331 -0.270 39
+ H19A HGA3 0.090 40
+ H19B HGA3 0.090 41
+ H19C HGA3 0.090 42
+ C1 CG321 -0.180 43
+ H1A HGA2 0.090 44
+ H1B HGA2 0.090 45
+ C2 CG321 -0.180 46
+ H2A HGA2 0.090 47
+ H2B HGA2 0.090 48
+ C20 CG311 -0.090 49
+ H20 HGA1 0.090 50
+ C21 CG331 -0.270 51
+ H21A HGA3 0.090 52
+ H21B HGA3 0.090 53
+ H21C HGA3 0.090 54
+ C22 CG321 -0.180 55
+ H22A HGA2 0.090 56
+ H22B HGA2 0.090 57
+ C23 CG321 -0.180 58
+ H23A HGA2 0.090 59
+ H23B HGA2 0.090 60
+ C24 CG321 -0.180 61
+ H24A HGA2 0.090 62
+ H24B HGA2 0.090 63
+ C25 CG311 -0.090 64
+ H25 HGA1 0.090 65
+ C26 CG331 -0.270 66
+ H26A HGA3 0.090 67
+ H26B HGA3 0.090 68
+ H26C HGA3 0.090 69
+ C27 CG331 -0.270 70
+ H27A HGA3 0.090 71
+ H27B HGA3 0.090 72
+ H27C HGA3 0.090 73
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 H3'
+ C3 C2
+ C2 H2A
+ C2 H2B
+ C2 C1
+ C1 H1A
+ C1 H1B
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 C10
+ C10 C1
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C6 H6
+ C6 C7
+ C7 H7A
+ C7 H7B
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 C24
+ C24 H24A
+ C24 H24B
+ C24 C25
+ C25 H25
+ C25 C26
+ C26 H26A
+ C26 H26B
+ C26 H26C
+ C25 C27
+ C27 H27A
+ C27 H27B
+ C27 H27C
+ C5 C6
+
+[ CNAD ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C51 -0.090 3
+ H21S HGA1 0.090 4
+ C3S CG3C52 -0.180 5
+ H31S HGA2 0.090 6
+ H32S HGA2 0.090 7
+ C5S CG3RC1 -0.090 8
+ H51S HGA1 0.090 9
+ C6S CG3C31 -0.180 10
+ H61S HGA2 0.090 11
+ H62S HGA2 0.090 12
+ C1S CG3RC1 -0.090 13
+ H11S HGA1 0.090 14
+ C5 CG2RC0 0.280 15
+ N7 NG2R50 -0.710 16
+ C8 CG2R53 0.340 17
+ H8 HGR52 0.120 18
+ N9 NG2R51 -0.050 19
+ N1 NG2R62 -0.740 20
+ C2 CG2R64 0.500 21
+ H2 HGR62 0.130 22
+ N3 NG2R62 -0.750 23
+ C4 CG2RC0 0.430 24
+ C6 CG2R64 0.460 25
+ N6 NG2S3 -0.770 26
+ H61 HGP4 0.380 27
+ H62 HGP4 0.380 28
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C1S H11S
+ C2S H21S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C2S N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C8 H8
+ C2 H2
+ N1 C6
+ C2 N3
+ C4 C5
+ N7 C8
+ [ impropers ]
+ C6 C5 N1 N6
+ N6 H62 H61 C6
+
+[ CNCY ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C51 -0.090 3
+ H21S HGA1 0.090 4
+ C3S CG3C52 -0.180 5
+ H31S HGA2 0.090 6
+ H32S HGA2 0.090 7
+ C5S CG3RC1 -0.090 8
+ H51S HGA1 0.090 9
+ C6S CG3C31 -0.180 10
+ H61S HGA2 0.090 11
+ H62S HGA2 0.090 12
+ C1S CG3RC1 -0.090 13
+ H11S HGA1 0.090 14
+ N1 NG2R61 -0.130 15
+ C6 CG2R62 0.050 16
+ H6 HGR62 0.170 17
+ C2 CG2R63 0.520 18
+ O2 OG2D4 -0.490 19
+ N3 NG2R62 -0.660 20
+ C4 CG2R64 0.650 21
+ N4 NG2S3 -0.750 22
+ H41 HGP4 0.370 23
+ H42 HGP4 0.330 24
+ C5 CG2R62 -0.130 25
+ H5 HGR62 0.070 26
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C1S H11S
+ C2S H21S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C2S N1
+ N1 C2
+ N1 C6
+ C2 O2
+ C2 N3
+ N3 C4
+ C4 N4
+ N4 H41
+ N4 H42
+ C4 C5
+ C5 C6
+ C5 H5
+ C6 H6
+ [ impropers ]
+ C4 C5 N3 N4
+ C2 N1 N3 O2
+ N4 H42 H41 C4
+
+[ CNGU ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C51 -0.090 3
+ H21S HGA1 0.090 4
+ C3S CG3C52 -0.180 5
+ H31S HGA2 0.090 6
+ H32S HGA2 0.090 7
+ C5S CG3RC1 -0.090 8
+ H51S HGA1 0.090 9
+ C6S CG3C31 -0.180 10
+ H61S HGA2 0.090 11
+ H62S HGA2 0.090 12
+ C1S CG3RC1 -0.090 13
+ H11S HGA1 0.090 14
+ N9 NG2R51 -0.020 15
+ C4 CG2RC0 0.260 16
+ N3 NG2R62 -0.740 17
+ C2 CG2R64 0.750 18
+ N1 NG2R61 -0.340 19
+ H1 HGP1 0.260 20
+ N2 NG2S3 -0.680 21
+ H21 HGP4 0.320 22
+ H22 HGP4 0.350 23
+ C6 CG2R63 0.540 24
+ O6 OG2D4 -0.510 25
+ C5 CG2RC0 0.000 26
+ N7 NG2R50 -0.600 27
+ C8 CG2R53 0.250 28
+ H8 HGR52 0.160 29
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C1S H11S
+ C2S H21S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C2S N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C8 H8
+ C4 C5
+ N3 C2
+ C2 N2
+ C2 N1
+ N2 H21
+ N2 H22
+ N1 H1
+ N1 C6
+ C6 O6
+ C6 C5
+ C5 N7
+ N7 C8
+ [ impropers ]
+ C2 N1 N3 N2
+ N2 H22 H21 C2
+ C6 C5 N1 O6
+
+[ CNT1 ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C51 -0.090 3
+ H21S HGA1 0.090 4
+ C3S CG3C52 -0.180 5
+ H31S HGA2 0.090 6
+ H32S HGA2 0.090 7
+ C5S CG3RC1 -0.090 8
+ H51S HGA1 0.090 9
+ C6S CG3C31 -0.180 10
+ H61S HGA2 0.090 11
+ H62S HGA2 0.090 12
+ C1S CG3RC1 -0.090 13
+ H11S HGA1 0.090 14
+ N1 NG2R61 -0.340 15
+ C6 CG2R62 0.170 16
+ H6 HGR62 0.170 17
+ C2 CG2R63 0.510 18
+ O2 OG2D4 -0.410 19
+ N3 NG2R61 -0.460 20
+ H3 HGP1 0.360 21
+ C4 CG2R63 0.500 22
+ O4 OG2D4 -0.450 23
+ C5 CG2R62 -0.150 24
+ C5M CG331 -0.110 25
+ H51 HGA3 0.070 26
+ H52 HGA3 0.070 27
+ H53 HGA3 0.070 28
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C1S H11S
+ C2S H21S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C2S N1
+ N1 C2
+ N1 C6
+ C2 O2
+ C4 C5
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 O4
+ C5 C5M
+ C5 C6
+ C6 H6
+ C5M H51
+ C5M H52
+ C5M H53
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ CNT2 ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C51 -0.090 3
+ H21S HGA1 0.090 4
+ C3S CG3C52 -0.180 5
+ H31S HGA2 0.090 6
+ H32S HGA2 0.090 7
+ C5S CG3RC1 -0.090 8
+ H51S HGA1 0.090 9
+ C6S CG3C31 -0.180 10
+ H61S HGA2 0.090 11
+ H62S HGA2 0.090 12
+ C1S CG3RC1 -0.090 13
+ H11S HGA1 0.090 14
+ N1 NG2R61 -0.340 15
+ C6 CG2R62 0.170 16
+ H6 HGR62 0.170 17
+ C2 CG2R63 0.510 18
+ O2 OG2D4 -0.410 19
+ N3 NG2R61 -0.460 20
+ H3 HGP1 0.360 21
+ C4 CG2R63 0.500 22
+ O4 OG2D4 -0.450 23
+ C5 CG2R62 -0.150 24
+ C5M CG331 -0.110 25
+ H51 HGA3 0.070 26
+ H52 HGA3 0.070 27
+ H53 HGA3 0.070 28
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C1S H11S
+ C2S H21S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C2S N1
+ N1 C2
+ N1 C6
+ C2 O2
+ C4 C5
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 O4
+ C5 C5M
+ C5 C6
+ C6 H6
+ C5M H51
+ C5M H52
+ C5M H53
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ CNT3 ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C51 -0.090 3
+ H21S HGA1 0.090 4
+ C3S CG3C52 -0.180 5
+ H31S HGA2 0.090 6
+ H32S HGA2 0.090 7
+ C5S CG3RC1 -0.090 8
+ H51S HGA1 0.090 9
+ C6S CG3C31 -0.180 10
+ H61S HGA2 0.090 11
+ H62S HGA2 0.090 12
+ C1S CG3RC1 -0.090 13
+ H11S HGA1 0.090 14
+ N1 NG2R61 -0.340 15
+ C6 CG2R62 0.170 16
+ H6 HGR62 0.170 17
+ C2 CG2R63 0.510 18
+ O2 OG2D4 -0.410 19
+ N3 NG2R61 -0.460 20
+ H3 HGP1 0.360 21
+ C4 CG2R63 0.500 22
+ O4 OG2D4 -0.450 23
+ C5 CG2R62 -0.150 24
+ C5M CG331 -0.110 25
+ H51 HGA3 0.070 26
+ H52 HGA3 0.070 27
+ H53 HGA3 0.070 28
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C1S H11S
+ C2S H21S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C2S N1
+ N1 C2
+ N1 C6
+ C2 O2
+ C4 C5
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 O4
+ C5 C5M
+ C5 C6
+ C6 H6
+ C5M H51
+ C5M H52
+ C5M H53
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ CNTH ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C51 -0.090 3
+ H21S HGA1 0.090 4
+ C3S CG3C52 -0.180 5
+ H31S HGA2 0.090 6
+ H32S HGA2 0.090 7
+ C5S CG3RC1 -0.090 8
+ H51S HGA1 0.090 9
+ C6S CG3C31 -0.180 10
+ H61S HGA2 0.090 11
+ H62S HGA2 0.090 12
+ C1S CG3RC1 -0.090 13
+ H11S HGA1 0.090 14
+ N1 NG2R61 -0.340 15
+ C6 CG2R62 0.170 16
+ H6 HGR62 0.170 17
+ C2 CG2R63 0.510 18
+ O2 OG2D4 -0.410 19
+ N3 NG2R61 -0.460 20
+ H3 HGP1 0.360 21
+ C4 CG2R63 0.500 22
+ O4 OG2D4 -0.450 23
+ C5 CG2R62 -0.150 24
+ C5M CG331 -0.110 25
+ H51 HGA3 0.070 26
+ H52 HGA3 0.070 27
+ H53 HGA3 0.070 28
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C1S H11S
+ C2S H21S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C2S N1
+ N1 C2
+ N1 C6
+ C2 O2
+ C4 C5
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 O4
+ C5 C5M
+ C5 C6
+ C6 H6
+ C5M H51
+ C5M H52
+ C5M H53
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ CO ]
+ [ atoms ]
+ C CM 0.021 0
+ O OM -0.021 1
+
+[ CO2 ]
+ [ atoms ]
+ C CG2O7 0.600 0
+ OC1 OG2D5 -0.300 1
+ OC2 OG2D5 -0.300 2
+ [ bonds ]
+ OC1 C
+ OC2 C
+
+[ CO2M ]
+ [ atoms ]
+ C CST 0.596 0
+ OC1 OST -0.298 1
+ OC2 OST -0.298 2
+ [ bonds ]
+ OC1 C
+ OC2 C
+
+[ CO3 ]
+ [ atoms ]
+ C1 CG2O6 1.420 0
+ O1 OG2D2 -1.140 1
+ O2 OG2D2 -1.140 2
+ O3 OG2D2 -1.140 3
+ [ bonds ]
+ C1 O1
+ C1 O2
+ C1 O3
+ [ impropers ]
+ C1 O1 O2 O3
+
+[ CO31 ]
+ [ atoms ]
+ C CG2O6 0.690 0
+ H3 HGP1 0.430 1
+ O1 OG2D2 -0.760 2
+ O2 OG2D2 -0.760 3
+ O3 OG311 -0.600 4
+ [ bonds ]
+ C O1
+ C O2
+ C O3
+ O3 H3
+ [ impropers ]
+ C O1 O2 O3
+
+[ CPDE ]
+ [ atoms ]
+ C1 CG3C52 0.100 0
+ H11 HGA2 0.090 1
+ H12 HGA2 0.090 2
+ C2 CG2R51 -0.360 3
+ H2 HGR51 0.220 4
+ C3 CG2R51 -0.220 5
+ H3 HGR51 0.220 6
+ C4 CG2R51 -0.220 7
+ H4 HGR51 0.220 8
+ C5 CG2R51 -0.360 9
+ H5 HGR51 0.220 10
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C1
+ C1 H11
+ C1 H12
+ C2 H2
+ C3 H3
+ C4 H4
+ C5 H5
+
+[ CPEN ]
+ [ atoms ]
+ C1 CC325A -0.180 0
+ H1A HCA25A 0.090 1
+ H1B HCA25A 0.090 2
+ C2 CC325A -0.180 3
+ H2A HCA25A 0.090 4
+ H2B HCA25A 0.090 5
+ C3 CC325A -0.180 6
+ H3A HCA25A 0.090 7
+ H3B HCA25A 0.090 8
+ C4 CC325A -0.180 9
+ H4A HCA25A 0.090 10
+ H4B HCA25A 0.090 11
+ C5 CC325A -0.180 12
+ H5A HCA25A 0.090 13
+ H5B HCA25A 0.090 14
+ [ bonds ]
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C3 H3A
+ C3 H3B
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5A
+ C5 H5B
+ C5 C1
+
+[ CPES ]
+ [ atoms ]
+ C1 CG3C52 -0.180 0
+ H11 HGA2 0.090 1
+ H12 HGA2 0.090 2
+ C2 CG3C52 -0.180 3
+ H21 HGA2 0.090 4
+ H22 HGA2 0.090 5
+ C3 CG3C52 -0.180 6
+ H31 HGA2 0.090 7
+ H32 HGA2 0.090 8
+ C4 CG3C52 -0.180 9
+ H41 HGA2 0.090 10
+ H42 HGA2 0.090 11
+ C5 CG3C52 -0.180 12
+ H51 HGA2 0.090 13
+ H52 HGA2 0.090 14
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C1
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+
+[ CRBZ ]
+ [ atoms ]
+ C1 CG2R61 -0.180 0
+ H1 HGR61 0.180 1
+ C2 CG2R61 -0.180 2
+ H2 HGR61 0.180 3
+ C3 CG2R61 -0.180 4
+ H3 HGR61 0.180 5
+ C4 CG2R61 -0.270 6
+ H4 HGR61 0.270 7
+ C5 CG2R67 -0.200 8
+ C6 CG2R67 -0.200 9
+ C7 CG2R61 -0.270 10
+ H7 HGR61 0.270 11
+ C8 CG2R61 -0.180 12
+ H8 HGR61 0.180 13
+ C9 CG2R61 -0.180 14
+ H9 HGR61 0.180 15
+ C10 CG2R61 -0.180 16
+ H10 HGR61 0.180 17
+ C11 CG2RC0 0.200 18
+ N12 NG2R51 -0.300 19
+ H12 HGP1 0.300 20
+ C13 CG2RC0 0.200 21
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 N12
+ N12 C13
+ C13 C1
+ C5 C13
+ C6 C11
+ C1 H1
+ C2 H2
+ C3 H3
+ C4 H4
+ C7 H7
+ C8 H8
+ C9 H9
+ C10 H10
+ N12 H12
+
+[ CROT ]
+ [ atoms ]
+ C12 CG331 -0.270 0
+ H121 HGA3 0.090 1
+ H122 HGA3 0.090 2
+ H123 HGA3 0.090 3
+ C13 CG2DC2 0.000 4
+ C14 CG2DC2 -0.150 5
+ H141 HGA4 0.150 6
+ C15 CG2O1 0.510 7
+ O29 OG2D1 -0.510 8
+ N21 NG2S1 -0.470 9
+ H211 HGP1 0.280 10
+ C16 CG331 -0.080 11
+ H131 HGA3 0.090 12
+ H132 HGA3 0.090 13
+ H133 HGA3 0.090 14
+ C20 CG331 -0.270 15
+ H201 HGA3 0.090 16
+ H202 HGA3 0.090 17
+ H203 HGA3 0.090 18
+ [ bonds ]
+ C12 C13
+ C13 C14
+ C14 C15
+ C15 N21
+ N21 C16
+ C13 C20
+ C15 O29
+ C14 H141
+ N21 H211
+ C16 H131
+ C16 H132
+ C16 H133
+ C12 H121
+ C12 H122
+ C12 H123
+ C20 H201
+ C20 H202
+ C20 H203
+ [ impropers ]
+ C15 C14 N21 O29
+
+[ CSAD ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C52 -0.180 3
+ H21S HGA2 0.090 4
+ H22S HGA2 0.090 5
+ C3S CG3C52 -0.180 6
+ H31S HGA2 0.090 7
+ H32S HGA2 0.090 8
+ C5S CG3RC1 -0.090 9
+ H51S HGA1 0.090 10
+ C6S CG3C31 -0.180 11
+ H61S HGA2 0.090 12
+ H62S HGA2 0.090 13
+ C1S CG3RC1 0.000 14
+ C5 CG2RC0 0.280 15
+ N7 NG2R50 -0.710 16
+ C8 CG2R53 0.340 17
+ H8 HGR52 0.120 18
+ N9 NG2R51 -0.050 19
+ N1 NG2R62 -0.740 20
+ C2 CG2R64 0.500 21
+ H2 HGR62 0.130 22
+ N3 NG2R62 -0.750 23
+ C4 CG2RC0 0.430 24
+ C6 CG2R64 0.460 25
+ N6 NG2S3 -0.770 26
+ H61 HGP4 0.380 27
+ H62 HGP4 0.380 28
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C2S H21S
+ C2S H22S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C1S N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C8 H8
+ C2 H2
+ N1 C6
+ C2 N3
+ C4 C5
+ N7 C8
+ [ impropers ]
+ C6 C5 N1 N6
+ N6 H62 H61 C6
+
+[ CSCY ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C52 -0.180 3
+ H21S HGA2 0.090 4
+ H22S HGA2 0.090 5
+ C3S CG3C52 -0.180 6
+ H31S HGA2 0.090 7
+ H32S HGA2 0.090 8
+ C5S CG3RC1 -0.090 9
+ H51S HGA1 0.090 10
+ C6S CG3C31 -0.180 11
+ H61S HGA2 0.090 12
+ H62S HGA2 0.090 13
+ C1S CG3RC1 0.000 14
+ N1 NG2R61 -0.130 15
+ C6 CG2R62 0.050 16
+ H6 HGR62 0.170 17
+ C2 CG2R63 0.520 18
+ O2 OG2D4 -0.490 19
+ N3 NG2R62 -0.660 20
+ C4 CG2R64 0.650 21
+ N4 NG2S3 -0.750 22
+ H41 HGP4 0.370 23
+ H42 HGP4 0.330 24
+ C5 CG2R62 -0.130 25
+ H5 HGR62 0.070 26
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C2S H21S
+ C2S H22S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C1S N1
+ N1 C2
+ N1 C6
+ C2 O2
+ C2 N3
+ N3 C4
+ C4 N4
+ N4 H41
+ N4 H42
+ C4 C5
+ C5 C6
+ C5 H5
+ C6 H6
+ [ impropers ]
+ C4 C5 N3 N4
+ C2 N1 N3 O2
+ N4 H42 H41 C4
+
+[ CSGU ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C52 -0.180 3
+ H21S HGA2 0.090 4
+ H22S HGA2 0.090 5
+ C3S CG3C52 -0.180 6
+ H31S HGA2 0.090 7
+ H32S HGA2 0.090 8
+ C5S CG3RC1 -0.090 9
+ H51S HGA1 0.090 10
+ C6S CG3C31 -0.180 11
+ H61S HGA2 0.090 12
+ H62S HGA2 0.090 13
+ C1S CG3RC1 0.000 14
+ N9 NG2R51 -0.020 15
+ C4 CG2RC0 0.260 16
+ N3 NG2R62 -0.740 17
+ C2 CG2R64 0.750 18
+ N1 NG2R61 -0.340 19
+ H1 HGP1 0.260 20
+ N2 NG2S3 -0.680 21
+ H21 HGP4 0.320 22
+ H22 HGP4 0.350 23
+ C6 CG2R63 0.540 24
+ O6 OG2D4 -0.510 25
+ C5 CG2RC0 0.000 26
+ N7 NG2R50 -0.600 27
+ C8 CG2R53 0.250 28
+ H8 HGR52 0.160 29
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C2S H21S
+ C2S H22S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C1S N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C8 H8
+ C4 C5
+ N3 C2
+ C2 N2
+ C2 N1
+ N2 H21
+ N2 H22
+ N1 H1
+ N1 C6
+ C6 O6
+ C6 C5
+ C5 N7
+ N7 C8
+ [ impropers ]
+ C2 N1 N3 N2
+ N2 H22 H21 C2
+ C6 C5 N1 O6
+
+[ CSTH ]
+ [ atoms ]
+ C4S CG3C52 -0.180 0
+ H41S HGA2 0.090 1
+ H42S HGA2 0.090 2
+ C2S CG3C52 -0.180 3
+ H21S HGA2 0.090 4
+ H22S HGA2 0.090 5
+ C3S CG3C52 -0.180 6
+ H31S HGA2 0.090 7
+ H32S HGA2 0.090 8
+ C5S CG3RC1 -0.090 9
+ H51S HGA1 0.090 10
+ C6S CG3C31 -0.180 11
+ H61S HGA2 0.090 12
+ H62S HGA2 0.090 13
+ C1S CG3RC1 0.000 14
+ N1 NG2R61 -0.340 15
+ C6 CG2R62 0.170 16
+ H6 HGR62 0.170 17
+ C2 CG2R63 0.510 18
+ O2 OG2D4 -0.410 19
+ N3 NG2R61 -0.460 20
+ H3 HGP1 0.360 21
+ C4 CG2R63 0.500 22
+ O4 OG2D4 -0.450 23
+ C5 CG2R62 -0.150 24
+ C5M CG331 -0.110 25
+ H51 HGA3 0.070 26
+ H52 HGA3 0.070 27
+ H53 HGA3 0.070 28
+ [ bonds ]
+ C1S C2S
+ C2S C3S
+ C3S C4S
+ C4S C5S
+ C5S C1S
+ C5S C6S
+ C6S C1S
+ C2S H21S
+ C2S H22S
+ C3S H31S
+ C3S H32S
+ C4S H41S
+ C4S H42S
+ C5S H51S
+ C6S H61S
+ C6S H62S
+ C1S N1
+ N1 C2
+ N1 C6
+ C2 O2
+ C4 C5
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 O4
+ C5 C5M
+ C5 C6
+ C6 H6
+ C5M H51
+ C5M H52
+ C5M H53
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ CUME ]
+ [ atoms ]
+ CA1 CG2R61 -0.115 0
+ HA1 HGR61 0.115 1
+ CA2 CG2R61 -0.115 2
+ HA2 HGR61 0.115 3
+ CA3 CG2R61 -0.115 4
+ HA3 HGR61 0.115 5
+ CA4 CG2R61 0.000 6
+ CA5 CG2R61 -0.115 7
+ HA5 HGR61 0.115 8
+ CA6 CG2R61 -0.115 9
+ HA6 HGR61 0.115 10
+ C4 CG311 -0.090 11
+ H41 HGA1 0.090 12
+ C3 CG331 -0.270 13
+ H31 HGA3 0.090 14
+ H32 HGA3 0.090 15
+ H33 HGA3 0.090 16
+ C5 CG331 -0.270 17
+ H51 HGA3 0.090 18
+ H52 HGA3 0.090 19
+ H53 HGA3 0.090 20
+ [ bonds ]
+ CA1 HA1
+ CA1 CA2
+ CA2 HA2
+ CA3 HA3
+ CA3 CA4
+ CA5 HA5
+ CA5 CA6
+ CA6 HA6
+ C3 H31
+ C3 H32
+ C3 H33
+ CA4 C4
+ C3 C4
+ C4 H41
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 H53
+ CA6 CA1
+ CA4 CA5
+ CA2 CA3
+
+[ CYIN ]
+ [ atoms ]
+ N1 NG2R51 -0.450 0
+ H1 HGP1 0.370 1
+ C2 CG2RC0 0.230 2
+ C3 CG2R61 -0.290 3
+ H3 HGR61 0.170 4
+ C4 CG2R61 -0.130 5
+ H4 HGR61 0.160 6
+ C5 CG2R61 -0.080 7
+ C6 CG2R61 -0.280 8
+ H6 HGR61 0.200 9
+ C7 CG2RC0 0.260 10
+ C8 CG2R51 -0.400 11
+ H8 HGR51 0.180 12
+ C9 CG2R51 -0.020 13
+ H9 HGR52 0.160 14
+ C10 CG1N1 0.390 15
+ N10 NG1T1 -0.470 16
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C4 C5
+ C6 C7
+ C7 C8
+ C9 N1
+ N1 H1
+ C3 H3
+ C4 H4
+ C5 C10
+ C6 H6
+ C8 H8
+ C9 H9
+ C3 C4
+ C5 C6
+ C7 C2
+ C8 C9
+
+[ CYPE ]
+ [ atoms ]
+ C1 CG2R51 -0.120 0
+ H1 HGR51 0.120 1
+ C2 CG2R51 -0.120 2
+ H2 HGR51 0.120 3
+ C3 CG3C52 -0.180 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ C4 CG3C52 -0.180 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG3C52 -0.180 10
+ H51 HGA2 0.090 11
+ H52 HGA2 0.090 12
+ [ bonds ]
+ C1 C2
+ C1 C5
+ C1 H1
+ C2 C3
+ C2 H2
+ C3 C4
+ C3 H31
+ C3 H32
+ C4 C5
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+
+
+
+[ CYS2 ] ; disulfide cystine residue provided by Michel Cuendet
+ [ atoms ]
+ N NH1 -0.47 0
+ HN H 0.31 1
+ CA CT1 0.07 2
+ HA HB1 0.09 3
+ CB CT2 -0.10 4
+ HB1 HA2 0.09 5
+ HB2 HA2 0.09 6
+ SG SM -0.08 7
+ C C 0.51 8
+ O O -0.51 9
+ [ bonds ]
+ CB CA
+ SG CB
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+[ cmap ]
+ -C N CA C +N
+
+[ CYS ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.110 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ SG S -0.230 7
+ HG1 HS 0.160 8
+ C C 0.510 9
+ O O -0.510 10
+ [ bonds ]
+ CB CA
+ SG CB
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ SG HG1
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ CYT ]
+ [ atoms ]
+ P P 1.500 0
+ O1P ON3 -0.780 1
+ O2P ON3 -0.780 2
+ O5' ON2 -0.570 3
+ C5' CN8B -0.080 4
+ H5' HN8 0.090 5
+ H5'' HN8 0.090 6
+ C4' CN7 0.160 7
+ H4' HN7 0.090 8
+ O4' ON6B -0.500 9
+ C1' CN7B 0.160 10
+ H1' HN7 0.090 11
+ N1 NN2 -0.130 12
+ C6 CN3 0.050 13
+ H6 HN3 0.170 14
+ C5 CN3 -0.130 15
+ H5 HN3 0.070 16
+ C2 CN1 0.520 17
+ O2 ON1C -0.490 18
+ N3 NN3 -0.660 19
+ C4 CN2 0.650 20
+ N4 NN1 -0.750 21
+ H41 HN1 0.370 22
+ H42 HN1 0.330 23
+ C2' CN7B 0.140 24
+ H2'' HN7 0.090 25
+ O2' ON5 -0.660 26
+ H2' HN5 0.430 27
+ C3' CN7 0.010 28
+ H3' HN7 0.090 29
+ O3' ON2 -0.570 30
+ [ bonds ]
+ P O1P
+ P O2P
+ P O5'
+ O5' C5'
+ C5' C4'
+ C4' O4'
+ C4' C3'
+ O4' C1'
+ C1' N1
+ C1' C2'
+ N1 C2
+ N1 C6
+ C2 N3
+ C4 N4
+ N4 H41
+ N4 H42
+ C4 C5
+ C2' C3'
+ C3' O3'
+ O3' +P
+ C2' O2'
+ O2' H2'
+ C1' H1'
+ C2' H2''
+ C3' H3'
+ C4' H4'
+ C5' H5'
+ C5' H5''
+ C5 H5
+ C6 H6
+ C2 O2
+ C5 C6
+ N3 C4
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 N3 C5 N4
+ N4 C4 H41 H42
+
+[ DALTOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ DAPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C12 CTL2 -0.100 1
+ H12A HL 0.250 2
+ H12B HL 0.250 3
+ C13 CTL5 -0.350 4
+ H13A HL 0.250 5
+ H13B HL 0.250 6
+ H13C HL 0.250 7
+ C14 CTL5 -0.350 8
+ H14A HL 0.250 9
+ H14B HL 0.250 10
+ H14C HL 0.250 11
+ C15 CTL5 -0.350 12
+ H15A HL 0.250 13
+ H15B HL 0.250 14
+ H15C HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O12 OSLP -0.570 22
+ O11 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CEL1 -0.150 50
+ H5R HEL1 0.150 51
+ C26 CEL1 -0.150 52
+ H6R HEL1 0.150 53
+ C27 CTL2 -0.180 54
+ H7R HAL2 0.090 55
+ H7S HAL2 0.090 56
+ C28 CEL1 -0.150 57
+ H8R HEL1 0.150 58
+ C29 CEL1 -0.150 59
+ H9R HEL1 0.150 60
+ C210 CTL2 -0.180 61
+ H10R HAL2 0.090 62
+ H10S HAL2 0.090 63
+ C211 CEL1 -0.150 64
+ H11R HEL1 0.150 65
+ C212 CEL1 -0.150 66
+ H12R HEL1 0.150 67
+ C213 CTL2 -0.180 68
+ H13R HAL2 0.090 69
+ H13S HAL2 0.090 70
+ C214 CEL1 -0.150 71
+ H14R HEL1 0.150 72
+ C215 CEL1 -0.150 73
+ H15R HEL1 0.150 74
+ C216 CTL2 -0.180 75
+ H16R HAL2 0.090 76
+ H16S HAL2 0.090 77
+ C217 CTL2 -0.180 78
+ H17R HAL2 0.090 79
+ H17S HAL2 0.090 80
+ C218 CTL2 -0.180 81
+ H18R HAL2 0.090 82
+ H18S HAL2 0.090 83
+ C219 CTL2 -0.180 84
+ H19R HAL2 0.090 85
+ H19S HAL2 0.090 86
+ C220 CTL3 -0.270 87
+ H20R HAL3 0.090 88
+ H20S HAL3 0.090 89
+ H20T HAL3 0.090 90
+ C33 CTL2 -0.180 91
+ H3X HAL2 0.090 92
+ H3Y HAL2 0.090 93
+ C34 CTL2 -0.180 94
+ H4X HAL2 0.090 95
+ H4Y HAL2 0.090 96
+ C35 CEL1 -0.150 97
+ H5X HEL1 0.150 98
+ C36 CEL1 -0.150 99
+ H6X HEL1 0.150 100
+ C37 CTL2 -0.180 101
+ H7X HAL2 0.090 102
+ H7Y HAL2 0.090 103
+ C38 CEL1 -0.150 104
+ H8X HEL1 0.150 105
+ C39 CEL1 -0.150 106
+ H9X HEL1 0.150 107
+ C310 CTL2 -0.180 108
+ H10X HAL2 0.090 109
+ H10Y HAL2 0.090 110
+ C311 CEL1 -0.150 111
+ H11X HEL1 0.150 112
+ C312 CEL1 -0.150 113
+ H12X HEL1 0.150 114
+ C313 CTL2 -0.180 115
+ H13X HAL2 0.090 116
+ H13Y HAL2 0.090 117
+ C314 CEL1 -0.150 118
+ H14X HEL1 0.150 119
+ C315 CEL1 -0.150 120
+ H15X HEL1 0.150 121
+ C316 CTL2 -0.180 122
+ H16X HAL2 0.090 123
+ H16Y HAL2 0.090 124
+ C317 CTL2 -0.180 125
+ H17X HAL2 0.090 126
+ H17Y HAL2 0.090 127
+ C318 CTL2 -0.180 128
+ H18X HAL2 0.090 129
+ H18Y HAL2 0.090 130
+ C319 CTL2 -0.180 131
+ H19X HAL2 0.090 132
+ H19Y HAL2 0.090 133
+ C320 CTL3 -0.270 134
+ H20X HAL3 0.090 135
+ H20Y HAL3 0.090 136
+ H20Z HAL3 0.090 137
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ C21 O21
+ C21 C22
+ C22 C23
+ C22 H2R
+ C22 H2S
+ C23 C24
+ C23 H3R
+ C23 H3S
+ C24 C25
+ C24 H4R
+ C24 H4S
+ C25 H5R
+ C26 C27
+ C26 H6R
+ C27 C28
+ C27 H7R
+ C27 H7S
+ C28 H8R
+ C29 C210
+ C29 H9R
+ C210 C211
+ C210 H10R
+ C210 H10S
+ C211 H11R
+ C212 C213
+ C212 H12R
+ C213 C214
+ C213 H13R
+ C213 H13S
+ C214 H14R
+ C215 C216
+ C215 H15R
+ C216 C217
+ C216 H16R
+ C216 H16S
+ C217 C218
+ C217 H17R
+ C217 H17S
+ C218 C219
+ C218 H18R
+ C218 H18S
+ C219 C220
+ C219 H19R
+ C219 H19S
+ C220 H20T
+ C220 H20R
+ C220 H20S
+ C31 O31
+ C31 C32
+ C32 C33
+ C32 H2X
+ C32 H2Y
+ C33 C34
+ C33 H3X
+ C33 H3Y
+ C34 C35
+ C34 H4X
+ C34 H4Y
+ C35 H5X
+ C36 C37
+ C36 H6X
+ C37 C38
+ C37 H7X
+ C37 H7Y
+ C38 H8X
+ C39 C310
+ C39 H9X
+ C310 C311
+ C310 H10X
+ C310 H10Y
+ C311 H11X
+ C312 C313
+ C312 H12X
+ C313 C314
+ C313 H13X
+ C313 H13Y
+ C314 H14X
+ C315 C316
+ C315 H15X
+ C316 C317
+ C316 H16X
+ C316 H16Y
+ C317 C318
+ C317 H17X
+ C317 H17Y
+ C318 C319
+ C318 H18X
+ C318 H18Y
+ C319 C320
+ C319 H19X
+ C319 H19Y
+ C320 H20Z
+ C320 H20X
+ C320 H20Y
+ C21 O22
+ C25 C26
+ C28 C29
+ C211 C212
+ C214 C215
+ C31 O32
+ C35 C36
+ C38 C39
+ C311 C312
+ C314 C315
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DARAOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC322 0.050 17
+ H51 HCA2 0.090 18
+ H52 HCA2 0.090 19
+ O5 OC311 -0.650 20
+ HO5 HCP1 0.420 21
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H51
+ C5 O5
+ O5 HO5
+ C5 H52
+
+[ DBRE ]
+ [ atoms ]
+ C1 CG311 0.100 0
+ BR11 BRGA2 -0.040 1
+ BR12 BRGA2 -0.040 2
+ H13 HGA1 0.220 3
+ C2 CG331 -0.510 4
+ H21 HGA3 0.090 5
+ H22 HGA3 0.090 6
+ H23 HGA3 0.090 7
+ [ bonds ]
+ C1 BR11
+ C1 BR12
+ C1 H13
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ DCA ]
+ [ atoms ]
+ C3 CG311 0.140 0
+ O3 OG311 -0.650 1
+ H3' HGP1 0.420 2
+ H3 HGA1 0.090 3
+ C4 CG321 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CG311 -0.090 7
+ H5 HGA1 0.090 8
+ C6 CG321 -0.180 9
+ H6A HGA2 0.090 10
+ H6B HGA2 0.090 11
+ C7 CG321 -0.180 12
+ H7A HGA2 0.090 13
+ H7B HGA2 0.090 14
+ C8 CG311 -0.090 15
+ H8 HGA1 0.090 16
+ C14 CG3RC1 -0.090 17
+ H14 HGA1 0.090 18
+ C15 CG3C52 -0.180 19
+ H15A HGA2 0.090 20
+ H15B HGA2 0.090 21
+ C16 CG3C52 -0.180 22
+ H16A HGA2 0.090 23
+ H16B HGA2 0.090 24
+ C17 CG3C51 -0.090 25
+ H17 HGA1 0.090 26
+ C13 CG3RC1 0.000 27
+ C18 CG331 -0.270 28
+ H18A HGA3 0.090 29
+ H18B HGA3 0.090 30
+ H18C HGA3 0.090 31
+ C12 CG311 0.140 32
+ H12 HGA1 0.090 33
+ O12 OG311 -0.650 34
+ H12' HGP1 0.420 35
+ C11 CG321 -0.180 36
+ H11A HGA2 0.090 37
+ H11B HGA2 0.090 38
+ C9 CG311 -0.090 39
+ H9 HGA1 0.090 40
+ C10 CG301 0.000 41
+ C19 CG331 -0.270 42
+ H19A HGA3 0.090 43
+ H19B HGA3 0.090 44
+ H19C HGA3 0.090 45
+ C1 CG321 -0.180 46
+ H1A HGA2 0.090 47
+ H1B HGA2 0.090 48
+ C2 CG321 -0.180 49
+ H2A HGA2 0.090 50
+ H2B HGA2 0.090 51
+ C20 CG311 -0.090 52
+ H20 HGA1 0.090 53
+ C21 CG331 -0.270 54
+ H21A HGA3 0.090 55
+ H21B HGA3 0.090 56
+ H21C HGA3 0.090 57
+ C22 CG321 -0.180 58
+ H22A HGA2 0.090 59
+ H22B HGA2 0.090 60
+ C23 CG321 -0.180 61
+ H23A HGA2 0.090 62
+ H23B HGA2 0.090 63
+ CD CG2O3 0.520 64
+ OE1 OG2D2 -0.760 65
+ OE2 OG2D2 -0.760 66
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 H3'
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5
+ C5 C10
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C10 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C7
+ C7 H7A
+ C7 H7B
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C13 C12
+ C12 H12
+ C12 O12
+ O12 H12'
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 CD
+ CD OE1
+ CD OE2
+ [ impropers ]
+ CD OE2 OE1 C23
+
+[ DCLE ]
+ [ atoms ]
+ C1 CG311 0.120 0
+ CL11 CLGA1 -0.040 1
+ CL12 CLGA1 -0.040 2
+ H13 HGA1 0.220 3
+ C2 CG331 -0.530 4
+ H21 HGA3 0.090 5
+ H22 HGA3 0.090 6
+ H23 HGA3 0.090 7
+ [ bonds ]
+ C1 CL11
+ C1 CL12
+ C1 H13
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ DECB ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG321 0.050 4
+ H21 HGA2 0.090 5
+ H22 HGA2 0.090 6
+ N3 NG2S1 -0.380 7
+ H3 HGP1 0.320 8
+ C4 CG2O6 0.200 9
+ O41 OG2D1 -0.390 10
+ O42 OG302 -0.320 11
+ C5 CG321 0.160 12
+ H51 HGA2 0.090 13
+ H52 HGA2 0.090 14
+ C6 CG331 -0.270 15
+ H61 HGA3 0.090 16
+ H62 HGA3 0.090 17
+ H63 HGA3 0.090 18
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 O41
+ C4 O42
+ O42 C5
+ C5 H51
+ C5 H52
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+ [ impropers ]
+ C4 N3 O41 O42
+
+[ DEDS ]
+ [ atoms ]
+ H1 HGA2 0.090 0
+ H2 HGA2 0.090 1
+ CM1 CG321 -0.100 2
+ S2 SG301 -0.080 3
+ S3 SG301 -0.080 4
+ CM4 CG321 -0.100 5
+ H4 HGA2 0.090 6
+ H5 HGA2 0.090 7
+ CM0 CG331 -0.270 8
+ H01 HGA3 0.090 9
+ H02 HGA3 0.090 10
+ H03 HGA3 0.090 11
+ CM5 CG331 -0.270 12
+ H51 HGA3 0.090 13
+ H52 HGA3 0.090 14
+ H53 HGA3 0.090 15
+ [ bonds ]
+ H1 CM1
+ H2 CM1
+ CM1 CM0
+ CM1 S2
+ S2 S3
+ S3 CM4
+ CM4 H4
+ CM4 H5
+ CM4 CM5
+ CM0 H01
+ CM0 H02
+ CM0 H03
+ CM5 H51
+ CM5 H52
+ CM5 H53
+
+[ DEET ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ C2 CC32A -0.010 4
+ H21 HCA2A 0.090 5
+ H22 HCA2A 0.090 6
+ O3 OC30A -0.340 7
+ C4 CC32A -0.010 8
+ H41 HCA2A 0.090 9
+ H42 HCA2A 0.090 10
+ C5 CC33A -0.270 11
+ H51 HCA3A 0.090 12
+ H52 HCA3A 0.090 13
+ H53 HCA3A 0.090 14
+ [ bonds ]
+ C1 C2
+ C2 O3
+ O3 C4
+ C4 C5
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ DETE ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG321 -0.010 4
+ H21 HGA2 0.090 5
+ H22 HGA2 0.090 6
+ O3 OG301 -0.340 7
+ C4 CG321 -0.010 8
+ H41 HGA2 0.090 9
+ H42 HGA2 0.090 10
+ C5 CG331 -0.270 11
+ H51 HGA3 0.090 12
+ H52 HGA3 0.090 13
+ H53 HGA3 0.090 14
+ [ bonds ]
+ C1 C2
+ C2 O3
+ O3 C4
+ C4 C5
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ DFB ]
+ [ atoms ]
+ C1 CG2R61 -0.260 0
+ H1 HGR62 0.230 1
+ C2 CG2R66 0.270 2
+ F2 FGR1 -0.190 3
+ C3 CG2R61 -0.230 4
+ H3 HGR62 0.190 5
+ C4 CG2R66 0.270 6
+ F4 FGR1 -0.190 7
+ C5 CG2R61 -0.260 8
+ H5 HGR62 0.230 9
+ C6 CG2R61 -0.320 10
+ H6 HGR61 0.260 11
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C1
+ C1 H1
+ C2 F2
+ C3 H3
+ C4 F4
+ C5 H5
+ C6 H6
+
+[ DFET ]
+ [ atoms ]
+ H13 HGA3 0.090 0
+ C1 CG331 -0.230 1
+ C2 CG312 0.240 2
+ H21 HGA7 0.100 3
+ F22 FGA2 -0.190 4
+ F23 FGA2 -0.190 5
+ H11 HGA3 0.090 6
+ H12 HGA3 0.090 7
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 F23
+ C2 F22
+ C2 H21
+
+[ DFT ]
+ [ atoms ]
+ C1 CG2R61 -0.240 0
+ C2 CG2R66 0.280 1
+ C3 CG2R61 -0.240 2
+ C4 CG2R66 0.220 3
+ C5 CG2R61 0.100 4
+ C6 CG2R61 -0.280 5
+ H1 HGR62 0.210 6
+ F2 FGR1 -0.210 7
+ H3 HGR62 0.190 8
+ F4 FGR1 -0.210 9
+ C5M CG331 -0.240 10
+ H51 HGA3 0.070 11
+ H52 HGA3 0.070 12
+ H53 HGA3 0.070 13
+ H6 HGR61 0.210 14
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C1
+ C1 H1
+ C2 F2
+ C3 H3
+ C4 F4
+ C5 C5M
+ C6 H6
+ C5M H51
+ C5M H52
+ C5M H53
+
+[ DGLUOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ DGULOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ DIDIOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ DIHE ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG2D1 -0.150 4
+ H21 HGA4 0.150 5
+ C3 CG2D1 -0.150 6
+ H31 HGA4 0.150 7
+ C4 CG321 -0.180 8
+ H41 HGA2 0.090 9
+ H42 HGA2 0.090 10
+ C5 CG2D1 -0.150 11
+ H51 HGA4 0.150 12
+ C6 CG2D1 -0.150 13
+ H61 HGA4 0.150 14
+ C7 CG331 -0.270 15
+ H71 HGA3 0.090 16
+ H72 HGA3 0.090 17
+ H73 HGA3 0.090 18
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 H21
+ C3 H31
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 C5
+ C5 H51
+ C6 H61
+ C6 C7
+ C7 H71
+ C7 H72
+ C7 H73
+ C2 C3
+ C5 C6
+
+[ DIOL ]
+ [ atoms ]
+ O1 OG3C51 -0.400 0
+ C2 CG3C52 0.160 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ O3 OG3C51 -0.400 4
+ C4 CG3C52 0.050 5
+ H41 HGA2 0.090 6
+ H42 HGA2 0.090 7
+ C5 CG3C52 0.050 8
+ H51 HGA2 0.090 9
+ H52 HGA2 0.090 10
+ [ bonds ]
+ O1 C2
+ C2 O3
+ O3 C4
+ C4 C5
+ C5 O1
+ C2 H21
+ C2 H22
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+
+[ DIOX ]
+ [ atoms ]
+ O1 OG3C61 -0.400 0
+ C2 CG321 0.020 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG321 0.020 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ O4 OG3C61 -0.400 7
+ C5 CG321 0.020 8
+ H51 HGA2 0.090 9
+ H52 HGA2 0.090 10
+ C6 CG321 0.020 11
+ H61 HGA2 0.090 12
+ H62 HGA2 0.090 13
+ [ bonds ]
+ O1 C2
+ C2 C3
+ C3 O4
+ O4 C5
+ C5 C6
+ C6 O1
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C6 H61
+ C6 H62
+ C5 H51
+ C5 H52
+
+[ DIPE ]
+ [ atoms ]
+ C1 CG2D2 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2D1 -0.150 3
+ H21 HGA4 0.150 4
+ C3 CG321 -0.180 5
+ H31 HGA2 0.090 6
+ H32 HGA2 0.090 7
+ C4 CG2D1 -0.150 8
+ H41 HGA4 0.150 9
+ C5 CG2D2 -0.420 10
+ H51 HGA5 0.210 11
+ H52 HGA5 0.210 12
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C5 H51
+ C5 H52
+ C1 C2
+ C4 C5
+
+[ DITH ]
+ [ atoms ]
+ S1 SG311 -0.220 0
+ C2 CG321 -0.070 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG321 -0.070 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ S4 SG311 -0.220 7
+ C5 CG321 -0.070 8
+ H51 HGA2 0.090 9
+ H52 HGA2 0.090 10
+ C6 CG321 -0.070 11
+ H61 HGA2 0.090 12
+ H62 HGA2 0.090 13
+ [ bonds ]
+ S1 C2
+ C2 C3
+ C3 S4
+ S4 C5
+ C5 C6
+ C6 S1
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+
+[ DIXB ]
+ [ atoms ]
+ O1 OG3C61 -0.400 0
+ C2 CG321 0.220 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ O3 OG3C61 -0.400 4
+ C4 CG321 0.020 5
+ H41 HGA2 0.090 6
+ H42 HGA2 0.090 7
+ C5 CG321 -0.180 8
+ H51 HGA2 0.090 9
+ H52 HGA2 0.090 10
+ C6 CG321 0.020 11
+ H61 HGA2 0.090 12
+ H62 HGA2 0.090 13
+ [ bonds ]
+ O1 C2
+ C2 O3
+ O3 C4
+ C4 C5
+ C5 C6
+ C6 O1
+ C2 H21
+ C2 H22
+ C4 H41
+ C4 H42
+ C6 H61
+ C6 H62
+ C5 H51
+ C5 H52
+
+[ DLPA ]
+ [ atoms ]
+ P PL 1.500 0
+ O13 O2L -0.820 1
+ O14 O2L -0.820 2
+ O12 OHL -0.680 3
+ H12 HOL 0.340 4
+ O11 OSLP -0.620 5
+ C1 CTL2 -0.080 6
+ HA HAL2 0.090 7
+ HB HAL2 0.090 8
+ C2 CTL1 0.170 9
+ HS HAL1 0.090 10
+ O21 OSL -0.490 11
+ C21 CL 0.900 12
+ O22 OBL -0.630 13
+ C22 CTL2 -0.220 14
+ H2R HAL2 0.090 15
+ H2S HAL2 0.090 16
+ C3 CTL2 0.080 17
+ HX HAL2 0.090 18
+ HY HAL2 0.090 19
+ O31 OSL -0.490 20
+ C31 CL 0.900 21
+ O32 OBL -0.630 22
+ C32 CTL2 -0.220 23
+ H2X HAL2 0.090 24
+ H2Y HAL2 0.090 25
+ C23 CTL2 -0.180 26
+ H3R HAL2 0.090 27
+ H3S HAL2 0.090 28
+ C24 CTL2 -0.180 29
+ H4R HAL2 0.090 30
+ H4S HAL2 0.090 31
+ C25 CTL2 -0.180 32
+ H5R HAL2 0.090 33
+ H5S HAL2 0.090 34
+ C26 CTL2 -0.180 35
+ H6R HAL2 0.090 36
+ H6S HAL2 0.090 37
+ C27 CTL2 -0.180 38
+ H7R HAL2 0.090 39
+ H7S HAL2 0.090 40
+ C28 CTL2 -0.180 41
+ H8R HAL2 0.090 42
+ H8S HAL2 0.090 43
+ C29 CTL2 -0.180 44
+ H9R HAL2 0.090 45
+ H9S HAL2 0.090 46
+ C210 CTL2 -0.180 47
+ H10R HAL2 0.090 48
+ H10S HAL2 0.090 49
+ C211 CTL2 -0.180 50
+ H11R HAL2 0.090 51
+ H11S HAL2 0.090 52
+ C212 CTL3 -0.270 53
+ H12R HAL3 0.090 54
+ H12S HAL3 0.090 55
+ H12T HAL3 0.090 56
+ C33 CTL2 -0.180 57
+ H3X HAL2 0.090 58
+ H3Y HAL2 0.090 59
+ C34 CTL2 -0.180 60
+ H4X HAL2 0.090 61
+ H4Y HAL2 0.090 62
+ C35 CTL2 -0.180 63
+ H5X HAL2 0.090 64
+ H5Y HAL2 0.090 65
+ C36 CTL2 -0.180 66
+ H6X HAL2 0.090 67
+ H6Y HAL2 0.090 68
+ C37 CTL2 -0.180 69
+ H7X HAL2 0.090 70
+ H7Y HAL2 0.090 71
+ C38 CTL2 -0.180 72
+ H8X HAL2 0.090 73
+ H8Y HAL2 0.090 74
+ C39 CTL2 -0.180 75
+ H9X HAL2 0.090 76
+ H9Y HAL2 0.090 77
+ C310 CTL2 -0.180 78
+ H10X HAL2 0.090 79
+ H10Y HAL2 0.090 80
+ C311 CTL2 -0.180 81
+ H11X HAL2 0.090 82
+ H11Y HAL2 0.090 83
+ C312 CTL3 -0.270 84
+ H12X HAL3 0.090 85
+ H12Y HAL3 0.090 86
+ H12Z HAL3 0.090 87
+ [ bonds ]
+ O12 P
+ P O11
+ P O13
+ P O14
+ O12 H12
+ O11 C1
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 H12T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 H12Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DLPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C13 CTL5 -0.350 1
+ H13A HL 0.250 2
+ H13B HL 0.250 3
+ H13C HL 0.250 4
+ C14 CTL5 -0.350 5
+ H14A HL 0.250 6
+ H14B HL 0.250 7
+ H14C HL 0.250 8
+ C15 CTL5 -0.350 9
+ H15A HL 0.250 10
+ H15B HL 0.250 11
+ H15C HL 0.250 12
+ C12 CTL2 -0.100 13
+ H12A HL 0.250 14
+ H12B HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O11 OSLP -0.570 22
+ O12 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CTL2 -0.180 50
+ H5R HAL2 0.090 51
+ H5S HAL2 0.090 52
+ C26 CTL2 -0.180 53
+ H6R HAL2 0.090 54
+ H6S HAL2 0.090 55
+ C27 CTL2 -0.180 56
+ H7R HAL2 0.090 57
+ H7S HAL2 0.090 58
+ C28 CTL2 -0.180 59
+ H8R HAL2 0.090 60
+ H8S HAL2 0.090 61
+ C29 CTL2 -0.180 62
+ H9R HAL2 0.090 63
+ H9S HAL2 0.090 64
+ C210 CTL2 -0.180 65
+ H10R HAL2 0.090 66
+ H10S HAL2 0.090 67
+ C211 CTL2 -0.180 68
+ H11R HAL2 0.090 69
+ H11S HAL2 0.090 70
+ C212 CTL3 -0.270 71
+ H12R HAL3 0.090 72
+ H12S HAL3 0.090 73
+ H12T HAL3 0.090 74
+ C33 CTL2 -0.180 75
+ H3X HAL2 0.090 76
+ H3Y HAL2 0.090 77
+ C34 CTL2 -0.180 78
+ H4X HAL2 0.090 79
+ H4Y HAL2 0.090 80
+ C35 CTL2 -0.180 81
+ H5X HAL2 0.090 82
+ H5Y HAL2 0.090 83
+ C36 CTL2 -0.180 84
+ H6X HAL2 0.090 85
+ H6Y HAL2 0.090 86
+ C37 CTL2 -0.180 87
+ H7X HAL2 0.090 88
+ H7Y HAL2 0.090 89
+ C38 CTL2 -0.180 90
+ H8X HAL2 0.090 91
+ H8Y HAL2 0.090 92
+ C39 CTL2 -0.180 93
+ H9X HAL2 0.090 94
+ H9Y HAL2 0.090 95
+ C310 CTL2 -0.180 96
+ H10X HAL2 0.090 97
+ H10Y HAL2 0.090 98
+ C311 CTL2 -0.180 99
+ H11X HAL2 0.090 100
+ H11Y HAL2 0.090 101
+ C312 CTL3 -0.270 102
+ H12X HAL3 0.090 103
+ H12Y HAL3 0.090 104
+ H12Z HAL3 0.090 105
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 H12T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 H12Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DLPE ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL2 0.130 4
+ H12A HAL2 0.090 5
+ H12B HAL2 0.090 6
+ C11 CTL2 -0.080 7
+ H11A HAL2 0.090 8
+ H11B HAL2 0.090 9
+ P PL 1.500 10
+ O13 O2L -0.780 11
+ O14 O2L -0.780 12
+ O11 OSLP -0.570 13
+ O12 OSLP -0.570 14
+ C1 CTL2 -0.080 15
+ HA HAL2 0.090 16
+ HB HAL2 0.090 17
+ C2 CTL1 0.170 18
+ HS HAL1 0.090 19
+ O21 OSL -0.490 20
+ C21 CL 0.900 21
+ O22 OBL -0.630 22
+ C22 CTL2 -0.220 23
+ H2R HAL2 0.090 24
+ H2S HAL2 0.090 25
+ C3 CTL2 0.080 26
+ HX HAL2 0.090 27
+ HY HAL2 0.090 28
+ O31 OSL -0.490 29
+ C31 CL 0.900 30
+ O32 OBL -0.630 31
+ C32 CTL2 -0.220 32
+ H2X HAL2 0.090 33
+ H2Y HAL2 0.090 34
+ C23 CTL2 -0.180 35
+ H3R HAL2 0.090 36
+ H3S HAL2 0.090 37
+ C24 CTL2 -0.180 38
+ H4R HAL2 0.090 39
+ H4S HAL2 0.090 40
+ C25 CTL2 -0.180 41
+ H5R HAL2 0.090 42
+ H5S HAL2 0.090 43
+ C26 CTL2 -0.180 44
+ H6R HAL2 0.090 45
+ H6S HAL2 0.090 46
+ C27 CTL2 -0.180 47
+ H7R HAL2 0.090 48
+ H7S HAL2 0.090 49
+ C28 CTL2 -0.180 50
+ H8R HAL2 0.090 51
+ H8S HAL2 0.090 52
+ C29 CTL2 -0.180 53
+ H9R HAL2 0.090 54
+ H9S HAL2 0.090 55
+ C210 CTL2 -0.180 56
+ H10R HAL2 0.090 57
+ H10S HAL2 0.090 58
+ C211 CTL2 -0.180 59
+ H11R HAL2 0.090 60
+ H11S HAL2 0.090 61
+ C212 CTL3 -0.270 62
+ H12R HAL3 0.090 63
+ H12S HAL3 0.090 64
+ H12T HAL3 0.090 65
+ C33 CTL2 -0.180 66
+ H3X HAL2 0.090 67
+ H3Y HAL2 0.090 68
+ C34 CTL2 -0.180 69
+ H4X HAL2 0.090 70
+ H4Y HAL2 0.090 71
+ C35 CTL2 -0.180 72
+ H5X HAL2 0.090 73
+ H5Y HAL2 0.090 74
+ C36 CTL2 -0.180 75
+ H6X HAL2 0.090 76
+ H6Y HAL2 0.090 77
+ C37 CTL2 -0.180 78
+ H7X HAL2 0.090 79
+ H7Y HAL2 0.090 80
+ C38 CTL2 -0.180 81
+ H8X HAL2 0.090 82
+ H8Y HAL2 0.090 83
+ C39 CTL2 -0.180 84
+ H9X HAL2 0.090 85
+ H9Y HAL2 0.090 86
+ C310 CTL2 -0.180 87
+ H10X HAL2 0.090 88
+ H10Y HAL2 0.090 89
+ C311 CTL2 -0.180 90
+ H11X HAL2 0.090 91
+ H11Y HAL2 0.090 92
+ C312 CTL3 -0.270 93
+ H12X HAL3 0.090 94
+ H12Y HAL3 0.090 95
+ H12Z HAL3 0.090 96
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 H12T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 H12Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DLPG ]
+ [ atoms ]
+ C13 CTL2 0.050 0
+ H13A HAL2 0.090 1
+ H13B HAL2 0.090 2
+ OC3 OHL -0.650 3
+ HO3 HOL 0.420 4
+ C12 CTL1 0.140 5
+ H12A HAL1 0.090 6
+ OC2 OHL -0.650 7
+ HO2 HOL 0.420 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CTL2 -0.180 55
+ H9R HAL2 0.090 56
+ H9S HAL2 0.090 57
+ C210 CTL2 -0.180 58
+ H10R HAL2 0.090 59
+ H10S HAL2 0.090 60
+ C211 CTL2 -0.180 61
+ H11R HAL2 0.090 62
+ H11S HAL2 0.090 63
+ C212 CTL3 -0.270 64
+ H12R HAL3 0.090 65
+ H12S HAL3 0.090 66
+ H12T HAL3 0.090 67
+ C33 CTL2 -0.180 68
+ H3X HAL2 0.090 69
+ H3Y HAL2 0.090 70
+ C34 CTL2 -0.180 71
+ H4X HAL2 0.090 72
+ H4Y HAL2 0.090 73
+ C35 CTL2 -0.180 74
+ H5X HAL2 0.090 75
+ H5Y HAL2 0.090 76
+ C36 CTL2 -0.180 77
+ H6X HAL2 0.090 78
+ H6Y HAL2 0.090 79
+ C37 CTL2 -0.180 80
+ H7X HAL2 0.090 81
+ H7Y HAL2 0.090 82
+ C38 CTL2 -0.180 83
+ H8X HAL2 0.090 84
+ H8Y HAL2 0.090 85
+ C39 CTL2 -0.180 86
+ H9X HAL2 0.090 87
+ H9Y HAL2 0.090 88
+ C310 CTL2 -0.180 89
+ H10X HAL2 0.090 90
+ H10Y HAL2 0.090 91
+ C311 CTL2 -0.180 92
+ H11X HAL2 0.090 93
+ H11Y HAL2 0.090 94
+ C312 CTL3 -0.270 95
+ H12X HAL3 0.090 96
+ H12Y HAL3 0.090 97
+ H12Z HAL3 0.090 98
+ [ bonds ]
+ HO3 OC3
+ OC3 C13
+ C13 H13A
+ C13 H13B
+ C13 C12
+ HO2 OC2
+ OC2 C12
+ C12 H12A
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 H12T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 H12Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DLPS ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL1 0.210 4
+ H12A HBL 0.100 5
+ C13 CCL 0.340 6
+ O13A OCL -0.670 7
+ O13B OCL -0.670 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CTL2 -0.180 55
+ H9R HAL2 0.090 56
+ H9S HAL2 0.090 57
+ C210 CTL2 -0.180 58
+ H10R HAL2 0.090 59
+ H10S HAL2 0.090 60
+ C211 CTL2 -0.180 61
+ H11R HAL2 0.090 62
+ H11S HAL2 0.090 63
+ C212 CTL3 -0.270 64
+ H12R HAL3 0.090 65
+ H12S HAL3 0.090 66
+ H12T HAL3 0.090 67
+ C33 CTL2 -0.180 68
+ H3X HAL2 0.090 69
+ H3Y HAL2 0.090 70
+ C34 CTL2 -0.180 71
+ H4X HAL2 0.090 72
+ H4Y HAL2 0.090 73
+ C35 CTL2 -0.180 74
+ H5X HAL2 0.090 75
+ H5Y HAL2 0.090 76
+ C36 CTL2 -0.180 77
+ H6X HAL2 0.090 78
+ H6Y HAL2 0.090 79
+ C37 CTL2 -0.180 80
+ H7X HAL2 0.090 81
+ H7Y HAL2 0.090 82
+ C38 CTL2 -0.180 83
+ H8X HAL2 0.090 84
+ H8Y HAL2 0.090 85
+ C39 CTL2 -0.180 86
+ H9X HAL2 0.090 87
+ H9Y HAL2 0.090 88
+ C310 CTL2 -0.180 89
+ H10X HAL2 0.090 90
+ H10Y HAL2 0.090 91
+ C311 CTL2 -0.180 92
+ H11X HAL2 0.090 93
+ H11Y HAL2 0.090 94
+ C312 CTL3 -0.270 95
+ H12X HAL3 0.090 96
+ H12Y HAL3 0.090 97
+ H12Z HAL3 0.090 98
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ O13B C13
+ C13 C12
+ C12 H12A
+ C12 C11
+ C1 O11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 H12T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 H12Z
+ C13 O13A
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+ C13 C12 O13B O13A
+
+[ DMA ]
+ [ atoms ]
+ C CG2O1 0.430 0
+ O OG2D1 -0.520 1
+ N NG2S0 -0.350 2
+ C1 CG331 -0.190 3
+ H11 HGA3 0.090 4
+ H12 HGA3 0.090 5
+ H13 HGA3 0.090 6
+ C2 CG331 -0.090 7
+ H21 HGA3 0.090 8
+ H22 HGA3 0.090 9
+ H23 HGA3 0.090 10
+ C3 CG331 -0.090 11
+ H31 HGA3 0.090 12
+ H32 HGA3 0.090 13
+ H33 HGA3 0.090 14
+ [ bonds ]
+ H11 C1
+ H12 C1
+ H13 C1
+ H21 C2
+ H22 C2
+ H23 C2
+ H31 C3
+ H32 C3
+ H33 C3
+ C C1
+ C N
+ N C2
+ N C3
+ C O
+ [ impropers ]
+ C C1 N O
+
+[ DMAM ]
+ [ atoms ]
+ N1 NG311 -0.820 0
+ HN1 HGPAM1 0.400 1
+ C1 CG3AM1 -0.060 2
+ C2 CG3AM1 -0.060 3
+ H11 HGAAM1 0.090 4
+ H12 HGAAM1 0.090 5
+ H13 HGAAM1 0.090 6
+ H21 HGAAM1 0.090 7
+ H22 HGAAM1 0.090 8
+ H23 HGAAM1 0.090 9
+ [ bonds ]
+ N1 HN1
+ N1 C1
+ N1 C2
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ DMANOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ DMB1 ]
+ [ atoms ]
+ C1 CG2DC3 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2DC2 0.000 3
+ C2M CG331 -0.270 4
+ H2M1 HGA3 0.090 5
+ H2M2 HGA3 0.090 6
+ H2M3 HGA3 0.090 7
+ C3 CG2DC1 -0.150 8
+ H31 HGA4 0.150 9
+ C4 CG2DC3 -0.420 10
+ H41 HGA5 0.210 11
+ H42 HGA5 0.210 12
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C2 C2M
+ C1 H11
+ C1 H12
+ C3 H31
+ C4 H41
+ C4 H42
+ C2M H2M1
+ C2M H2M2
+ C2M H2M3
+
+[ DMBU ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C6 CG331 -0.060 4
+ H61 HGA3 0.090 5
+ H62 HGA3 0.090 6
+ H63 HGA3 0.090 7
+ O5 OG301 -0.340 8
+ C2 CG301 0.260 9
+ O7 OG301 -0.340 10
+ C8 CG331 -0.060 11
+ H81 HGA3 0.090 12
+ H82 HGA3 0.090 13
+ H83 HGA3 0.090 14
+ C3 CG321 -0.180 15
+ H31 HGA2 0.090 16
+ H32 HGA2 0.090 17
+ C4 CG331 -0.270 18
+ H41 HGA3 0.090 19
+ H42 HGA3 0.090 20
+ H43 HGA3 0.090 21
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C2 O5
+ O5 C6
+ C2 O7
+ O7 C8
+ C1 H11
+ C1 H12
+ C1 H13
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C4 H43
+ C6 H61
+ C6 H62
+ C6 H63
+ C8 H81
+ C8 H82
+ C8 H83
+
+[ DMCA ]
+ [ atoms ]
+ C1 CG331 0.050 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ O1 OG302 -0.240 4
+ C CG2O6 0.230 5
+ O OG2D1 -0.390 6
+ O2 OG302 -0.240 7
+ C2 CG331 0.050 8
+ H21 HGA3 0.090 9
+ H22 HGA3 0.090 10
+ H23 HGA3 0.090 11
+ [ bonds ]
+ C1 O1
+ O1 C
+ C O2
+ O2 C2
+ C O
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+ [ impropers ]
+ C O1 O2 O
+
+[ DMCB ]
+ [ atoms ]
+ C1 CG331 -0.040 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ N2 NG2S1 -0.380 4
+ H2 HGP1 0.320 5
+ C3 CG2O6 0.200 6
+ O31 OG2D1 -0.390 7
+ O32 OG302 -0.320 8
+ C4 CG331 0.070 9
+ H41 HGA3 0.090 10
+ H42 HGA3 0.090 11
+ H43 HGA3 0.090 12
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 N2
+ N2 H2
+ N2 C3
+ C3 O31
+ C3 O32
+ O32 C4
+ C4 H41
+ C4 H42
+ C4 H43
+ [ impropers ]
+ C3 N2 O31 O32
+
+[ DMDS ]
+ [ atoms ]
+ H1 HGA3 0.090 0
+ H2 HGA3 0.090 1
+ H3 HGA3 0.090 2
+ CM1 CG331 -0.190 3
+ S2 SG301 -0.080 4
+ S3 SG301 -0.080 5
+ CM4 CG331 -0.190 6
+ H4 HGA3 0.090 7
+ H5 HGA3 0.090 8
+ H6 HGA3 0.090 9
+ [ bonds ]
+ H1 CM1
+ H2 CM1
+ H3 CM1
+ CM1 S2
+ S2 S3
+ S3 CM4
+ CM4 H4
+ CM4 H5
+ CM4 H6
+
+[ DME ]
+ [ atoms ]
+ C1 CC33A -0.100 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ O2 OC30A -0.340 4
+ C3 CC32A -0.010 5
+ H31 HCA2A 0.090 6
+ H32 HCA2A 0.090 7
+ C4 CC32A -0.010 8
+ H41 HCA2A 0.090 9
+ H42 HCA2A 0.090 10
+ O5 OC30A -0.340 11
+ C6 CC33A -0.100 12
+ H61 HCA3A 0.090 13
+ H62 HCA3A 0.090 14
+ H63 HCA3A 0.090 15
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 O2
+ O2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 O5
+ O5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ DMEE ]
+ [ atoms ]
+ C1 CG331 -0.100 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ O2 OG301 -0.340 4
+ C3 CG331 -0.100 5
+ H31 HGA3 0.090 6
+ H32 HGA3 0.090 7
+ H33 HGA3 0.090 8
+ [ bonds ]
+ C1 O2
+ O2 C3
+ C1 H11
+ C1 H12
+ C1 H13
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ DMEP ]
+ [ atoms ]
+ P1 PG1 1.500 0
+ O3 OG2P1 -0.780 1
+ O4 OG2P1 -0.780 2
+ O1 OG303 -0.570 3
+ O2 OG303 -0.570 4
+ C1 CG331 -0.170 5
+ H11 HGA3 0.090 6
+ H12 HGA3 0.090 7
+ H13 HGA3 0.090 8
+ C2 CG331 -0.170 9
+ H21 HGA3 0.090 10
+ H22 HGA3 0.090 11
+ H23 HGA3 0.090 12
+ [ bonds ]
+ P1 O1
+ P1 O2
+ P1 O3
+ P1 O4
+ O1 C1
+ O2 C2
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ DMET ]
+ [ atoms ]
+ C1 CC33A -0.100 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ O2 OC30A -0.340 4
+ C3 CC33A -0.100 5
+ H31 HCA3A 0.090 6
+ H32 HCA3A 0.090 7
+ H33 HCA3A 0.090 8
+ [ bonds ]
+ C1 O2
+ O2 C3
+ C1 H11
+ C1 H12
+ C1 H13
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ DMF ]
+ [ atoms ]
+ HA HGR52 0.080 0
+ C CG2O1 0.430 1
+ O OG2D1 -0.540 2
+ N NG2S0 -0.330 3
+ CC CG331 -0.090 4
+ HC1 HGA3 0.090 5
+ HC2 HGA3 0.090 6
+ HC3 HGA3 0.090 7
+ CT CG331 -0.090 8
+ HT1 HGA3 0.090 9
+ HT2 HGA3 0.090 10
+ HT3 HGA3 0.090 11
+ [ bonds ]
+ HT1 CT
+ HT2 CT
+ HT3 CT
+ C HA
+ C N
+ N CC
+ N CT
+ HC1 CC
+ HC2 CC
+ HC3 CC
+ C O
+ [ impropers ]
+ C N O HA
+
+[ DMOP ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG301 0.400 4
+ O4 OG301 -0.380 5
+ C5 CG331 -0.090 6
+ H51 HGA3 0.090 7
+ H52 HGA3 0.090 8
+ H53 HGA3 0.090 9
+ O6 OG301 -0.380 10
+ C7 CG331 -0.090 11
+ H71 HGA3 0.090 12
+ H72 HGA3 0.090 13
+ H73 HGA3 0.090 14
+ C3 CG331 -0.270 15
+ H31 HGA3 0.090 16
+ H32 HGA3 0.090 17
+ H33 HGA3 0.090 18
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C2 O4
+ O4 C5
+ C2 O6
+ O6 C7
+ C1 H11
+ C1 H12
+ C1 H13
+ C3 H31
+ C3 H32
+ C3 H33
+ C5 H51
+ C5 H52
+ C5 H53
+ C7 H71
+ C7 H72
+ C7 H73
+
+[ DMP1 ]
+ [ atoms ]
+ C1 CG2DC3 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2DC2 -0.150 3
+ H21 HGA4 0.150 4
+ C3 CG2DC1 -0.150 5
+ H31 HGA4 0.150 6
+ C4 CG2DC1 0.000 7
+ C4M CG331 -0.270 8
+ H4M1 HGA3 0.090 9
+ H4M2 HGA3 0.090 10
+ H4M3 HGA3 0.090 11
+ C5 CG331 -0.270 12
+ H51 HGA3 0.090 13
+ H52 HGA3 0.090 14
+ H53 HGA3 0.090 15
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C4 C4M
+ C1 H11
+ C1 H12
+ C2 H21
+ C3 H31
+ C4M H4M1
+ C4M H4M2
+ C4M H4M3
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ DMP2 ]
+ [ atoms ]
+ C1 CG2DC3 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2DC2 0.000 3
+ C2M CG331 -0.270 4
+ H2M1 HGA3 0.090 5
+ H2M2 HGA3 0.090 6
+ H2M3 HGA3 0.090 7
+ C3 CG2DC1 -0.150 8
+ H31 HGA4 0.150 9
+ C4 CG2DC1 -0.150 10
+ H41 HGA4 0.150 11
+ C5 CG331 -0.270 12
+ H51 HGA3 0.090 13
+ H52 HGA3 0.090 14
+ H53 HGA3 0.090 15
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C2 C2M
+ C1 H11
+ C1 H12
+ C3 H31
+ C4 H41
+ C2M H2M1
+ C2M H2M2
+ C2M H2M3
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ DMPA ]
+ [ atoms ]
+ P PL 1.500 0
+ O13 O2L -0.820 1
+ O14 O2L -0.820 2
+ O12 OHL -0.680 3
+ H12 HOL 0.340 4
+ O11 OSLP -0.620 5
+ C1 CTL2 -0.080 6
+ HA HAL2 0.090 7
+ HB HAL2 0.090 8
+ C2 CTL1 0.170 9
+ HS HAL1 0.090 10
+ O21 OSL -0.490 11
+ C21 CL 0.900 12
+ O22 OBL -0.630 13
+ C22 CTL2 -0.220 14
+ H2R HAL2 0.090 15
+ H2S HAL2 0.090 16
+ C3 CTL2 0.080 17
+ HX HAL2 0.090 18
+ HY HAL2 0.090 19
+ O31 OSL -0.490 20
+ C31 CL 0.900 21
+ O32 OBL -0.630 22
+ C32 CTL2 -0.220 23
+ H2X HAL2 0.090 24
+ H2Y HAL2 0.090 25
+ C23 CTL2 -0.180 26
+ H3R HAL2 0.090 27
+ H3S HAL2 0.090 28
+ C24 CTL2 -0.180 29
+ H4R HAL2 0.090 30
+ H4S HAL2 0.090 31
+ C25 CTL2 -0.180 32
+ H5R HAL2 0.090 33
+ H5S HAL2 0.090 34
+ C26 CTL2 -0.180 35
+ H6R HAL2 0.090 36
+ H6S HAL2 0.090 37
+ C27 CTL2 -0.180 38
+ H7R HAL2 0.090 39
+ H7S HAL2 0.090 40
+ C28 CTL2 -0.180 41
+ H8R HAL2 0.090 42
+ H8S HAL2 0.090 43
+ C29 CTL2 -0.180 44
+ H9R HAL2 0.090 45
+ H9S HAL2 0.090 46
+ C210 CTL2 -0.180 47
+ H10R HAL2 0.090 48
+ H10S HAL2 0.090 49
+ C211 CTL2 -0.180 50
+ H11R HAL2 0.090 51
+ H11S HAL2 0.090 52
+ C212 CTL2 -0.180 53
+ H12R HAL2 0.090 54
+ H12S HAL2 0.090 55
+ C213 CTL2 -0.180 56
+ H13R HAL2 0.090 57
+ H13S HAL2 0.090 58
+ C214 CTL3 -0.270 59
+ H14R HAL3 0.090 60
+ H14S HAL3 0.090 61
+ H14T HAL3 0.090 62
+ C33 CTL2 -0.180 63
+ H3X HAL2 0.090 64
+ H3Y HAL2 0.090 65
+ C34 CTL2 -0.180 66
+ H4X HAL2 0.090 67
+ H4Y HAL2 0.090 68
+ C35 CTL2 -0.180 69
+ H5X HAL2 0.090 70
+ H5Y HAL2 0.090 71
+ C36 CTL2 -0.180 72
+ H6X HAL2 0.090 73
+ H6Y HAL2 0.090 74
+ C37 CTL2 -0.180 75
+ H7X HAL2 0.090 76
+ H7Y HAL2 0.090 77
+ C38 CTL2 -0.180 78
+ H8X HAL2 0.090 79
+ H8Y HAL2 0.090 80
+ C39 CTL2 -0.180 81
+ H9X HAL2 0.090 82
+ H9Y HAL2 0.090 83
+ C310 CTL2 -0.180 84
+ H10X HAL2 0.090 85
+ H10Y HAL2 0.090 86
+ C311 CTL2 -0.180 87
+ H11X HAL2 0.090 88
+ H11Y HAL2 0.090 89
+ C312 CTL2 -0.180 90
+ H12X HAL2 0.090 91
+ H12Y HAL2 0.090 92
+ C313 CTL2 -0.180 93
+ H13X HAL2 0.090 94
+ H13Y HAL2 0.090 95
+ C314 CTL3 -0.270 96
+ H14X HAL3 0.090 97
+ H14Y HAL3 0.090 98
+ H14Z HAL3 0.090 99
+ [ bonds ]
+ O12 P
+ P O11
+ P O13
+ P O14
+ O12 H12
+ O11 C1
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 H14T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 H14Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DMPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C13 CTL5 -0.350 1
+ H13A HL 0.250 2
+ H13B HL 0.250 3
+ H13C HL 0.250 4
+ C14 CTL5 -0.350 5
+ H14A HL 0.250 6
+ H14B HL 0.250 7
+ H14C HL 0.250 8
+ C15 CTL5 -0.350 9
+ H15A HL 0.250 10
+ H15B HL 0.250 11
+ H15C HL 0.250 12
+ C12 CTL2 -0.100 13
+ H12A HL 0.250 14
+ H12B HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O11 OSLP -0.570 22
+ O12 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CTL2 -0.180 50
+ H5R HAL2 0.090 51
+ H5S HAL2 0.090 52
+ C26 CTL2 -0.180 53
+ H6R HAL2 0.090 54
+ H6S HAL2 0.090 55
+ C27 CTL2 -0.180 56
+ H7R HAL2 0.090 57
+ H7S HAL2 0.090 58
+ C28 CTL2 -0.180 59
+ H8R HAL2 0.090 60
+ H8S HAL2 0.090 61
+ C29 CTL2 -0.180 62
+ H9R HAL2 0.090 63
+ H9S HAL2 0.090 64
+ C210 CTL2 -0.180 65
+ H10R HAL2 0.090 66
+ H10S HAL2 0.090 67
+ C211 CTL2 -0.180 68
+ H11R HAL2 0.090 69
+ H11S HAL2 0.090 70
+ C212 CTL2 -0.180 71
+ H12R HAL2 0.090 72
+ H12S HAL2 0.090 73
+ C213 CTL2 -0.180 74
+ H13R HAL2 0.090 75
+ H13S HAL2 0.090 76
+ C214 CTL3 -0.270 77
+ H14R HAL3 0.090 78
+ H14S HAL3 0.090 79
+ H14T HAL3 0.090 80
+ C33 CTL2 -0.180 81
+ H3X HAL2 0.090 82
+ H3Y HAL2 0.090 83
+ C34 CTL2 -0.180 84
+ H4X HAL2 0.090 85
+ H4Y HAL2 0.090 86
+ C35 CTL2 -0.180 87
+ H5X HAL2 0.090 88
+ H5Y HAL2 0.090 89
+ C36 CTL2 -0.180 90
+ H6X HAL2 0.090 91
+ H6Y HAL2 0.090 92
+ C37 CTL2 -0.180 93
+ H7X HAL2 0.090 94
+ H7Y HAL2 0.090 95
+ C38 CTL2 -0.180 96
+ H8X HAL2 0.090 97
+ H8Y HAL2 0.090 98
+ C39 CTL2 -0.180 99
+ H9X HAL2 0.090 100
+ H9Y HAL2 0.090 101
+ C310 CTL2 -0.180 102
+ H10X HAL2 0.090 103
+ H10Y HAL2 0.090 104
+ C311 CTL2 -0.180 105
+ H11X HAL2 0.090 106
+ H11Y HAL2 0.090 107
+ C312 CTL2 -0.180 108
+ H12X HAL2 0.090 109
+ H12Y HAL2 0.090 110
+ C313 CTL2 -0.180 111
+ H13X HAL2 0.090 112
+ H13Y HAL2 0.090 113
+ C314 CTL3 -0.270 114
+ H14X HAL3 0.090 115
+ H14Y HAL3 0.090 116
+ H14Z HAL3 0.090 117
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 H14T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 H14Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DMPE ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL2 0.130 4
+ H12A HAL2 0.090 5
+ H12B HAL2 0.090 6
+ C11 CTL2 -0.080 7
+ H11A HAL2 0.090 8
+ H11B HAL2 0.090 9
+ P PL 1.500 10
+ O13 O2L -0.780 11
+ O14 O2L -0.780 12
+ O11 OSLP -0.570 13
+ O12 OSLP -0.570 14
+ C1 CTL2 -0.080 15
+ HA HAL2 0.090 16
+ HB HAL2 0.090 17
+ C2 CTL1 0.170 18
+ HS HAL1 0.090 19
+ O21 OSL -0.490 20
+ C21 CL 0.900 21
+ O22 OBL -0.630 22
+ C22 CTL2 -0.220 23
+ H2R HAL2 0.090 24
+ H2S HAL2 0.090 25
+ C3 CTL2 0.080 26
+ HX HAL2 0.090 27
+ HY HAL2 0.090 28
+ O31 OSL -0.490 29
+ C31 CL 0.900 30
+ O32 OBL -0.630 31
+ C32 CTL2 -0.220 32
+ H2X HAL2 0.090 33
+ H2Y HAL2 0.090 34
+ C23 CTL2 -0.180 35
+ H3R HAL2 0.090 36
+ H3S HAL2 0.090 37
+ C24 CTL2 -0.180 38
+ H4R HAL2 0.090 39
+ H4S HAL2 0.090 40
+ C25 CTL2 -0.180 41
+ H5R HAL2 0.090 42
+ H5S HAL2 0.090 43
+ C26 CTL2 -0.180 44
+ H6R HAL2 0.090 45
+ H6S HAL2 0.090 46
+ C27 CTL2 -0.180 47
+ H7R HAL2 0.090 48
+ H7S HAL2 0.090 49
+ C28 CTL2 -0.180 50
+ H8R HAL2 0.090 51
+ H8S HAL2 0.090 52
+ C29 CTL2 -0.180 53
+ H9R HAL2 0.090 54
+ H9S HAL2 0.090 55
+ C210 CTL2 -0.180 56
+ H10R HAL2 0.090 57
+ H10S HAL2 0.090 58
+ C211 CTL2 -0.180 59
+ H11R HAL2 0.090 60
+ H11S HAL2 0.090 61
+ C212 CTL2 -0.180 62
+ H12R HAL2 0.090 63
+ H12S HAL2 0.090 64
+ C213 CTL2 -0.180 65
+ H13R HAL2 0.090 66
+ H13S HAL2 0.090 67
+ C214 CTL3 -0.270 68
+ H14R HAL3 0.090 69
+ H14S HAL3 0.090 70
+ H14T HAL3 0.090 71
+ C33 CTL2 -0.180 72
+ H3X HAL2 0.090 73
+ H3Y HAL2 0.090 74
+ C34 CTL2 -0.180 75
+ H4X HAL2 0.090 76
+ H4Y HAL2 0.090 77
+ C35 CTL2 -0.180 78
+ H5X HAL2 0.090 79
+ H5Y HAL2 0.090 80
+ C36 CTL2 -0.180 81
+ H6X HAL2 0.090 82
+ H6Y HAL2 0.090 83
+ C37 CTL2 -0.180 84
+ H7X HAL2 0.090 85
+ H7Y HAL2 0.090 86
+ C38 CTL2 -0.180 87
+ H8X HAL2 0.090 88
+ H8Y HAL2 0.090 89
+ C39 CTL2 -0.180 90
+ H9X HAL2 0.090 91
+ H9Y HAL2 0.090 92
+ C310 CTL2 -0.180 93
+ H10X HAL2 0.090 94
+ H10Y HAL2 0.090 95
+ C311 CTL2 -0.180 96
+ H11X HAL2 0.090 97
+ H11Y HAL2 0.090 98
+ C312 CTL2 -0.180 99
+ H12X HAL2 0.090 100
+ H12Y HAL2 0.090 101
+ C313 CTL2 -0.180 102
+ H13X HAL2 0.090 103
+ H13Y HAL2 0.090 104
+ C314 CTL3 -0.270 105
+ H14X HAL3 0.090 106
+ H14Y HAL3 0.090 107
+ H14Z HAL3 0.090 108
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 H14T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 H14Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DMPG ]
+ [ atoms ]
+ C13 CTL2 0.050 0
+ H13A HAL2 0.090 1
+ H13B HAL2 0.090 2
+ OC3 OHL -0.650 3
+ HO3 HOL 0.420 4
+ C12 CTL1 0.140 5
+ H12A HAL1 0.090 6
+ OC2 OHL -0.650 7
+ HO2 HOL 0.420 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CTL2 -0.180 55
+ H9R HAL2 0.090 56
+ H9S HAL2 0.090 57
+ C210 CTL2 -0.180 58
+ H10R HAL2 0.090 59
+ H10S HAL2 0.090 60
+ C211 CTL2 -0.180 61
+ H11R HAL2 0.090 62
+ H11S HAL2 0.090 63
+ C212 CTL2 -0.180 64
+ H12R HAL2 0.090 65
+ H12S HAL2 0.090 66
+ C213 CTL2 -0.180 67
+ H13R HAL2 0.090 68
+ H13S HAL2 0.090 69
+ C214 CTL3 -0.270 70
+ H14R HAL3 0.090 71
+ H14S HAL3 0.090 72
+ H14T HAL3 0.090 73
+ C33 CTL2 -0.180 74
+ H3X HAL2 0.090 75
+ H3Y HAL2 0.090 76
+ C34 CTL2 -0.180 77
+ H4X HAL2 0.090 78
+ H4Y HAL2 0.090 79
+ C35 CTL2 -0.180 80
+ H5X HAL2 0.090 81
+ H5Y HAL2 0.090 82
+ C36 CTL2 -0.180 83
+ H6X HAL2 0.090 84
+ H6Y HAL2 0.090 85
+ C37 CTL2 -0.180 86
+ H7X HAL2 0.090 87
+ H7Y HAL2 0.090 88
+ C38 CTL2 -0.180 89
+ H8X HAL2 0.090 90
+ H8Y HAL2 0.090 91
+ C39 CTL2 -0.180 92
+ H9X HAL2 0.090 93
+ H9Y HAL2 0.090 94
+ C310 CTL2 -0.180 95
+ H10X HAL2 0.090 96
+ H10Y HAL2 0.090 97
+ C311 CTL2 -0.180 98
+ H11X HAL2 0.090 99
+ H11Y HAL2 0.090 100
+ C312 CTL2 -0.180 101
+ H12X HAL2 0.090 102
+ H12Y HAL2 0.090 103
+ C313 CTL2 -0.180 104
+ H13X HAL2 0.090 105
+ H13Y HAL2 0.090 106
+ C314 CTL3 -0.270 107
+ H14X HAL3 0.090 108
+ H14Y HAL3 0.090 109
+ H14Z HAL3 0.090 110
+ [ bonds ]
+ HO3 OC3
+ OC3 C13
+ C13 H13A
+ C13 H13B
+ C13 C12
+ HO2 OC2
+ OC2 C12
+ C12 H12A
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 H14T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 H14Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DMPR ]
+ [ atoms ]
+ C CG2O1 0.430 0
+ O OG2D1 -0.520 1
+ N NG2S0 -0.350 2
+ C1 CG321 -0.100 3
+ H11 HGA2 0.090 4
+ H12 HGA2 0.090 5
+ C2 CG331 -0.090 6
+ H21 HGA3 0.090 7
+ H22 HGA3 0.090 8
+ H23 HGA3 0.090 9
+ C3 CG331 -0.090 10
+ H31 HGA3 0.090 11
+ H32 HGA3 0.090 12
+ H33 HGA3 0.090 13
+ C4 CG331 -0.270 14
+ H41 HGA3 0.090 15
+ H42 HGA3 0.090 16
+ H43 HGA3 0.090 17
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 C4
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+ C C1
+ C N
+ N C2
+ N C3
+ C4 H41
+ C4 H42
+ C4 H43
+ C O
+ [ impropers ]
+ C C1 N O
+
+[ DMPS ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL1 0.210 4
+ H12A HBL 0.100 5
+ C13 CCL 0.340 6
+ O13A OCL -0.670 7
+ O13B OCL -0.670 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CTL2 -0.180 55
+ H9R HAL2 0.090 56
+ H9S HAL2 0.090 57
+ C210 CTL2 -0.180 58
+ H10R HAL2 0.090 59
+ H10S HAL2 0.090 60
+ C211 CTL2 -0.180 61
+ H11R HAL2 0.090 62
+ H11S HAL2 0.090 63
+ C212 CTL2 -0.180 64
+ H12R HAL2 0.090 65
+ H12S HAL2 0.090 66
+ C213 CTL2 -0.180 67
+ H13R HAL2 0.090 68
+ H13S HAL2 0.090 69
+ C214 CTL3 -0.270 70
+ H14R HAL3 0.090 71
+ H14S HAL3 0.090 72
+ H14T HAL3 0.090 73
+ C33 CTL2 -0.180 74
+ H3X HAL2 0.090 75
+ H3Y HAL2 0.090 76
+ C34 CTL2 -0.180 77
+ H4X HAL2 0.090 78
+ H4Y HAL2 0.090 79
+ C35 CTL2 -0.180 80
+ H5X HAL2 0.090 81
+ H5Y HAL2 0.090 82
+ C36 CTL2 -0.180 83
+ H6X HAL2 0.090 84
+ H6Y HAL2 0.090 85
+ C37 CTL2 -0.180 86
+ H7X HAL2 0.090 87
+ H7Y HAL2 0.090 88
+ C38 CTL2 -0.180 89
+ H8X HAL2 0.090 90
+ H8Y HAL2 0.090 91
+ C39 CTL2 -0.180 92
+ H9X HAL2 0.090 93
+ H9Y HAL2 0.090 94
+ C310 CTL2 -0.180 95
+ H10X HAL2 0.090 96
+ H10Y HAL2 0.090 97
+ C311 CTL2 -0.180 98
+ H11X HAL2 0.090 99
+ H11Y HAL2 0.090 100
+ C312 CTL2 -0.180 101
+ H12X HAL2 0.090 102
+ H12Y HAL2 0.090 103
+ C313 CTL2 -0.180 104
+ H13X HAL2 0.090 105
+ H13Y HAL2 0.090 106
+ C314 CTL3 -0.270 107
+ H14X HAL3 0.090 108
+ H14Y HAL3 0.090 109
+ H14Z HAL3 0.090 110
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ O13B C13
+ C13 C12
+ C12 H12A
+ C12 C11
+ C1 O11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 H14T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 H14Z
+ C13 O13A
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+ C13 C12 O13B O13A
+
+[ DMSN ]
+ [ atoms ]
+ S SG3O2 0.140 0
+ O1 OG2P1 -0.360 1
+ O2 OG2P1 -0.360 2
+ C3 CG331 0.020 3
+ H31 HGA3 0.090 4
+ H32 HGA3 0.090 5
+ H33 HGA3 0.090 6
+ C4 CG331 0.020 7
+ H41 HGA3 0.090 8
+ H42 HGA3 0.090 9
+ H43 HGA3 0.090 10
+ [ bonds ]
+ S O1
+ S O2
+ S C3
+ S C4
+ C3 H31
+ C3 H32
+ C3 H33
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ DMSO ]
+ [ atoms ]
+ O1 OG2P1 -0.550 0
+ S2 SG3O3 0.310 1
+ C3 CG331 -0.150 2
+ H4 HGA3 0.090 3
+ H5 HGA3 0.090 4
+ H6 HGA3 0.090 5
+ C7 CG331 -0.150 6
+ H8 HGA3 0.090 7
+ H9 HGA3 0.090 8
+ H10 HGA3 0.090 9
+ [ bonds ]
+ O1 S2
+ S2 C3
+ S2 C7
+ C3 H4
+ C3 H5
+ C3 H6
+ C7 H8
+ C7 H9
+ C7 H10
+
+[ DMTF ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C51 0.110 1
+ C2' CG3C52 -0.180 2
+ C3' CG3C52 -0.180 3
+ C4' CG3C51 0.110 4
+ H11' HGA1 0.090 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ H31' HGA2 0.090 8
+ H32' HGA2 0.090 9
+ H42' HGA1 0.090 10
+ C5 CG331 -0.270 11
+ H51 HGA3 0.090 12
+ H52 HGA3 0.090 13
+ H53 HGA3 0.090 14
+ C1 CG331 -0.270 15
+ H11 HGA3 0.090 16
+ H12 HGA3 0.090 17
+ H13 HGA3 0.090 18
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5
+ C1' H11'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C3' H32'
+ C4' H42'
+ C5 H51
+ C5 H52
+ C5 H53
+ C1' C1
+ C1 H11
+ C1 H12
+ C1 H13
+
+[ DMTT ]
+ [ atoms ]
+ C1 CG331 -0.090 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ S1 SG311 -0.170 4
+ C CG2O6 0.220 5
+ S SG2D1 -0.240 6
+ S2 SG311 -0.170 7
+ C2 CG331 -0.090 8
+ H21 HGA3 0.090 9
+ H22 HGA3 0.090 10
+ H23 HGA3 0.090 11
+ [ bonds ]
+ C1 S1
+ S1 C
+ C S2
+ S2 C2
+ C S
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+ [ impropers ]
+ C S1 S2 S
+
+[ DOPA ]
+ [ atoms ]
+ P PL 1.500 0
+ O13 O2L -0.820 1
+ O14 O2L -0.820 2
+ O12 OHL -0.680 3
+ H12 HOL 0.340 4
+ O11 OSLP -0.620 5
+ C1 CTL2 -0.080 6
+ HA HAL2 0.090 7
+ HB HAL2 0.090 8
+ C2 CTL1 0.170 9
+ HS HAL1 0.090 10
+ O21 OSL -0.490 11
+ C21 CL 0.900 12
+ O22 OBL -0.630 13
+ C22 CTL2 -0.220 14
+ H2R HAL2 0.090 15
+ H2S HAL2 0.090 16
+ C3 CTL2 0.080 17
+ HX HAL2 0.090 18
+ HY HAL2 0.090 19
+ O31 OSL -0.490 20
+ C31 CL 0.900 21
+ O32 OBL -0.630 22
+ C32 CTL2 -0.220 23
+ H2X HAL2 0.090 24
+ H2Y HAL2 0.090 25
+ C23 CTL2 -0.180 26
+ H3R HAL2 0.090 27
+ H3S HAL2 0.090 28
+ C24 CTL2 -0.180 29
+ H4R HAL2 0.090 30
+ H4S HAL2 0.090 31
+ C25 CTL2 -0.180 32
+ H5R HAL2 0.090 33
+ H5S HAL2 0.090 34
+ C26 CTL2 -0.180 35
+ H6R HAL2 0.090 36
+ H6S HAL2 0.090 37
+ C27 CTL2 -0.180 38
+ H7R HAL2 0.090 39
+ H7S HAL2 0.090 40
+ C28 CTL2 -0.180 41
+ H8R HAL2 0.090 42
+ H8S HAL2 0.090 43
+ C29 CEL1 -0.150 44
+ H9R HEL1 0.150 45
+ C210 CEL1 -0.150 46
+ H10R HEL1 0.150 47
+ C211 CTL2 -0.180 48
+ H11R HAL2 0.090 49
+ H11S HAL2 0.090 50
+ C212 CTL2 -0.180 51
+ H12R HAL2 0.090 52
+ H12S HAL2 0.090 53
+ C213 CTL2 -0.180 54
+ H13R HAL2 0.090 55
+ H13S HAL2 0.090 56
+ C214 CTL2 -0.180 57
+ H14R HAL2 0.090 58
+ H14S HAL2 0.090 59
+ C215 CTL2 -0.180 60
+ H15R HAL2 0.090 61
+ H15S HAL2 0.090 62
+ C216 CTL2 -0.180 63
+ H16R HAL2 0.090 64
+ H16S HAL2 0.090 65
+ C217 CTL2 -0.180 66
+ H17R HAL2 0.090 67
+ H17S HAL2 0.090 68
+ C218 CTL3 -0.270 69
+ H18R HAL3 0.090 70
+ H18S HAL3 0.090 71
+ H18T HAL3 0.090 72
+ C33 CTL2 -0.180 73
+ H3X HAL2 0.090 74
+ H3Y HAL2 0.090 75
+ C34 CTL2 -0.180 76
+ H4X HAL2 0.090 77
+ H4Y HAL2 0.090 78
+ C35 CTL2 -0.180 79
+ H5X HAL2 0.090 80
+ H5Y HAL2 0.090 81
+ C36 CTL2 -0.180 82
+ H6X HAL2 0.090 83
+ H6Y HAL2 0.090 84
+ C37 CTL2 -0.180 85
+ H7X HAL2 0.090 86
+ H7Y HAL2 0.090 87
+ C38 CTL2 -0.180 88
+ H8X HAL2 0.090 89
+ H8Y HAL2 0.090 90
+ C39 CEL1 -0.150 91
+ H9X HEL1 0.150 92
+ C310 CEL1 -0.150 93
+ H10X HEL1 0.150 94
+ C311 CTL2 -0.180 95
+ H11X HAL2 0.090 96
+ H11Y HAL2 0.090 97
+ C312 CTL2 -0.180 98
+ H12X HAL2 0.090 99
+ H12Y HAL2 0.090 100
+ C313 CTL2 -0.180 101
+ H13X HAL2 0.090 102
+ H13Y HAL2 0.090 103
+ C314 CTL2 -0.180 104
+ H14X HAL2 0.090 105
+ H14Y HAL2 0.090 106
+ C315 CTL2 -0.180 107
+ H15X HAL2 0.090 108
+ H15Y HAL2 0.090 109
+ C316 CTL2 -0.180 110
+ H16X HAL2 0.090 111
+ H16Y HAL2 0.090 112
+ C317 CTL2 -0.180 113
+ H17X HAL2 0.090 114
+ H17Y HAL2 0.090 115
+ C318 CTL3 -0.270 116
+ H18X HAL3 0.090 117
+ H18Y HAL3 0.090 118
+ H18Z HAL3 0.090 119
+ [ bonds ]
+ O12 P
+ P O11
+ P O13
+ P O14
+ O12 H12
+ O11 C1
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C210 H10R
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C310 H10X
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C29 C210
+ C31 O32
+ C39 C310
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DOPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C12 CTL2 -0.100 1
+ H12A HL 0.250 2
+ H12B HL 0.250 3
+ C13 CTL5 -0.350 4
+ H13A HL 0.250 5
+ H13B HL 0.250 6
+ H13C HL 0.250 7
+ C14 CTL5 -0.350 8
+ H14A HL 0.250 9
+ H14B HL 0.250 10
+ H14C HL 0.250 11
+ C15 CTL5 -0.350 12
+ H15A HL 0.250 13
+ H15B HL 0.250 14
+ H15C HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O12 OSLP -0.570 22
+ O11 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CTL2 -0.180 50
+ H5R HAL2 0.090 51
+ H5S HAL2 0.090 52
+ C26 CTL2 -0.180 53
+ H6R HAL2 0.090 54
+ H6S HAL2 0.090 55
+ C27 CTL2 -0.180 56
+ H7R HAL2 0.090 57
+ H7S HAL2 0.090 58
+ C28 CTL2 -0.180 59
+ H8R HAL2 0.090 60
+ H8S HAL2 0.090 61
+ C29 CEL1 -0.150 62
+ H9R HEL1 0.150 63
+ C210 CEL1 -0.150 64
+ H10R HEL1 0.150 65
+ C211 CTL2 -0.180 66
+ H11R HAL2 0.090 67
+ H11S HAL2 0.090 68
+ C212 CTL2 -0.180 69
+ H12R HAL2 0.090 70
+ H12S HAL2 0.090 71
+ C213 CTL2 -0.180 72
+ H13R HAL2 0.090 73
+ H13S HAL2 0.090 74
+ C214 CTL2 -0.180 75
+ H14R HAL2 0.090 76
+ H14S HAL2 0.090 77
+ C215 CTL2 -0.180 78
+ H15R HAL2 0.090 79
+ H15S HAL2 0.090 80
+ C216 CTL2 -0.180 81
+ H16R HAL2 0.090 82
+ H16S HAL2 0.090 83
+ C217 CTL2 -0.180 84
+ H17R HAL2 0.090 85
+ H17S HAL2 0.090 86
+ C218 CTL3 -0.270 87
+ H18R HAL3 0.090 88
+ H18S HAL3 0.090 89
+ H18T HAL3 0.090 90
+ C33 CTL2 -0.180 91
+ H3X HAL2 0.090 92
+ H3Y HAL2 0.090 93
+ C34 CTL2 -0.180 94
+ H4X HAL2 0.090 95
+ H4Y HAL2 0.090 96
+ C35 CTL2 -0.180 97
+ H5X HAL2 0.090 98
+ H5Y HAL2 0.090 99
+ C36 CTL2 -0.180 100
+ H6X HAL2 0.090 101
+ H6Y HAL2 0.090 102
+ C37 CTL2 -0.180 103
+ H7X HAL2 0.090 104
+ H7Y HAL2 0.090 105
+ C38 CTL2 -0.180 106
+ H8X HAL2 0.090 107
+ H8Y HAL2 0.090 108
+ C39 CEL1 -0.150 109
+ H9X HEL1 0.150 110
+ C310 CEL1 -0.150 111
+ H10X HEL1 0.150 112
+ C311 CTL2 -0.180 113
+ H11X HAL2 0.090 114
+ H11Y HAL2 0.090 115
+ C312 CTL2 -0.180 116
+ H12X HAL2 0.090 117
+ H12Y HAL2 0.090 118
+ C313 CTL2 -0.180 119
+ H13X HAL2 0.090 120
+ H13Y HAL2 0.090 121
+ C314 CTL2 -0.180 122
+ H14X HAL2 0.090 123
+ H14Y HAL2 0.090 124
+ C315 CTL2 -0.180 125
+ H15X HAL2 0.090 126
+ H15Y HAL2 0.090 127
+ C316 CTL2 -0.180 128
+ H16X HAL2 0.090 129
+ H16Y HAL2 0.090 130
+ C317 CTL2 -0.180 131
+ H17X HAL2 0.090 132
+ H17Y HAL2 0.090 133
+ C318 CTL3 -0.270 134
+ H18X HAL3 0.090 135
+ H18Y HAL3 0.090 136
+ H18Z HAL3 0.090 137
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C210 H10R
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C310 H10X
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C29 C210
+ C31 O32
+ C39 C310
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DOPE ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL2 0.130 4
+ H12A HAL2 0.090 5
+ H12B HAL2 0.090 6
+ C11 CTL2 -0.080 7
+ H11A HAL2 0.090 8
+ H11B HAL2 0.090 9
+ P PL 1.500 10
+ O13 O2L -0.780 11
+ O14 O2L -0.780 12
+ O11 OSLP -0.570 13
+ O12 OSLP -0.570 14
+ C1 CTL2 -0.080 15
+ HA HAL2 0.090 16
+ HB HAL2 0.090 17
+ C2 CTL1 0.170 18
+ HS HAL1 0.090 19
+ O21 OSL -0.490 20
+ C21 CL 0.900 21
+ O22 OBL -0.630 22
+ C22 CTL2 -0.220 23
+ H2R HAL2 0.090 24
+ H2S HAL2 0.090 25
+ C3 CTL2 0.080 26
+ HX HAL2 0.090 27
+ HY HAL2 0.090 28
+ O31 OSL -0.490 29
+ C31 CL 0.900 30
+ O32 OBL -0.630 31
+ C32 CTL2 -0.220 32
+ H2X HAL2 0.090 33
+ H2Y HAL2 0.090 34
+ C23 CTL2 -0.180 35
+ H3R HAL2 0.090 36
+ H3S HAL2 0.090 37
+ C24 CTL2 -0.180 38
+ H4R HAL2 0.090 39
+ H4S HAL2 0.090 40
+ C25 CTL2 -0.180 41
+ H5R HAL2 0.090 42
+ H5S HAL2 0.090 43
+ C26 CTL2 -0.180 44
+ H6R HAL2 0.090 45
+ H6S HAL2 0.090 46
+ C27 CTL2 -0.180 47
+ H7R HAL2 0.090 48
+ H7S HAL2 0.090 49
+ C28 CTL2 -0.180 50
+ H8R HAL2 0.090 51
+ H8S HAL2 0.090 52
+ C29 CEL1 -0.150 53
+ H9R HEL1 0.150 54
+ C210 CEL1 -0.150 55
+ H10R HEL1 0.150 56
+ C211 CTL2 -0.180 57
+ H11R HAL2 0.090 58
+ H11S HAL2 0.090 59
+ C212 CTL2 -0.180 60
+ H12R HAL2 0.090 61
+ H12S HAL2 0.090 62
+ C213 CTL2 -0.180 63
+ H13R HAL2 0.090 64
+ H13S HAL2 0.090 65
+ C214 CTL2 -0.180 66
+ H14R HAL2 0.090 67
+ H14S HAL2 0.090 68
+ C215 CTL2 -0.180 69
+ H15R HAL2 0.090 70
+ H15S HAL2 0.090 71
+ C216 CTL2 -0.180 72
+ H16R HAL2 0.090 73
+ H16S HAL2 0.090 74
+ C217 CTL2 -0.180 75
+ H17R HAL2 0.090 76
+ H17S HAL2 0.090 77
+ C218 CTL3 -0.270 78
+ H18R HAL3 0.090 79
+ H18S HAL3 0.090 80
+ H18T HAL3 0.090 81
+ C33 CTL2 -0.180 82
+ H3X HAL2 0.090 83
+ H3Y HAL2 0.090 84
+ C34 CTL2 -0.180 85
+ H4X HAL2 0.090 86
+ H4Y HAL2 0.090 87
+ C35 CTL2 -0.180 88
+ H5X HAL2 0.090 89
+ H5Y HAL2 0.090 90
+ C36 CTL2 -0.180 91
+ H6X HAL2 0.090 92
+ H6Y HAL2 0.090 93
+ C37 CTL2 -0.180 94
+ H7X HAL2 0.090 95
+ H7Y HAL2 0.090 96
+ C38 CTL2 -0.180 97
+ H8X HAL2 0.090 98
+ H8Y HAL2 0.090 99
+ C39 CEL1 -0.150 100
+ H9X HEL1 0.150 101
+ C310 CEL1 -0.150 102
+ H10X HEL1 0.150 103
+ C311 CTL2 -0.180 104
+ H11X HAL2 0.090 105
+ H11Y HAL2 0.090 106
+ C312 CTL2 -0.180 107
+ H12X HAL2 0.090 108
+ H12Y HAL2 0.090 109
+ C313 CTL2 -0.180 110
+ H13X HAL2 0.090 111
+ H13Y HAL2 0.090 112
+ C314 CTL2 -0.180 113
+ H14X HAL2 0.090 114
+ H14Y HAL2 0.090 115
+ C315 CTL2 -0.180 116
+ H15X HAL2 0.090 117
+ H15Y HAL2 0.090 118
+ C316 CTL2 -0.180 119
+ H16X HAL2 0.090 120
+ H16Y HAL2 0.090 121
+ C317 CTL2 -0.180 122
+ H17X HAL2 0.090 123
+ H17Y HAL2 0.090 124
+ C318 CTL3 -0.270 125
+ H18X HAL3 0.090 126
+ H18Y HAL3 0.090 127
+ H18Z HAL3 0.090 128
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C210 H10R
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C310 H10X
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C29 C210
+ C31 O32
+ C39 C310
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DOPG ]
+ [ atoms ]
+ C13 CTL2 0.050 0
+ H13A HAL2 0.090 1
+ H13B HAL2 0.090 2
+ OC3 OHL -0.650 3
+ HO3 HOL 0.420 4
+ C12 CTL1 0.140 5
+ H12A HAL1 0.090 6
+ OC2 OHL -0.650 7
+ HO2 HOL 0.420 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CEL1 -0.150 55
+ H9R HEL1 0.150 56
+ C210 CEL1 -0.150 57
+ H10R HEL1 0.150 58
+ C211 CTL2 -0.180 59
+ H11R HAL2 0.090 60
+ H11S HAL2 0.090 61
+ C212 CTL2 -0.180 62
+ H12R HAL2 0.090 63
+ H12S HAL2 0.090 64
+ C213 CTL2 -0.180 65
+ H13R HAL2 0.090 66
+ H13S HAL2 0.090 67
+ C214 CTL2 -0.180 68
+ H14R HAL2 0.090 69
+ H14S HAL2 0.090 70
+ C215 CTL2 -0.180 71
+ H15R HAL2 0.090 72
+ H15S HAL2 0.090 73
+ C216 CTL2 -0.180 74
+ H16R HAL2 0.090 75
+ H16S HAL2 0.090 76
+ C217 CTL2 -0.180 77
+ H17R HAL2 0.090 78
+ H17S HAL2 0.090 79
+ C218 CTL3 -0.270 80
+ H18R HAL3 0.090 81
+ H18S HAL3 0.090 82
+ H18T HAL3 0.090 83
+ C33 CTL2 -0.180 84
+ H3X HAL2 0.090 85
+ H3Y HAL2 0.090 86
+ C34 CTL2 -0.180 87
+ H4X HAL2 0.090 88
+ H4Y HAL2 0.090 89
+ C35 CTL2 -0.180 90
+ H5X HAL2 0.090 91
+ H5Y HAL2 0.090 92
+ C36 CTL2 -0.180 93
+ H6X HAL2 0.090 94
+ H6Y HAL2 0.090 95
+ C37 CTL2 -0.180 96
+ H7X HAL2 0.090 97
+ H7Y HAL2 0.090 98
+ C38 CTL2 -0.180 99
+ H8X HAL2 0.090 100
+ H8Y HAL2 0.090 101
+ C39 CEL1 -0.150 102
+ H9X HEL1 0.150 103
+ C310 CEL1 -0.150 104
+ H10X HEL1 0.150 105
+ C311 CTL2 -0.180 106
+ H11X HAL2 0.090 107
+ H11Y HAL2 0.090 108
+ C312 CTL2 -0.180 109
+ H12X HAL2 0.090 110
+ H12Y HAL2 0.090 111
+ C313 CTL2 -0.180 112
+ H13X HAL2 0.090 113
+ H13Y HAL2 0.090 114
+ C314 CTL2 -0.180 115
+ H14X HAL2 0.090 116
+ H14Y HAL2 0.090 117
+ C315 CTL2 -0.180 118
+ H15X HAL2 0.090 119
+ H15Y HAL2 0.090 120
+ C316 CTL2 -0.180 121
+ H16X HAL2 0.090 122
+ H16Y HAL2 0.090 123
+ C317 CTL2 -0.180 124
+ H17X HAL2 0.090 125
+ H17Y HAL2 0.090 126
+ C318 CTL3 -0.270 127
+ H18X HAL3 0.090 128
+ H18Y HAL3 0.090 129
+ H18Z HAL3 0.090 130
+ [ bonds ]
+ HO3 OC3
+ OC3 C13
+ C13 H13A
+ C13 H13B
+ C13 C12
+ HO2 OC2
+ OC2 C12
+ C12 H12A
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C210 H10R
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C310 H10X
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C29 C210
+ C31 O32
+ C39 C310
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DOPS ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL1 0.210 4
+ H12A HBL 0.100 5
+ C13 CCL 0.340 6
+ O13A OCL -0.670 7
+ O13B OCL -0.670 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CEL1 -0.150 55
+ H9R HEL1 0.150 56
+ C210 CEL1 -0.150 57
+ H10R HEL1 0.150 58
+ C211 CTL2 -0.180 59
+ H11R HAL2 0.090 60
+ H11S HAL2 0.090 61
+ C212 CTL2 -0.180 62
+ H12R HAL2 0.090 63
+ H12S HAL2 0.090 64
+ C213 CTL2 -0.180 65
+ H13R HAL2 0.090 66
+ H13S HAL2 0.090 67
+ C214 CTL2 -0.180 68
+ H14R HAL2 0.090 69
+ H14S HAL2 0.090 70
+ C215 CTL2 -0.180 71
+ H15R HAL2 0.090 72
+ H15S HAL2 0.090 73
+ C216 CTL2 -0.180 74
+ H16R HAL2 0.090 75
+ H16S HAL2 0.090 76
+ C217 CTL2 -0.180 77
+ H17R HAL2 0.090 78
+ H17S HAL2 0.090 79
+ C218 CTL3 -0.270 80
+ H18R HAL3 0.090 81
+ H18S HAL3 0.090 82
+ H18T HAL3 0.090 83
+ C33 CTL2 -0.180 84
+ H3X HAL2 0.090 85
+ H3Y HAL2 0.090 86
+ C34 CTL2 -0.180 87
+ H4X HAL2 0.090 88
+ H4Y HAL2 0.090 89
+ C35 CTL2 -0.180 90
+ H5X HAL2 0.090 91
+ H5Y HAL2 0.090 92
+ C36 CTL2 -0.180 93
+ H6X HAL2 0.090 94
+ H6Y HAL2 0.090 95
+ C37 CTL2 -0.180 96
+ H7X HAL2 0.090 97
+ H7Y HAL2 0.090 98
+ C38 CTL2 -0.180 99
+ H8X HAL2 0.090 100
+ H8Y HAL2 0.090 101
+ C39 CEL1 -0.150 102
+ H9X HEL1 0.150 103
+ C310 CEL1 -0.150 104
+ H10X HEL1 0.150 105
+ C311 CTL2 -0.180 106
+ H11X HAL2 0.090 107
+ H11Y HAL2 0.090 108
+ C312 CTL2 -0.180 109
+ H12X HAL2 0.090 110
+ H12Y HAL2 0.090 111
+ C313 CTL2 -0.180 112
+ H13X HAL2 0.090 113
+ H13Y HAL2 0.090 114
+ C314 CTL2 -0.180 115
+ H14X HAL2 0.090 116
+ H14Y HAL2 0.090 117
+ C315 CTL2 -0.180 118
+ H15X HAL2 0.090 119
+ H15Y HAL2 0.090 120
+ C316 CTL2 -0.180 121
+ H16X HAL2 0.090 122
+ H16Y HAL2 0.090 123
+ C317 CTL2 -0.180 124
+ H17X HAL2 0.090 125
+ H17Y HAL2 0.090 126
+ C318 CTL3 -0.270 127
+ H18X HAL3 0.090 128
+ H18Y HAL3 0.090 129
+ H18Z HAL3 0.090 130
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ O13B C13
+ C13 C12
+ C12 H12A
+ C12 C11
+ C1 O11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C210 H10R
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C310 H10X
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C13 O13A
+ C21 O22
+ C29 C210
+ C31 O32
+ C39 C310
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+ C13 C12 O13B O13A
+
+[ DPPA ]
+ [ atoms ]
+ P PL 1.500 0
+ O13 O2L -0.820 1
+ O14 O2L -0.820 2
+ O12 OHL -0.680 3
+ H12 HOL 0.340 4
+ O11 OSLP -0.620 5
+ C1 CTL2 -0.080 6
+ HA HAL2 0.090 7
+ HB HAL2 0.090 8
+ C2 CTL1 0.170 9
+ HS HAL1 0.090 10
+ O21 OSL -0.490 11
+ C21 CL 0.900 12
+ O22 OBL -0.630 13
+ C22 CTL2 -0.220 14
+ H2R HAL2 0.090 15
+ H2S HAL2 0.090 16
+ C3 CTL2 0.080 17
+ HX HAL2 0.090 18
+ HY HAL2 0.090 19
+ O31 OSL -0.490 20
+ C31 CL 0.900 21
+ O32 OBL -0.630 22
+ C32 CTL2 -0.220 23
+ H2X HAL2 0.090 24
+ H2Y HAL2 0.090 25
+ C23 CTL2 -0.180 26
+ H3R HAL2 0.090 27
+ H3S HAL2 0.090 28
+ C24 CTL2 -0.180 29
+ H4R HAL2 0.090 30
+ H4S HAL2 0.090 31
+ C25 CTL2 -0.180 32
+ H5R HAL2 0.090 33
+ H5S HAL2 0.090 34
+ C26 CTL2 -0.180 35
+ H6R HAL2 0.090 36
+ H6S HAL2 0.090 37
+ C27 CTL2 -0.180 38
+ H7R HAL2 0.090 39
+ H7S HAL2 0.090 40
+ C28 CTL2 -0.180 41
+ H8R HAL2 0.090 42
+ H8S HAL2 0.090 43
+ C29 CTL2 -0.180 44
+ H9R HAL2 0.090 45
+ H9S HAL2 0.090 46
+ C210 CTL2 -0.180 47
+ H10R HAL2 0.090 48
+ H10S HAL2 0.090 49
+ C211 CTL2 -0.180 50
+ H11R HAL2 0.090 51
+ H11S HAL2 0.090 52
+ C212 CTL2 -0.180 53
+ H12R HAL2 0.090 54
+ H12S HAL2 0.090 55
+ C213 CTL2 -0.180 56
+ H13R HAL2 0.090 57
+ H13S HAL2 0.090 58
+ C214 CTL2 -0.180 59
+ H14R HAL2 0.090 60
+ H14S HAL2 0.090 61
+ C215 CTL2 -0.180 62
+ H15R HAL2 0.090 63
+ H15S HAL2 0.090 64
+ C216 CTL3 -0.270 65
+ H16R HAL3 0.090 66
+ H16S HAL3 0.090 67
+ H16T HAL3 0.090 68
+ C33 CTL2 -0.180 69
+ H3X HAL2 0.090 70
+ H3Y HAL2 0.090 71
+ C34 CTL2 -0.180 72
+ H4X HAL2 0.090 73
+ H4Y HAL2 0.090 74
+ C35 CTL2 -0.180 75
+ H5X HAL2 0.090 76
+ H5Y HAL2 0.090 77
+ C36 CTL2 -0.180 78
+ H6X HAL2 0.090 79
+ H6Y HAL2 0.090 80
+ C37 CTL2 -0.180 81
+ H7X HAL2 0.090 82
+ H7Y HAL2 0.090 83
+ C38 CTL2 -0.180 84
+ H8X HAL2 0.090 85
+ H8Y HAL2 0.090 86
+ C39 CTL2 -0.180 87
+ H9X HAL2 0.090 88
+ H9Y HAL2 0.090 89
+ C310 CTL2 -0.180 90
+ H10X HAL2 0.090 91
+ H10Y HAL2 0.090 92
+ C311 CTL2 -0.180 93
+ H11X HAL2 0.090 94
+ H11Y HAL2 0.090 95
+ C312 CTL2 -0.180 96
+ H12X HAL2 0.090 97
+ H12Y HAL2 0.090 98
+ C313 CTL2 -0.180 99
+ H13X HAL2 0.090 100
+ H13Y HAL2 0.090 101
+ C314 CTL2 -0.180 102
+ H14X HAL2 0.090 103
+ H14Y HAL2 0.090 104
+ C315 CTL2 -0.180 105
+ H15X HAL2 0.090 106
+ H15Y HAL2 0.090 107
+ C316 CTL3 -0.270 108
+ H16X HAL3 0.090 109
+ H16Y HAL3 0.090 110
+ H16Z HAL3 0.090 111
+ [ bonds ]
+ O12 P
+ P O11
+ P O13
+ P O14
+ O12 H12
+ O11 C1
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DPPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C13 CTL5 -0.350 1
+ H13A HL 0.250 2
+ H13B HL 0.250 3
+ H13C HL 0.250 4
+ C14 CTL5 -0.350 5
+ H14A HL 0.250 6
+ H14B HL 0.250 7
+ H14C HL 0.250 8
+ C15 CTL5 -0.350 9
+ H15A HL 0.250 10
+ H15B HL 0.250 11
+ H15C HL 0.250 12
+ C12 CTL2 -0.100 13
+ H12A HL 0.250 14
+ H12B HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O11 OSLP -0.570 22
+ O12 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CTL2 -0.180 50
+ H5R HAL2 0.090 51
+ H5S HAL2 0.090 52
+ C26 CTL2 -0.180 53
+ H6R HAL2 0.090 54
+ H6S HAL2 0.090 55
+ C27 CTL2 -0.180 56
+ H7R HAL2 0.090 57
+ H7S HAL2 0.090 58
+ C28 CTL2 -0.180 59
+ H8R HAL2 0.090 60
+ H8S HAL2 0.090 61
+ C29 CTL2 -0.180 62
+ H9R HAL2 0.090 63
+ H9S HAL2 0.090 64
+ C210 CTL2 -0.180 65
+ H10R HAL2 0.090 66
+ H10S HAL2 0.090 67
+ C211 CTL2 -0.180 68
+ H11R HAL2 0.090 69
+ H11S HAL2 0.090 70
+ C212 CTL2 -0.180 71
+ H12R HAL2 0.090 72
+ H12S HAL2 0.090 73
+ C213 CTL2 -0.180 74
+ H13R HAL2 0.090 75
+ H13S HAL2 0.090 76
+ C214 CTL2 -0.180 77
+ H14R HAL2 0.090 78
+ H14S HAL2 0.090 79
+ C215 CTL2 -0.180 80
+ H15R HAL2 0.090 81
+ H15S HAL2 0.090 82
+ C216 CTL3 -0.270 83
+ H16R HAL3 0.090 84
+ H16S HAL3 0.090 85
+ H16T HAL3 0.090 86
+ C33 CTL2 -0.180 87
+ H3X HAL2 0.090 88
+ H3Y HAL2 0.090 89
+ C34 CTL2 -0.180 90
+ H4X HAL2 0.090 91
+ H4Y HAL2 0.090 92
+ C35 CTL2 -0.180 93
+ H5X HAL2 0.090 94
+ H5Y HAL2 0.090 95
+ C36 CTL2 -0.180 96
+ H6X HAL2 0.090 97
+ H6Y HAL2 0.090 98
+ C37 CTL2 -0.180 99
+ H7X HAL2 0.090 100
+ H7Y HAL2 0.090 101
+ C38 CTL2 -0.180 102
+ H8X HAL2 0.090 103
+ H8Y HAL2 0.090 104
+ C39 CTL2 -0.180 105
+ H9X HAL2 0.090 106
+ H9Y HAL2 0.090 107
+ C310 CTL2 -0.180 108
+ H10X HAL2 0.090 109
+ H10Y HAL2 0.090 110
+ C311 CTL2 -0.180 111
+ H11X HAL2 0.090 112
+ H11Y HAL2 0.090 113
+ C312 CTL2 -0.180 114
+ H12X HAL2 0.090 115
+ H12Y HAL2 0.090 116
+ C313 CTL2 -0.180 117
+ H13X HAL2 0.090 118
+ H13Y HAL2 0.090 119
+ C314 CTL2 -0.180 120
+ H14X HAL2 0.090 121
+ H14Y HAL2 0.090 122
+ C315 CTL2 -0.180 123
+ H15X HAL2 0.090 124
+ H15Y HAL2 0.090 125
+ C316 CTL3 -0.270 126
+ H16X HAL3 0.090 127
+ H16Y HAL3 0.090 128
+ H16Z HAL3 0.090 129
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DPPE ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL2 0.130 4
+ H12A HAL2 0.090 5
+ H12B HAL2 0.090 6
+ C11 CTL2 -0.080 7
+ H11A HAL2 0.090 8
+ H11B HAL2 0.090 9
+ P PL 1.500 10
+ O13 O2L -0.780 11
+ O14 O2L -0.780 12
+ O11 OSLP -0.570 13
+ O12 OSLP -0.570 14
+ C1 CTL2 -0.080 15
+ HA HAL2 0.090 16
+ HB HAL2 0.090 17
+ C2 CTL1 0.170 18
+ HS HAL1 0.090 19
+ O21 OSL -0.490 20
+ C21 CL 0.900 21
+ O22 OBL -0.630 22
+ C22 CTL2 -0.220 23
+ H2R HAL2 0.090 24
+ H2S HAL2 0.090 25
+ C3 CTL2 0.080 26
+ HX HAL2 0.090 27
+ HY HAL2 0.090 28
+ O31 OSL -0.490 29
+ C31 CL 0.900 30
+ O32 OBL -0.630 31
+ C32 CTL2 -0.220 32
+ H2X HAL2 0.090 33
+ H2Y HAL2 0.090 34
+ C23 CTL2 -0.180 35
+ H3R HAL2 0.090 36
+ H3S HAL2 0.090 37
+ C24 CTL2 -0.180 38
+ H4R HAL2 0.090 39
+ H4S HAL2 0.090 40
+ C25 CTL2 -0.180 41
+ H5R HAL2 0.090 42
+ H5S HAL2 0.090 43
+ C26 CTL2 -0.180 44
+ H6R HAL2 0.090 45
+ H6S HAL2 0.090 46
+ C27 CTL2 -0.180 47
+ H7R HAL2 0.090 48
+ H7S HAL2 0.090 49
+ C28 CTL2 -0.180 50
+ H8R HAL2 0.090 51
+ H8S HAL2 0.090 52
+ C29 CTL2 -0.180 53
+ H9R HAL2 0.090 54
+ H9S HAL2 0.090 55
+ C210 CTL2 -0.180 56
+ H10R HAL2 0.090 57
+ H10S HAL2 0.090 58
+ C211 CTL2 -0.180 59
+ H11R HAL2 0.090 60
+ H11S HAL2 0.090 61
+ C212 CTL2 -0.180 62
+ H12R HAL2 0.090 63
+ H12S HAL2 0.090 64
+ C213 CTL2 -0.180 65
+ H13R HAL2 0.090 66
+ H13S HAL2 0.090 67
+ C214 CTL2 -0.180 68
+ H14R HAL2 0.090 69
+ H14S HAL2 0.090 70
+ C215 CTL2 -0.180 71
+ H15R HAL2 0.090 72
+ H15S HAL2 0.090 73
+ C216 CTL3 -0.270 74
+ H16R HAL3 0.090 75
+ H16S HAL3 0.090 76
+ H16T HAL3 0.090 77
+ C33 CTL2 -0.180 78
+ H3X HAL2 0.090 79
+ H3Y HAL2 0.090 80
+ C34 CTL2 -0.180 81
+ H4X HAL2 0.090 82
+ H4Y HAL2 0.090 83
+ C35 CTL2 -0.180 84
+ H5X HAL2 0.090 85
+ H5Y HAL2 0.090 86
+ C36 CTL2 -0.180 87
+ H6X HAL2 0.090 88
+ H6Y HAL2 0.090 89
+ C37 CTL2 -0.180 90
+ H7X HAL2 0.090 91
+ H7Y HAL2 0.090 92
+ C38 CTL2 -0.180 93
+ H8X HAL2 0.090 94
+ H8Y HAL2 0.090 95
+ C39 CTL2 -0.180 96
+ H9X HAL2 0.090 97
+ H9Y HAL2 0.090 98
+ C310 CTL2 -0.180 99
+ H10X HAL2 0.090 100
+ H10Y HAL2 0.090 101
+ C311 CTL2 -0.180 102
+ H11X HAL2 0.090 103
+ H11Y HAL2 0.090 104
+ C312 CTL2 -0.180 105
+ H12X HAL2 0.090 106
+ H12Y HAL2 0.090 107
+ C313 CTL2 -0.180 108
+ H13X HAL2 0.090 109
+ H13Y HAL2 0.090 110
+ C314 CTL2 -0.180 111
+ H14X HAL2 0.090 112
+ H14Y HAL2 0.090 113
+ C315 CTL2 -0.180 114
+ H15X HAL2 0.090 115
+ H15Y HAL2 0.090 116
+ C316 CTL3 -0.270 117
+ H16X HAL3 0.090 118
+ H16Y HAL3 0.090 119
+ H16Z HAL3 0.090 120
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DPPG ]
+ [ atoms ]
+ C13 CTL2 0.050 0
+ H13A HAL2 0.090 1
+ H13B HAL2 0.090 2
+ OC3 OHL -0.650 3
+ HO3 HOL 0.420 4
+ C12 CTL1 0.140 5
+ H12A HAL1 0.090 6
+ OC2 OHL -0.650 7
+ HO2 HOL 0.420 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CTL2 -0.180 55
+ H9R HAL2 0.090 56
+ H9S HAL2 0.090 57
+ C210 CTL2 -0.180 58
+ H10R HAL2 0.090 59
+ H10S HAL2 0.090 60
+ C211 CTL2 -0.180 61
+ H11R HAL2 0.090 62
+ H11S HAL2 0.090 63
+ C212 CTL2 -0.180 64
+ H12R HAL2 0.090 65
+ H12S HAL2 0.090 66
+ C213 CTL2 -0.180 67
+ H13R HAL2 0.090 68
+ H13S HAL2 0.090 69
+ C214 CTL2 -0.180 70
+ H14R HAL2 0.090 71
+ H14S HAL2 0.090 72
+ C215 CTL2 -0.180 73
+ H15R HAL2 0.090 74
+ H15S HAL2 0.090 75
+ C216 CTL3 -0.270 76
+ H16R HAL3 0.090 77
+ H16S HAL3 0.090 78
+ H16T HAL3 0.090 79
+ C33 CTL2 -0.180 80
+ H3X HAL2 0.090 81
+ H3Y HAL2 0.090 82
+ C34 CTL2 -0.180 83
+ H4X HAL2 0.090 84
+ H4Y HAL2 0.090 85
+ C35 CTL2 -0.180 86
+ H5X HAL2 0.090 87
+ H5Y HAL2 0.090 88
+ C36 CTL2 -0.180 89
+ H6X HAL2 0.090 90
+ H6Y HAL2 0.090 91
+ C37 CTL2 -0.180 92
+ H7X HAL2 0.090 93
+ H7Y HAL2 0.090 94
+ C38 CTL2 -0.180 95
+ H8X HAL2 0.090 96
+ H8Y HAL2 0.090 97
+ C39 CTL2 -0.180 98
+ H9X HAL2 0.090 99
+ H9Y HAL2 0.090 100
+ C310 CTL2 -0.180 101
+ H10X HAL2 0.090 102
+ H10Y HAL2 0.090 103
+ C311 CTL2 -0.180 104
+ H11X HAL2 0.090 105
+ H11Y HAL2 0.090 106
+ C312 CTL2 -0.180 107
+ H12X HAL2 0.090 108
+ H12Y HAL2 0.090 109
+ C313 CTL2 -0.180 110
+ H13X HAL2 0.090 111
+ H13Y HAL2 0.090 112
+ C314 CTL2 -0.180 113
+ H14X HAL2 0.090 114
+ H14Y HAL2 0.090 115
+ C315 CTL2 -0.180 116
+ H15X HAL2 0.090 117
+ H15Y HAL2 0.090 118
+ C316 CTL3 -0.270 119
+ H16X HAL3 0.090 120
+ H16Y HAL3 0.090 121
+ H16Z HAL3 0.090 122
+ [ bonds ]
+ HO3 OC3
+ OC3 C13
+ C13 H13A
+ C13 H13B
+ C13 C12
+ HO2 OC2
+ OC2 C12
+ C12 H12A
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DPPS ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL1 0.210 4
+ H12A HBL 0.100 5
+ C13 CCL 0.340 6
+ O13A OCL -0.670 7
+ O13B OCL -0.670 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CTL2 -0.180 55
+ H9R HAL2 0.090 56
+ H9S HAL2 0.090 57
+ C210 CTL2 -0.180 58
+ H10R HAL2 0.090 59
+ H10S HAL2 0.090 60
+ C211 CTL2 -0.180 61
+ H11R HAL2 0.090 62
+ H11S HAL2 0.090 63
+ C212 CTL2 -0.180 64
+ H12R HAL2 0.090 65
+ H12S HAL2 0.090 66
+ C213 CTL2 -0.180 67
+ H13R HAL2 0.090 68
+ H13S HAL2 0.090 69
+ C214 CTL2 -0.180 70
+ H14R HAL2 0.090 71
+ H14S HAL2 0.090 72
+ C215 CTL2 -0.180 73
+ H15R HAL2 0.090 74
+ H15S HAL2 0.090 75
+ C216 CTL3 -0.270 76
+ H16R HAL3 0.090 77
+ H16S HAL3 0.090 78
+ H16T HAL3 0.090 79
+ C33 CTL2 -0.180 80
+ H3X HAL2 0.090 81
+ H3Y HAL2 0.090 82
+ C34 CTL2 -0.180 83
+ H4X HAL2 0.090 84
+ H4Y HAL2 0.090 85
+ C35 CTL2 -0.180 86
+ H5X HAL2 0.090 87
+ H5Y HAL2 0.090 88
+ C36 CTL2 -0.180 89
+ H6X HAL2 0.090 90
+ H6Y HAL2 0.090 91
+ C37 CTL2 -0.180 92
+ H7X HAL2 0.090 93
+ H7Y HAL2 0.090 94
+ C38 CTL2 -0.180 95
+ H8X HAL2 0.090 96
+ H8Y HAL2 0.090 97
+ C39 CTL2 -0.180 98
+ H9X HAL2 0.090 99
+ H9Y HAL2 0.090 100
+ C310 CTL2 -0.180 101
+ H10X HAL2 0.090 102
+ H10Y HAL2 0.090 103
+ C311 CTL2 -0.180 104
+ H11X HAL2 0.090 105
+ H11Y HAL2 0.090 106
+ C312 CTL2 -0.180 107
+ H12X HAL2 0.090 108
+ H12Y HAL2 0.090 109
+ C313 CTL2 -0.180 110
+ H13X HAL2 0.090 111
+ H13Y HAL2 0.090 112
+ C314 CTL2 -0.180 113
+ H14X HAL2 0.090 114
+ H14Y HAL2 0.090 115
+ C315 CTL2 -0.180 116
+ H15X HAL2 0.090 117
+ H15Y HAL2 0.090 118
+ C316 CTL3 -0.270 119
+ H16X HAL3 0.090 120
+ H16Y HAL3 0.090 121
+ H16Z HAL3 0.090 122
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ O13B C13
+ C13 C12
+ C12 H12A
+ C12 C11
+ C1 O11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C13 O13A
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+ C13 C12 O13B O13A
+
+[ DSPA ]
+ [ atoms ]
+ P PL 1.500 0
+ O13 O2L -0.820 1
+ O14 O2L -0.820 2
+ O12 OHL -0.680 3
+ H12 HOL 0.340 4
+ O11 OSLP -0.620 5
+ C1 CTL2 -0.080 6
+ HA HAL2 0.090 7
+ HB HAL2 0.090 8
+ C2 CTL1 0.170 9
+ HS HAL1 0.090 10
+ O21 OSL -0.490 11
+ C21 CL 0.900 12
+ O22 OBL -0.630 13
+ C22 CTL2 -0.220 14
+ H2R HAL2 0.090 15
+ H2S HAL2 0.090 16
+ C3 CTL2 0.080 17
+ HX HAL2 0.090 18
+ HY HAL2 0.090 19
+ O31 OSL -0.490 20
+ C31 CL 0.900 21
+ O32 OBL -0.630 22
+ C32 CTL2 -0.220 23
+ H2X HAL2 0.090 24
+ H2Y HAL2 0.090 25
+ C23 CTL2 -0.180 26
+ H3R HAL2 0.090 27
+ H3S HAL2 0.090 28
+ C24 CTL2 -0.180 29
+ H4R HAL2 0.090 30
+ H4S HAL2 0.090 31
+ C25 CTL2 -0.180 32
+ H5R HAL2 0.090 33
+ H5S HAL2 0.090 34
+ C26 CTL2 -0.180 35
+ H6R HAL2 0.090 36
+ H6S HAL2 0.090 37
+ C27 CTL2 -0.180 38
+ H7R HAL2 0.090 39
+ H7S HAL2 0.090 40
+ C28 CTL2 -0.180 41
+ H8R HAL2 0.090 42
+ H8S HAL2 0.090 43
+ C29 CTL2 -0.180 44
+ H9R HAL2 0.090 45
+ H9S HAL2 0.090 46
+ C210 CTL2 -0.180 47
+ H10R HAL2 0.090 48
+ H10S HAL2 0.090 49
+ C211 CTL2 -0.180 50
+ H11R HAL2 0.090 51
+ H11S HAL2 0.090 52
+ C212 CTL2 -0.180 53
+ H12R HAL2 0.090 54
+ H12S HAL2 0.090 55
+ C213 CTL2 -0.180 56
+ H13R HAL2 0.090 57
+ H13S HAL2 0.090 58
+ C214 CTL2 -0.180 59
+ H14R HAL2 0.090 60
+ H14S HAL2 0.090 61
+ C215 CTL2 -0.180 62
+ H15R HAL2 0.090 63
+ H15S HAL2 0.090 64
+ C216 CTL2 -0.180 65
+ H16R HAL2 0.090 66
+ H16S HAL2 0.090 67
+ C217 CTL2 -0.180 68
+ H17R HAL2 0.090 69
+ H17S HAL2 0.090 70
+ C218 CTL3 -0.270 71
+ H18R HAL3 0.090 72
+ H18S HAL3 0.090 73
+ H18T HAL3 0.090 74
+ C33 CTL2 -0.180 75
+ H3X HAL2 0.090 76
+ H3Y HAL2 0.090 77
+ C34 CTL2 -0.180 78
+ H4X HAL2 0.090 79
+ H4Y HAL2 0.090 80
+ C35 CTL2 -0.180 81
+ H5X HAL2 0.090 82
+ H5Y HAL2 0.090 83
+ C36 CTL2 -0.180 84
+ H6X HAL2 0.090 85
+ H6Y HAL2 0.090 86
+ C37 CTL2 -0.180 87
+ H7X HAL2 0.090 88
+ H7Y HAL2 0.090 89
+ C38 CTL2 -0.180 90
+ H8X HAL2 0.090 91
+ H8Y HAL2 0.090 92
+ C39 CTL2 -0.180 93
+ H9X HAL2 0.090 94
+ H9Y HAL2 0.090 95
+ C310 CTL2 -0.180 96
+ H10X HAL2 0.090 97
+ H10Y HAL2 0.090 98
+ C311 CTL2 -0.180 99
+ H11X HAL2 0.090 100
+ H11Y HAL2 0.090 101
+ C312 CTL2 -0.180 102
+ H12X HAL2 0.090 103
+ H12Y HAL2 0.090 104
+ C313 CTL2 -0.180 105
+ H13X HAL2 0.090 106
+ H13Y HAL2 0.090 107
+ C314 CTL2 -0.180 108
+ H14X HAL2 0.090 109
+ H14Y HAL2 0.090 110
+ C315 CTL2 -0.180 111
+ H15X HAL2 0.090 112
+ H15Y HAL2 0.090 113
+ C316 CTL2 -0.180 114
+ H16X HAL2 0.090 115
+ H16Y HAL2 0.090 116
+ C317 CTL2 -0.180 117
+ H17X HAL2 0.090 118
+ H17Y HAL2 0.090 119
+ C318 CTL3 -0.270 120
+ H18X HAL3 0.090 121
+ H18Y HAL3 0.090 122
+ H18Z HAL3 0.090 123
+ [ bonds ]
+ O12 P
+ P O11
+ P O13
+ P O14
+ O12 H12
+ O11 C1
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DSPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C13 CTL5 -0.350 1
+ H13A HL 0.250 2
+ H13B HL 0.250 3
+ H13C HL 0.250 4
+ C14 CTL5 -0.350 5
+ H14A HL 0.250 6
+ H14B HL 0.250 7
+ H14C HL 0.250 8
+ C15 CTL5 -0.350 9
+ H15A HL 0.250 10
+ H15B HL 0.250 11
+ H15C HL 0.250 12
+ C12 CTL2 -0.100 13
+ H12A HL 0.250 14
+ H12B HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O11 OSLP -0.570 22
+ O12 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CTL2 -0.180 50
+ H5R HAL2 0.090 51
+ H5S HAL2 0.090 52
+ C26 CTL2 -0.180 53
+ H6R HAL2 0.090 54
+ H6S HAL2 0.090 55
+ C27 CTL2 -0.180 56
+ H7R HAL2 0.090 57
+ H7S HAL2 0.090 58
+ C28 CTL2 -0.180 59
+ H8R HAL2 0.090 60
+ H8S HAL2 0.090 61
+ C29 CTL2 -0.180 62
+ H9R HAL2 0.090 63
+ H9S HAL2 0.090 64
+ C210 CTL2 -0.180 65
+ H10R HAL2 0.090 66
+ H10S HAL2 0.090 67
+ C211 CTL2 -0.180 68
+ H11R HAL2 0.090 69
+ H11S HAL2 0.090 70
+ C212 CTL2 -0.180 71
+ H12R HAL2 0.090 72
+ H12S HAL2 0.090 73
+ C213 CTL2 -0.180 74
+ H13R HAL2 0.090 75
+ H13S HAL2 0.090 76
+ C214 CTL2 -0.180 77
+ H14R HAL2 0.090 78
+ H14S HAL2 0.090 79
+ C215 CTL2 -0.180 80
+ H15R HAL2 0.090 81
+ H15S HAL2 0.090 82
+ C216 CTL2 -0.180 83
+ H16R HAL2 0.090 84
+ H16S HAL2 0.090 85
+ C217 CTL2 -0.180 86
+ H17R HAL2 0.090 87
+ H17S HAL2 0.090 88
+ C218 CTL3 -0.270 89
+ H18R HAL3 0.090 90
+ H18S HAL3 0.090 91
+ H18T HAL3 0.090 92
+ C33 CTL2 -0.180 93
+ H3X HAL2 0.090 94
+ H3Y HAL2 0.090 95
+ C34 CTL2 -0.180 96
+ H4X HAL2 0.090 97
+ H4Y HAL2 0.090 98
+ C35 CTL2 -0.180 99
+ H5X HAL2 0.090 100
+ H5Y HAL2 0.090 101
+ C36 CTL2 -0.180 102
+ H6X HAL2 0.090 103
+ H6Y HAL2 0.090 104
+ C37 CTL2 -0.180 105
+ H7X HAL2 0.090 106
+ H7Y HAL2 0.090 107
+ C38 CTL2 -0.180 108
+ H8X HAL2 0.090 109
+ H8Y HAL2 0.090 110
+ C39 CTL2 -0.180 111
+ H9X HAL2 0.090 112
+ H9Y HAL2 0.090 113
+ C310 CTL2 -0.180 114
+ H10X HAL2 0.090 115
+ H10Y HAL2 0.090 116
+ C311 CTL2 -0.180 117
+ H11X HAL2 0.090 118
+ H11Y HAL2 0.090 119
+ C312 CTL2 -0.180 120
+ H12X HAL2 0.090 121
+ H12Y HAL2 0.090 122
+ C313 CTL2 -0.180 123
+ H13X HAL2 0.090 124
+ H13Y HAL2 0.090 125
+ C314 CTL2 -0.180 126
+ H14X HAL2 0.090 127
+ H14Y HAL2 0.090 128
+ C315 CTL2 -0.180 129
+ H15X HAL2 0.090 130
+ H15Y HAL2 0.090 131
+ C316 CTL2 -0.180 132
+ H16X HAL2 0.090 133
+ H16Y HAL2 0.090 134
+ C317 CTL2 -0.180 135
+ H17X HAL2 0.090 136
+ H17Y HAL2 0.090 137
+ C318 CTL3 -0.270 138
+ H18X HAL3 0.090 139
+ H18Y HAL3 0.090 140
+ H18Z HAL3 0.090 141
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DSPE ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL2 0.130 4
+ H12A HAL2 0.090 5
+ H12B HAL2 0.090 6
+ C11 CTL2 -0.080 7
+ H11A HAL2 0.090 8
+ H11B HAL2 0.090 9
+ P PL 1.500 10
+ O13 O2L -0.780 11
+ O14 O2L -0.780 12
+ O11 OSLP -0.570 13
+ O12 OSLP -0.570 14
+ C1 CTL2 -0.080 15
+ HA HAL2 0.090 16
+ HB HAL2 0.090 17
+ C2 CTL1 0.170 18
+ HS HAL1 0.090 19
+ O21 OSL -0.490 20
+ C21 CL 0.900 21
+ O22 OBL -0.630 22
+ C22 CTL2 -0.220 23
+ H2R HAL2 0.090 24
+ H2S HAL2 0.090 25
+ C3 CTL2 0.080 26
+ HX HAL2 0.090 27
+ HY HAL2 0.090 28
+ O31 OSL -0.490 29
+ C31 CL 0.900 30
+ O32 OBL -0.630 31
+ C32 CTL2 -0.220 32
+ H2X HAL2 0.090 33
+ H2Y HAL2 0.090 34
+ C23 CTL2 -0.180 35
+ H3R HAL2 0.090 36
+ H3S HAL2 0.090 37
+ C24 CTL2 -0.180 38
+ H4R HAL2 0.090 39
+ H4S HAL2 0.090 40
+ C25 CTL2 -0.180 41
+ H5R HAL2 0.090 42
+ H5S HAL2 0.090 43
+ C26 CTL2 -0.180 44
+ H6R HAL2 0.090 45
+ H6S HAL2 0.090 46
+ C27 CTL2 -0.180 47
+ H7R HAL2 0.090 48
+ H7S HAL2 0.090 49
+ C28 CTL2 -0.180 50
+ H8R HAL2 0.090 51
+ H8S HAL2 0.090 52
+ C29 CTL2 -0.180 53
+ H9R HAL2 0.090 54
+ H9S HAL2 0.090 55
+ C210 CTL2 -0.180 56
+ H10R HAL2 0.090 57
+ H10S HAL2 0.090 58
+ C211 CTL2 -0.180 59
+ H11R HAL2 0.090 60
+ H11S HAL2 0.090 61
+ C212 CTL2 -0.180 62
+ H12R HAL2 0.090 63
+ H12S HAL2 0.090 64
+ C213 CTL2 -0.180 65
+ H13R HAL2 0.090 66
+ H13S HAL2 0.090 67
+ C214 CTL2 -0.180 68
+ H14R HAL2 0.090 69
+ H14S HAL2 0.090 70
+ C215 CTL2 -0.180 71
+ H15R HAL2 0.090 72
+ H15S HAL2 0.090 73
+ C216 CTL2 -0.180 74
+ H16R HAL2 0.090 75
+ H16S HAL2 0.090 76
+ C217 CTL2 -0.180 77
+ H17R HAL2 0.090 78
+ H17S HAL2 0.090 79
+ C218 CTL3 -0.270 80
+ H18R HAL3 0.090 81
+ H18S HAL3 0.090 82
+ H18T HAL3 0.090 83
+ C33 CTL2 -0.180 84
+ H3X HAL2 0.090 85
+ H3Y HAL2 0.090 86
+ C34 CTL2 -0.180 87
+ H4X HAL2 0.090 88
+ H4Y HAL2 0.090 89
+ C35 CTL2 -0.180 90
+ H5X HAL2 0.090 91
+ H5Y HAL2 0.090 92
+ C36 CTL2 -0.180 93
+ H6X HAL2 0.090 94
+ H6Y HAL2 0.090 95
+ C37 CTL2 -0.180 96
+ H7X HAL2 0.090 97
+ H7Y HAL2 0.090 98
+ C38 CTL2 -0.180 99
+ H8X HAL2 0.090 100
+ H8Y HAL2 0.090 101
+ C39 CTL2 -0.180 102
+ H9X HAL2 0.090 103
+ H9Y HAL2 0.090 104
+ C310 CTL2 -0.180 105
+ H10X HAL2 0.090 106
+ H10Y HAL2 0.090 107
+ C311 CTL2 -0.180 108
+ H11X HAL2 0.090 109
+ H11Y HAL2 0.090 110
+ C312 CTL2 -0.180 111
+ H12X HAL2 0.090 112
+ H12Y HAL2 0.090 113
+ C313 CTL2 -0.180 114
+ H13X HAL2 0.090 115
+ H13Y HAL2 0.090 116
+ C314 CTL2 -0.180 117
+ H14X HAL2 0.090 118
+ H14Y HAL2 0.090 119
+ C315 CTL2 -0.180 120
+ H15X HAL2 0.090 121
+ H15Y HAL2 0.090 122
+ C316 CTL2 -0.180 123
+ H16X HAL2 0.090 124
+ H16Y HAL2 0.090 125
+ C317 CTL2 -0.180 126
+ H17X HAL2 0.090 127
+ H17Y HAL2 0.090 128
+ C318 CTL3 -0.270 129
+ H18X HAL3 0.090 130
+ H18Y HAL3 0.090 131
+ H18Z HAL3 0.090 132
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DSPG ]
+ [ atoms ]
+ C13 CTL2 0.050 0
+ H13A HAL2 0.090 1
+ H13B HAL2 0.090 2
+ OC3 OHL -0.650 3
+ HO3 HOL 0.420 4
+ C12 CTL1 0.140 5
+ H12A HAL1 0.090 6
+ OC2 OHL -0.650 7
+ HO2 HOL 0.420 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CTL2 -0.180 55
+ H9R HAL2 0.090 56
+ H9S HAL2 0.090 57
+ C210 CTL2 -0.180 58
+ H10R HAL2 0.090 59
+ H10S HAL2 0.090 60
+ C211 CTL2 -0.180 61
+ H11R HAL2 0.090 62
+ H11S HAL2 0.090 63
+ C212 CTL2 -0.180 64
+ H12R HAL2 0.090 65
+ H12S HAL2 0.090 66
+ C213 CTL2 -0.180 67
+ H13R HAL2 0.090 68
+ H13S HAL2 0.090 69
+ C214 CTL2 -0.180 70
+ H14R HAL2 0.090 71
+ H14S HAL2 0.090 72
+ C215 CTL2 -0.180 73
+ H15R HAL2 0.090 74
+ H15S HAL2 0.090 75
+ C216 CTL2 -0.180 76
+ H16R HAL2 0.090 77
+ H16S HAL2 0.090 78
+ C217 CTL2 -0.180 79
+ H17R HAL2 0.090 80
+ H17S HAL2 0.090 81
+ C218 CTL3 -0.270 82
+ H18R HAL3 0.090 83
+ H18S HAL3 0.090 84
+ H18T HAL3 0.090 85
+ C33 CTL2 -0.180 86
+ H3X HAL2 0.090 87
+ H3Y HAL2 0.090 88
+ C34 CTL2 -0.180 89
+ H4X HAL2 0.090 90
+ H4Y HAL2 0.090 91
+ C35 CTL2 -0.180 92
+ H5X HAL2 0.090 93
+ H5Y HAL2 0.090 94
+ C36 CTL2 -0.180 95
+ H6X HAL2 0.090 96
+ H6Y HAL2 0.090 97
+ C37 CTL2 -0.180 98
+ H7X HAL2 0.090 99
+ H7Y HAL2 0.090 100
+ C38 CTL2 -0.180 101
+ H8X HAL2 0.090 102
+ H8Y HAL2 0.090 103
+ C39 CTL2 -0.180 104
+ H9X HAL2 0.090 105
+ H9Y HAL2 0.090 106
+ C310 CTL2 -0.180 107
+ H10X HAL2 0.090 108
+ H10Y HAL2 0.090 109
+ C311 CTL2 -0.180 110
+ H11X HAL2 0.090 111
+ H11Y HAL2 0.090 112
+ C312 CTL2 -0.180 113
+ H12X HAL2 0.090 114
+ H12Y HAL2 0.090 115
+ C313 CTL2 -0.180 116
+ H13X HAL2 0.090 117
+ H13Y HAL2 0.090 118
+ C314 CTL2 -0.180 119
+ H14X HAL2 0.090 120
+ H14Y HAL2 0.090 121
+ C315 CTL2 -0.180 122
+ H15X HAL2 0.090 123
+ H15Y HAL2 0.090 124
+ C316 CTL2 -0.180 125
+ H16X HAL2 0.090 126
+ H16Y HAL2 0.090 127
+ C317 CTL2 -0.180 128
+ H17X HAL2 0.090 129
+ H17Y HAL2 0.090 130
+ C318 CTL3 -0.270 131
+ H18X HAL3 0.090 132
+ H18Y HAL3 0.090 133
+ H18Z HAL3 0.090 134
+ [ bonds ]
+ HO3 OC3
+ OC3 C13
+ C13 H13A
+ C13 H13B
+ C13 C12
+ HO2 OC2
+ OC2 C12
+ C12 H12A
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ DSPS ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL1 0.210 4
+ H12A HBL 0.100 5
+ C13 CCL 0.340 6
+ O13A OCL -0.670 7
+ O13B OCL -0.670 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CTL2 -0.180 55
+ H9R HAL2 0.090 56
+ H9S HAL2 0.090 57
+ C210 CTL2 -0.180 58
+ H10R HAL2 0.090 59
+ H10S HAL2 0.090 60
+ C211 CTL2 -0.180 61
+ H11R HAL2 0.090 62
+ H11S HAL2 0.090 63
+ C212 CTL2 -0.180 64
+ H12R HAL2 0.090 65
+ H12S HAL2 0.090 66
+ C213 CTL2 -0.180 67
+ H13R HAL2 0.090 68
+ H13S HAL2 0.090 69
+ C214 CTL2 -0.180 70
+ H14R HAL2 0.090 71
+ H14S HAL2 0.090 72
+ C215 CTL2 -0.180 73
+ H15R HAL2 0.090 74
+ H15S HAL2 0.090 75
+ C216 CTL2 -0.180 76
+ H16R HAL2 0.090 77
+ H16S HAL2 0.090 78
+ C217 CTL2 -0.180 79
+ H17R HAL2 0.090 80
+ H17S HAL2 0.090 81
+ C218 CTL3 -0.270 82
+ H18R HAL3 0.090 83
+ H18S HAL3 0.090 84
+ H18T HAL3 0.090 85
+ C33 CTL2 -0.180 86
+ H3X HAL2 0.090 87
+ H3Y HAL2 0.090 88
+ C34 CTL2 -0.180 89
+ H4X HAL2 0.090 90
+ H4Y HAL2 0.090 91
+ C35 CTL2 -0.180 92
+ H5X HAL2 0.090 93
+ H5Y HAL2 0.090 94
+ C36 CTL2 -0.180 95
+ H6X HAL2 0.090 96
+ H6Y HAL2 0.090 97
+ C37 CTL2 -0.180 98
+ H7X HAL2 0.090 99
+ H7Y HAL2 0.090 100
+ C38 CTL2 -0.180 101
+ H8X HAL2 0.090 102
+ H8Y HAL2 0.090 103
+ C39 CTL2 -0.180 104
+ H9X HAL2 0.090 105
+ H9Y HAL2 0.090 106
+ C310 CTL2 -0.180 107
+ H10X HAL2 0.090 108
+ H10Y HAL2 0.090 109
+ C311 CTL2 -0.180 110
+ H11X HAL2 0.090 111
+ H11Y HAL2 0.090 112
+ C312 CTL2 -0.180 113
+ H12X HAL2 0.090 114
+ H12Y HAL2 0.090 115
+ C313 CTL2 -0.180 116
+ H13X HAL2 0.090 117
+ H13Y HAL2 0.090 118
+ C314 CTL2 -0.180 119
+ H14X HAL2 0.090 120
+ H14Y HAL2 0.090 121
+ C315 CTL2 -0.180 122
+ H15X HAL2 0.090 123
+ H15Y HAL2 0.090 124
+ C316 CTL2 -0.180 125
+ H16X HAL2 0.090 126
+ H16Y HAL2 0.090 127
+ C317 CTL2 -0.180 128
+ H17X HAL2 0.090 129
+ H17Y HAL2 0.090 130
+ C318 CTL3 -0.270 131
+ H18X HAL3 0.090 132
+ H18Y HAL3 0.090 133
+ H18Z HAL3 0.090 134
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ O13B C13
+ C13 C12
+ C12 H12A
+ C12 C11
+ C1 O11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C13 O13A
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+ C13 C12 O13B O13A
+
+[ DTHROL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC322 0.050 13
+ H41 HCA2 0.090 14
+ H42 HCA2 0.090 15
+ O4 OC311 -0.650 16
+ HO4 HCP1 0.420 17
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H41
+ C4 O4
+ O4 HO4
+ C4 H42
+
+[ EAMM ]
+ [ atoms ]
+ CE CG324 0.210 0
+ NZ NG3P3 -0.300 1
+ HE1 HGA2 0.050 2
+ HE2 HGA2 0.050 3
+ HZ1 HGP2 0.330 4
+ HZ2 HGP2 0.330 5
+ HZ3 HGP2 0.330 6
+ C1 CG331 -0.270 7
+ H11 HGA3 0.090 8
+ H12 HGA3 0.090 9
+ H13 HGA3 0.090 10
+ [ bonds ]
+ CE HE1
+ CE HE2
+ CE C1
+ CE NZ
+ NZ HZ1
+ NZ HZ2
+ NZ HZ3
+ C1 H11
+ C1 H12
+ C1 H13
+
+[ EBEN ]
+ [ atoms ]
+ CG CG2R61 0.000 0
+ CD1 CG2R61 -0.115 1
+ HD1 HGR61 0.115 2
+ CD2 CG2R61 -0.115 3
+ HD2 HGR61 0.115 4
+ CE1 CG2R61 -0.115 5
+ HE1 HGR61 0.115 6
+ CE2 CG2R61 -0.115 7
+ HE2 HGR61 0.115 8
+ CZ CG2R61 -0.115 9
+ HZ HGR61 0.115 10
+ CB CG321 -0.180 11
+ HB1 HGA2 0.090 12
+ HB2 HGA2 0.090 13
+ CA CG331 -0.270 14
+ HA1 HGA3 0.090 15
+ HA2 HGA3 0.090 16
+ HA3 HGA3 0.090 17
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG CB
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ HZ
+ CB HB1
+ CB HB2
+ CB CA
+ CA HA1
+ CA HA2
+ CA HA3
+
+[ EESM ]
+ [ atoms ]
+ C3 CG321 0.040 0
+ H31 HGA2 0.090 1
+ H32 HGA2 0.090 2
+ S1 SG3O2 0.600 3
+ O11 OG2P1 -0.420 4
+ O12 OG2P1 -0.420 5
+ N2 NG311 -0.570 6
+ H21 HGP1 0.350 7
+ C4 CG321 0.060 8
+ H41 HGA2 0.090 9
+ H42 HGA2 0.090 10
+ C5 CG331 -0.270 11
+ H51 HGA3 0.090 12
+ H52 HGA3 0.090 13
+ H53 HGA3 0.090 14
+ C6 CG331 -0.270 15
+ H61 HGA3 0.090 16
+ H62 HGA3 0.090 17
+ H63 HGA3 0.090 18
+ [ bonds ]
+ C3 S1
+ S1 N2
+ S1 O11
+ S1 O12
+ N2 H21
+ N2 C4
+ C3 H31
+ C3 H32
+ C3 C5
+ C4 H41
+ C4 H42
+ C4 C6
+ C5 H51
+ C5 H52
+ C5 H53
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ EIMI ]
+ [ atoms ]
+ CA CG331 -0.270 0
+ HA1 HGA3 0.090 1
+ HA2 HGA3 0.090 2
+ HA3 HGA3 0.090 3
+ ND1 NG2R51 -0.360 4
+ HD1 HGP1 0.320 5
+ CG CG2R51 -0.050 6
+ CB CG321 -0.090 7
+ HB1 HGA2 0.090 8
+ HB2 HGA2 0.090 9
+ NE2 NG2R50 -0.700 10
+ CD2 CG2R51 0.220 11
+ HD2 HGR52 0.100 12
+ CE1 CG2R53 0.250 13
+ HE1 HGR52 0.130 14
+ [ bonds ]
+ NE2 CD2
+ ND1 CG
+ CE1 ND1
+ CG CB
+ ND1 HD1
+ CD2 HD2
+ CE1 HE1
+ CB HB1
+ CB HB2
+ CB CA
+ CA HA1
+ CA HA2
+ CA HA3
+ NE2 CE1
+ CD2 CG
+
+[ EIMM ]
+ [ atoms ]
+ CA CG331 -0.270 0
+ HA1 HGA3 0.090 1
+ HA2 HGA3 0.090 2
+ HA3 HGA3 0.090 3
+ CB CG321 -0.050 4
+ HB1 HGA2 0.090 5
+ HB2 HGA2 0.090 6
+ CG CG2R51 0.190 7
+ CD2 CG2R51 0.190 8
+ HD2 HGR52 0.130 9
+ ND1 NG2R52 -0.510 10
+ HD1 HGP2 0.440 11
+ NE2 NG2R52 -0.510 12
+ HE2 HGP2 0.440 13
+ CE1 CG2R53 0.320 14
+ HE1 HGR53 0.180 15
+ [ bonds ]
+ NE2 CD2
+ ND1 CG
+ CE1 ND1
+ CG CB
+ NE2 HE2
+ ND1 HD1
+ CD2 HD2
+ CE1 HE1
+ CB HB1
+ CB HB2
+ CB CA
+ CA HA1
+ CA HA2
+ CA HA3
+ CD2 CG
+ NE2 CE1
+
+[ EIND ]
+ [ atoms ]
+ CA CG331 -0.270 0
+ HA1 HGA3 0.090 1
+ HA2 HGA3 0.090 2
+ HA3 HGA3 0.090 3
+ CB CG321 -0.180 4
+ HB1 HGA2 0.090 5
+ HB2 HGA2 0.090 6
+ CG CG2R51 -0.030 7
+ CD2 CG2RC0 0.110 8
+ CD1 CG2R51 -0.150 9
+ HD1 HGR52 0.220 10
+ NE1 NG2R51 -0.510 11
+ HE1 HGP1 0.370 12
+ CE2 CG2RC0 0.240 13
+ CE3 CG2R61 -0.250 14
+ HE3 HGR61 0.170 15
+ CZ2 CG2R61 -0.270 16
+ HZ2 HGR61 0.160 17
+ CZ3 CG2R61 -0.200 18
+ HZ3 HGR61 0.140 19
+ CH2 CG2R61 -0.140 20
+ HH2 HGR61 0.140 21
+ [ bonds ]
+ CA HA1
+ CA HA2
+ CA HA3
+ CA CB
+ CB HB1
+ CB HB2
+ CG CB
+ CD2 CG
+ NE1 CD1
+ CZ2 CE2
+ CZ3 CH2
+ CD2 CE3
+ NE1 CE2
+ CD1 HD1
+ NE1 HE1
+ CE3 HE3
+ CZ3 HZ3
+ CH2 HH2
+ CZ2 HZ2
+ CD1 CG
+ CE2 CD2
+ CH2 CZ2
+ CZ3 CE3
+
+[ EMS ]
+ [ atoms ]
+ H1 HGA3 0.090 0
+ H2 HGA3 0.090 1
+ H3 HGA3 0.090 2
+ CM1 CG331 -0.270 3
+ H4 HGA2 0.090 4
+ H5 HGA2 0.090 5
+ CM2 CG321 -0.130 6
+ S3 SG311 -0.100 7
+ CM4 CG331 -0.220 8
+ H6 HGA3 0.090 9
+ H7 HGA3 0.090 10
+ H8 HGA3 0.090 11
+ [ bonds ]
+ CM1 H1
+ CM1 H2
+ CM1 H3
+ CM1 CM2
+ CM2 H4
+ CM2 H5
+ CM2 S3
+ S3 CM4
+ CM4 H6
+ CM4 H7
+ CM4 H8
+
+[ EPET ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ C2 CC32A -0.010 4
+ H21 HCA2A 0.090 5
+ H22 HCA2A 0.090 6
+ O3 OC30A -0.340 7
+ C4 CC32A -0.010 8
+ H41 HCA2A 0.090 9
+ H42 HCA2A 0.090 10
+ C5 CC32A -0.180 11
+ H51 HCA2A 0.090 12
+ H52 HCA2A 0.090 13
+ C6 CC33A -0.270 14
+ H61 HCA3A 0.090 15
+ H62 HCA3A 0.090 16
+ H63 HCA3A 0.090 17
+ [ bonds ]
+ C1 C2
+ C2 O3
+ O3 C4
+ C4 C5
+ C5 C6
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ EPHE ]
+ [ atoms ]
+ CG CG2R61 0.000 0
+ CD1 CG2R61 -0.115 1
+ HD1 HGR61 0.115 2
+ CD2 CG2R61 -0.115 3
+ HD2 HGR61 0.115 4
+ CE1 CG2R61 -0.115 5
+ HE1 HGR61 0.115 6
+ CE2 CG2R61 -0.115 7
+ HE2 HGR61 0.115 8
+ CZ CG2R61 0.110 9
+ OH OG311 -0.530 10
+ HH HGP1 0.420 11
+ CB CG321 -0.180 12
+ HB1 HGA2 0.090 13
+ HB2 HGA2 0.090 14
+ CA CG331 -0.270 15
+ HA1 HGA3 0.090 16
+ HA2 HGA3 0.090 17
+ HA3 HGA3 0.090 18
+ [ bonds ]
+ CD2 CG
+ CE1 CD1
+ CZ CE2
+ CG CB
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ OH
+ OH HH
+ CB HB1
+ CB HB2
+ CB CA
+ CA HA1
+ CA HA2
+ CA HA3
+ CD1 CG
+ CE2 CD2
+ CZ CE1
+
+[ EPRE ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG321 -0.010 4
+ H21 HGA2 0.090 5
+ H22 HGA2 0.090 6
+ O3 OG301 -0.340 7
+ C4 CG321 -0.010 8
+ H41 HGA2 0.090 9
+ H42 HGA2 0.090 10
+ C5 CG321 -0.180 11
+ H51 HGA2 0.090 12
+ H52 HGA2 0.090 13
+ C6 CG331 -0.270 14
+ H61 HGA3 0.090 15
+ H62 HGA3 0.090 16
+ H63 HGA3 0.090 17
+ [ bonds ]
+ C1 C2
+ C2 O3
+ O3 C4
+ C4 C5
+ C5 C6
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ EP_2 ]
+ [ atoms ]
+ P1 PG2 1.100 0
+ O1 OG303 -0.400 1
+ O2 OG2P1 -0.900 2
+ O3 OG2P1 -0.900 3
+ O4 OG2P1 -0.900 4
+ C1 CG321 -0.180 5
+ H11 HGA2 0.090 6
+ H12 HGA2 0.090 7
+ C2 CG331 -0.270 8
+ H21 HGA3 0.090 9
+ H22 HGA3 0.090 10
+ H23 HGA3 0.090 11
+ [ bonds ]
+ P1 O1
+ P1 O2
+ P1 O3
+ P1 O4
+ O1 C1
+ C1 H11
+ C1 H12
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ ES1 ]
+ [ atoms ]
+ S SG302 -0.800 0
+ C1 CG323 -0.380 1
+ C2 CG331 -0.270 2
+ H21 HGA3 0.090 3
+ H22 HGA3 0.090 4
+ H23 HGA3 0.090 5
+ H11 HGA2 0.090 6
+ H12 HGA2 0.090 7
+ [ bonds ]
+ S C1
+ C1 H11
+ C1 H12
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ ESNA ]
+ [ atoms ]
+ S SG3O1 0.730 0
+ O1 OG2P1 -0.550 1
+ O2 OG2P1 -0.550 2
+ O3 OG2P1 -0.550 3
+ C1 CG321 -0.260 4
+ H11 HGA2 0.090 5
+ H12 HGA2 0.090 6
+ C2 CG331 -0.270 7
+ H21 HGA3 0.090 8
+ H22 HGA3 0.090 9
+ H23 HGA3 0.090 10
+ [ bonds ]
+ S O1
+ S O2
+ S O3
+ S C1
+ C1 H11
+ C1 H12
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ ETAC ]
+ [ atoms ]
+ C1 CG331 -0.310 0
+ C CG2O2 0.900 1
+ OM OG302 -0.490 2
+ C2 CG321 0.080 3
+ O OG2D1 -0.630 4
+ H11 HGA3 0.090 5
+ H12 HGA3 0.090 6
+ H13 HGA3 0.090 7
+ H22 HGA2 0.090 8
+ H23 HGA2 0.090 9
+ C21 CG331 -0.270 10
+ H211 HGA3 0.090 11
+ H212 HGA3 0.090 12
+ H213 HGA3 0.090 13
+ [ bonds ]
+ C1 C
+ C OM
+ OM C2
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 C21
+ C2 H22
+ C2 H23
+ C21 H211
+ C21 H212
+ C21 H213
+ C O
+ [ impropers ]
+ C C1 O OM
+
+[ ETAM ]
+ [ atoms ]
+ N NG3P3 -0.300 0
+ HN1 HGP2 0.330 1
+ HN2 HGP2 0.330 2
+ HN3 HGP2 0.330 3
+ C1 CG324 0.130 4
+ H11 HGA2 0.090 5
+ H12 HGA2 0.090 6
+ C5 CG321 0.050 7
+ H51 HGA2 0.090 8
+ H52 HGA2 0.090 9
+ OH1 OG311 -0.650 10
+ HO1 HGP1 0.420 11
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C1
+ C1 H11
+ C1 H12
+ C1 C5
+ C5 H51
+ C5 H52
+ C5 OH1
+ OH1 HO1
+
+[ ETHA ]
+ [ atoms ]
+ H11 HCA3A 0.090 0
+ H12 HCA3A 0.090 1
+ H13 HCA3A 0.090 2
+ C1 CC33A -0.270 3
+ H21 HCA3A 0.090 4
+ H22 HCA3A 0.090 5
+ H23 HCA3A 0.090 6
+ C2 CC33A -0.270 7
+ [ bonds ]
+ c1 h11
+ c1 h12
+ c1 h13
+ c1 c2
+ c2 h21
+ c2 h22
+ c2 h23
+
+[ ETHE ]
+ [ atoms ]
+ C1 CG2D2 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2D2 -0.420 3
+ H21 HGA5 0.210 4
+ H22 HGA5 0.210 5
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 H22
+ C1 C2
+
+[ ETO ]
+ [ atoms ]
+ OG OG312 -0.920 0
+ CB CG321 -0.300 1
+ CA CG331 -0.270 2
+ HB1 HGA2 0.110 3
+ HB2 HGA2 0.110 4
+ HA1 HGA3 0.090 5
+ HA2 HGA3 0.090 6
+ HA3 HGA3 0.090 7
+ [ bonds ]
+ CA CB
+ CB OG
+ CB HB1
+ CB HB2
+ CA HA1
+ CA HA2
+ CA HA3
+
+[ ETOB ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ CG2R61 0.220 10
+ OZ OG301 -0.390 11
+ C1 CG321 -0.010 12
+ H1A HGA2 0.090 13
+ H1B HGA2 0.090 14
+ C2 CG331 -0.270 15
+ H2A HGA3 0.090 16
+ H2B HGA3 0.090 17
+ H2C HGA3 0.090 18
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ OZ
+ OZ C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 H2C
+
+[ ETOH ]
+ [ atoms ]
+ C1 CG321 0.050 0
+ O1 OG311 -0.650 1
+ HO1 HGP1 0.420 2
+ H11 HGA2 0.090 3
+ H12 HGA2 0.090 4
+ C2 CG331 -0.270 5
+ H21 HGA3 0.090 6
+ H22 HGA3 0.090 7
+ H23 HGA3 0.090 8
+ [ bonds ]
+ C1 C2
+ C1 O1
+ C1 H11
+ C1 H12
+ O1 HO1
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ ETRZ ]
+ [ atoms ]
+ N1 NG2R51 0.280 0
+ N2 NG2R50 -0.370 1
+ N3 NG2R50 -0.410 2
+ C4 CG2R51 0.250 3
+ H4 HGR52 0.110 4
+ C5 CG2R51 -0.350 5
+ H5 HGR52 0.200 6
+ C6 CG321 0.110 7
+ H61 HGA2 0.090 8
+ H62 HGA2 0.090 9
+ C7 CG331 -0.270 10
+ H71 HGA3 0.090 11
+ H72 HGA3 0.090 12
+ H73 HGA3 0.090 13
+ [ bonds ]
+ N1 C5
+ N1 N2
+ N1 C6
+ N2 N3
+ N3 C4
+ C4 C5
+ C4 H4
+ C5 H5
+ C6 C7
+ C6 H61
+ C6 H62
+ C7 H71
+ C7 H72
+ C7 H73
+
+[ ETSH ]
+ [ atoms ]
+ H1 HGA3 0.090 0
+ H2 HGA3 0.090 1
+ H3 HGA3 0.090 2
+ CM1 CG331 -0.270 3
+ H4 HGA2 0.090 4
+ H5 HGA2 0.090 5
+ CM2 CG321 -0.110 6
+ S3 SG311 -0.230 7
+ H6 HGP3 0.160 8
+ [ bonds ]
+ CM1 H1
+ CM1 H2
+ CM1 H3
+ CM1 CM2
+ CM2 H4
+ CM2 H5
+ CM2 S3
+ S3 H6
+
+[ FBIB ]
+ [ atoms ]
+ CG CG2R61 0.000 0
+ CD1 CG2R61 -0.115 1
+ HD1 HGR61 0.115 2
+ CD2 CG2R61 -0.115 3
+ HD2 HGR61 0.115 4
+ CE1 CG2R61 -0.115 5
+ HE1 HGR61 0.115 6
+ CE2 CG2R61 0.000 7
+ CC CG311 -0.090 8
+ HC HGA1 0.090 9
+ C1 CG331 -0.270 10
+ H1A HGA3 0.090 11
+ H1B HGA3 0.090 12
+ H1C HGA3 0.090 13
+ C2 CG331 -0.270 14
+ H2A HGA3 0.090 15
+ H2B HGA3 0.090 16
+ H2C HGA3 0.090 17
+ CZ CG2R61 0.110 18
+ OH OG311 -0.530 19
+ HH HGP1 0.420 20
+ CB CG321 -0.180 21
+ HB1 HGA2 0.090 22
+ HB2 HGA2 0.090 23
+ CA CG321 -0.280 24
+ HA1 HGA2 0.090 25
+ HA2 HGA2 0.090 26
+ CD CG2O3 0.620 27
+ OD1 OG2D2 -0.760 28
+ OD2 OG2D2 -0.760 29
+ [ bonds ]
+ CG CD1
+ CD1 HD1
+ CD1 CE1
+ CE1 HE1
+ CE1 CZ
+ CG CD2
+ CD2 HD2
+ CD2 CE2
+ CE2 CC
+ CE2 CZ
+ CG CB
+ CB HB1
+ CB HB2
+ CB CA
+ CA HA1
+ CA HA2
+ CA CD
+ CD OD1
+ CD OD2
+ CC HC
+ CC C1
+ CC C2
+ C1 H1A
+ C1 H1B
+ C1 H1C
+ C2 H2A
+ C2 H2B
+ C2 H2C
+ CZ OH
+ OH HH
+ [ impropers ]
+ CD OD2 OD1 CA
+
+[ FENZ ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ H1 HGR61 0.115 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 0.320 8
+ N6 NG2R60 -0.640 9
+ C7 CG2R61 0.320 10
+ C8 CG2R61 -0.115 11
+ H8 HGR61 0.115 12
+ C9 CG2R61 -0.115 13
+ H9 HGR61 0.115 14
+ C10 CG2R61 -0.115 15
+ H10 HGR61 0.115 16
+ C11 CG2R61 -0.115 17
+ H11 HGR61 0.115 18
+ C12 CG2R61 0.320 19
+ N13 NG2R60 -0.640 20
+ C14 CG2R61 0.320 21
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 N6
+ N6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 N13
+ N13 C14
+ C14 C1
+ C5 C14
+ C7 C12
+ C1 H1
+ C2 H2
+ C3 H3
+ C4 H4
+ C8 H8
+ C9 H9
+ C10 H10
+ C11 H11
+
+[ FEOZ ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ H1 HGR61 0.115 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 0.130 8
+ O6 OG3R60 -0.260 9
+ C7 CG2R61 0.130 10
+ C8 CG2R61 -0.115 11
+ H8 HGR61 0.115 12
+ C9 CG2R61 -0.115 13
+ H9 HGR61 0.115 14
+ C10 CG2R61 -0.115 15
+ H10 HGR61 0.115 16
+ C11 CG2R61 -0.115 17
+ H11 HGR61 0.115 18
+ C12 CG2R61 0.040 19
+ N13 NG311 -0.470 20
+ H13 HGPAM1 0.390 21
+ C14 CG2R61 0.040 22
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 O6
+ O6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 N13
+ N13 C14
+ C14 C1
+ C5 C14
+ C7 C12
+ C1 H1
+ C2 H2
+ C3 H3
+ C4 H4
+ C8 H8
+ C9 H9
+ C10 H10
+ C11 H11
+ N13 H13
+
+[ FETH ]
+ [ atoms ]
+ H13 HGA3 0.090 0
+ C1 CG331 -0.210 1
+ C2 CG322 -0.060 2
+ F21 FGA1 -0.220 3
+ H22 HGA6 0.110 4
+ H23 HGA6 0.110 5
+ H11 HGA3 0.090 6
+ H12 HGA3 0.090 7
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 F21
+ C2 H22
+ C2 H23
+
+[ FETZ ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ H1 HGR61 0.115 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 0.130 8
+ S6 SG311 -0.240 9
+ C7 CG2R61 0.130 10
+ C8 CG2R61 -0.115 11
+ H8 HGR61 0.115 12
+ C9 CG2R61 -0.115 13
+ H9 HGR61 0.115 14
+ C10 CG2R61 -0.115 15
+ H10 HGR61 0.115 16
+ C11 CG2R61 -0.115 17
+ H11 HGR61 0.115 18
+ C12 CG2R61 -0.010 19
+ N13 NG311 -0.360 20
+ H13 HGPAM1 0.360 21
+ C14 CG2R61 -0.010 22
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 S6
+ S6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 N13
+ N13 C14
+ C14 C1
+ C5 C14
+ C7 C12
+ C1 H1
+ C2 H2
+ C3 H3
+ C4 H4
+ C8 H8
+ C9 H9
+ C10 H10
+ C11 H11
+ N13 H13
+
+[ FLRN ]
+ [ atoms ]
+ C1 CG2R61 -0.140 0
+ H1 HGR61 0.140 1
+ C2 CG2R61 -0.170 2
+ H2 HGR61 0.170 3
+ C3 CG2R61 -0.190 4
+ H3 HGR61 0.190 5
+ C4 CG2R61 -0.280 6
+ H4 HGR61 0.280 7
+ C5 CG2R67 -0.240 8
+ C6 CG2R67 -0.240 9
+ C7 CG2R61 -0.280 10
+ H7 HGR61 0.280 11
+ C8 CG2R61 -0.190 12
+ H8 HGR61 0.190 13
+ C9 CG2R61 -0.170 14
+ H9 HGR61 0.170 15
+ C10 CG2R61 -0.140 16
+ H10 HGR61 0.140 17
+ C11 CG2RC0 0.240 18
+ C12 CG3C52 -0.180 19
+ H21 HGA2 0.090 20
+ H22 HGA2 0.090 21
+ C13 CG2RC0 0.240 22
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 C13
+ C13 C1
+ C5 C13
+ C6 C11
+ C1 H1
+ C2 H2
+ C3 H3
+ C4 H4
+ C7 H7
+ C8 H8
+ C9 H9
+ C10 H10
+ C12 H21
+ C12 H22
+
+[ FLUB ]
+ [ atoms ]
+ C1 CG2R61 -0.100 0
+ H1 HGR62 0.150 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 -0.100 8
+ H5 HGR62 0.150 9
+ C6 CG2R66 0.110 10
+ F6 FGR1 -0.210 11
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 C1
+ C6 F6
+
+[ FORA ]
+ [ atoms ]
+ C1 CG2O3 0.520 0
+ O2 OG2D2 -0.760 1
+ O3 OG2D2 -0.760 2
+ H4 HGR52 0.000 3
+ [ bonds ]
+ C1 H4
+ C1 O2
+ C1 O3
+ [ impropers ]
+ C1 O2 O3 H4
+
+[ FORH ]
+ [ atoms ]
+ C CG2O2 0.380 0
+ H HGR52 0.110 1
+ O2 OG2D1 -0.400 2
+ O1 OG311 -0.490 3
+ HO1 HGP1 0.400 4
+ [ bonds ]
+ C O1
+ C H
+ O1 HO1
+ C O2
+ [ impropers ]
+ C O2 O1 H
+
+[ FORM ]
+ [ atoms ]
+ HA HGR52 0.080 0
+ C CG2O1 0.420 1
+ N NG2S2 -0.690 2
+ HC HGP1 0.350 3
+ HT HGP1 0.350 4
+ O OG2D1 -0.510 5
+ [ bonds ]
+ C HA
+ C N
+ N HC
+ N HT
+ C O
+ [ impropers ]
+ C N O HA
+
+[ FRET ]
+ [ atoms ]
+ C1 CG301 0.000 0
+ C2 CG321 -0.180 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG321 -0.180 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ C4 CG321 -0.180 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG2DC2 0.000 10
+ C6 CG2DC2 0.000 11
+ C7 CG2DC1 -0.150 12
+ H71 HGA4 0.150 13
+ C8 CG2DC1 -0.150 14
+ H81 HGA4 0.150 15
+ C9 CG2DC2 0.000 16
+ C10 CG2DC2 -0.150 17
+ H101 HGA4 0.150 18
+ C11 CG2DC1 -0.150 19
+ H111 HGA4 0.150 20
+ C12 CG2DC1 -0.150 21
+ H121 HGA4 0.150 22
+ C13 CG2DC2 0.000 23
+ C14 CG2DC2 -0.150 24
+ H141 HGA4 0.150 25
+ C16 CG331 -0.270 26
+ H161 HGA3 0.090 27
+ H162 HGA3 0.090 28
+ H163 HGA3 0.090 29
+ C17 CG331 -0.270 30
+ H171 HGA3 0.090 31
+ H172 HGA3 0.090 32
+ H173 HGA3 0.090 33
+ C18 CG331 -0.270 34
+ H181 HGA3 0.090 35
+ H182 HGA3 0.090 36
+ H183 HGA3 0.090 37
+ C19 CG331 -0.270 38
+ H191 HGA3 0.090 39
+ H192 HGA3 0.090 40
+ H193 HGA3 0.090 41
+ C20 CG331 -0.270 42
+ H201 HGA3 0.090 43
+ H202 HGA3 0.090 44
+ H203 HGA3 0.090 45
+ C15 CG2O1 0.510 46
+ O29 OG2D1 -0.510 47
+ N21 NG2S1 -0.470 48
+ H211 HGP1 0.330 49
+ C22 CG2R61 0.140 50
+ C23 CG2R61 -0.115 51
+ H231 HGR61 0.115 52
+ C24 CG2R61 -0.115 53
+ H241 HGR61 0.115 54
+ C26 CG2R61 -0.115 55
+ H261 HGR61 0.115 56
+ C27 CG2R61 -0.115 57
+ H271 HGR61 0.115 58
+ C25 CG2R61 0.110 59
+ O28 OG311 -0.530 60
+ H281 HGP1 0.420 61
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C1
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 C13
+ C13 C14
+ C14 C15
+ C15 N21
+ N21 C22
+ C22 C23
+ C23 C24
+ C24 C25
+ C25 C26
+ C26 C27
+ C27 C22
+ C1 C16
+ C1 C17
+ C5 C18
+ C9 C19
+ C13 C20
+ C15 O29
+ C25 O28
+ O28 H281
+ N21 H211
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C7 H71
+ C8 H81
+ C10 H101
+ C11 H111
+ C12 H121
+ C14 H141
+ C16 H161
+ C16 H162
+ C16 H163
+ C17 H171
+ C17 H172
+ C17 H173
+ C18 H181
+ C18 H182
+ C18 H183
+ C19 H191
+ C19 H192
+ C19 H193
+ C20 H201
+ C20 H202
+ C20 H203
+ C23 H231
+ C24 H241
+ C26 H261
+ C27 H271
+ [ impropers ]
+ C15 C14 N21 O29
+
+[ FTAZ ]
+ [ atoms ]
+ C1 CG2R61 0.340 0
+ H1 HGR62 0.080 1
+ N2 NG2R62 -0.490 2
+ N3 NG2R62 -0.490 3
+ C4 CG2R61 0.340 4
+ H4 HGR62 0.080 5
+ C5 CG2R61 0.070 6
+ C6 CG2R61 -0.115 7
+ H6 HGR61 0.115 8
+ C7 CG2R61 -0.115 9
+ H7 HGR61 0.115 10
+ C8 CG2R61 -0.115 11
+ H8 HGR61 0.115 12
+ C9 CG2R61 -0.115 13
+ H9 HGR61 0.115 14
+ C10 CG2R61 0.070 15
+ [ bonds ]
+ C1 N2
+ N2 N3
+ N3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C5 C10
+ C1 C10
+ C1 H1
+ C4 H4
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+
+[ FURA ]
+ [ atoms ]
+ C1 CG2R51 0.100 0
+ H1 HGR52 0.140 1
+ C2 CG2R51 -0.250 2
+ H2 HGR51 0.150 3
+ C3 CG2R51 -0.250 4
+ H3 HGR51 0.150 5
+ C4 CG2R51 0.100 6
+ H4 HGR52 0.140 7
+ O5 OG2R50 -0.280 8
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 O5
+ O5 C1
+
+[ GA ]
+ [ atoms ]
+ C3 CG311 0.140 0
+ O3 OG311 -0.650 1
+ H3' HGP1 0.420 2
+ H3 HGA1 0.090 3
+ C4 CG321 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CG311 -0.090 7
+ H5 HGA1 0.090 8
+ C6 CG321 -0.180 9
+ H6A HGA2 0.090 10
+ H6B HGA2 0.090 11
+ C7 CG311 0.140 12
+ O7 OG311 -0.650 13
+ H7' HGP1 0.420 14
+ H7 HGA1 0.090 15
+ C8 CG311 -0.090 16
+ H8 HGA1 0.090 17
+ C14 CG3RC1 -0.090 18
+ H14 HGA1 0.090 19
+ C15 CG3C52 -0.180 20
+ H15A HGA2 0.090 21
+ H15B HGA2 0.090 22
+ C16 CG3C52 -0.180 23
+ H16A HGA2 0.090 24
+ H16B HGA2 0.090 25
+ C17 CG3C51 -0.090 26
+ H17 HGA1 0.090 27
+ C13 CG3RC1 0.000 28
+ C18 CG331 -0.270 29
+ H18A HGA3 0.090 30
+ H18B HGA3 0.090 31
+ H18C HGA3 0.090 32
+ C12 CG321 -0.180 33
+ H12A HGA2 0.090 34
+ H12B HGA2 0.090 35
+ C11 CG321 -0.180 36
+ H11A HGA2 0.090 37
+ H11B HGA2 0.090 38
+ C9 CG311 -0.090 39
+ H9 HGA1 0.090 40
+ C10 CG301 0.000 41
+ C19 CG331 -0.270 42
+ H19A HGA3 0.090 43
+ H19B HGA3 0.090 44
+ H19C HGA3 0.090 45
+ C1 CG321 -0.180 46
+ H1A HGA2 0.090 47
+ H1B HGA2 0.090 48
+ C2 CG321 -0.180 49
+ H2A HGA2 0.090 50
+ H2B HGA2 0.090 51
+ C20 CG311 -0.090 52
+ H20 HGA1 0.090 53
+ C21 CG331 -0.270 54
+ H21A HGA3 0.090 55
+ H21B HGA3 0.090 56
+ H21C HGA3 0.090 57
+ C22 CG321 -0.180 58
+ H22A HGA2 0.090 59
+ H22B HGA2 0.090 60
+ C23 CG321 -0.180 61
+ H23A HGA2 0.090 62
+ H23B HGA2 0.090 63
+ C24 CG2O1 0.510 64
+ O24 OG2D1 -0.510 65
+ N NG2S1 -0.470 66
+ HN HGP1 0.470 67
+ CC1 CG311 -0.190 68
+ HC1 HGA1 0.090 69
+ CA CG2O3 0.620 70
+ OA1 OG2D2 -0.760 71
+ OA2 OG2D2 -0.760 72
+ CC2 CG321 -0.180 73
+ HC2A HGA2 0.090 74
+ HC2B HGA2 0.090 75
+ CC3 CG321 -0.280 76
+ HC3A HGA2 0.090 77
+ HC3B HGA2 0.090 78
+ CG CG2O3 0.620 79
+ OG1 OG2D2 -0.760 80
+ OG2 OG2D2 -0.760 81
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 H3'
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5
+ C5 C10
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C10 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C7
+ C7 H7
+ C7 O7
+ O7 H7'
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C13 C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 C24
+ C24 O24
+ C24 N
+ N HN
+ N CC1
+ CC1 HC1
+ CC1 CA
+ CA OA1
+ CA OA2
+ CC1 CC2
+ CC2 HC2A
+ CC2 HC2B
+ CC2 CC3
+ CC3 HC3A
+ CC3 HC3B
+ CC3 CG
+ CG OG1
+ CG OG2
+ [ impropers ]
+ C24 C23 N O24
+ CA OA2 OA1 CC1
+ CG OG2 OG1 CC3
+
+[ GABD ]
+ [ atoms ]
+ C3 CG311 0.140 0
+ O3 OG311 -0.650 1
+ HO3 HGP1 0.420 2
+ H3 HGA1 0.090 3
+ C4 CG321 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CG311 -0.090 7
+ H5 HGA1 0.090 8
+ C6 CG321 -0.180 9
+ H6A HGA2 0.090 10
+ H6B HGA2 0.090 11
+ C7 CG311 0.140 12
+ O7 OG311 -0.650 13
+ HO7 HGP1 0.420 14
+ H7 HGA1 0.090 15
+ C8 CG311 -0.090 16
+ H8 HGA1 0.090 17
+ C14 CG3RC1 -0.090 18
+ H14 HGA1 0.090 19
+ C15 CG3C52 -0.180 20
+ H15A HGA2 0.090 21
+ H15B HGA2 0.090 22
+ C16 CG3C52 -0.180 23
+ H16A HGA2 0.090 24
+ H16B HGA2 0.090 25
+ C17 CG3C51 -0.090 26
+ H17 HGA1 0.090 27
+ C13 CG3RC1 0.000 28
+ C18 CG331 -0.270 29
+ H18A HGA3 0.090 30
+ H18B HGA3 0.090 31
+ H18C HGA3 0.090 32
+ C12 CG321 -0.180 33
+ H12A HGA2 0.090 34
+ H12B HGA2 0.090 35
+ C11 CG321 -0.180 36
+ H11A HGA2 0.090 37
+ H11B HGA2 0.090 38
+ C9 CG311 -0.090 39
+ H9 HGA1 0.090 40
+ C10 CG301 0.000 41
+ C19 CG331 -0.270 42
+ H19A HGA3 0.090 43
+ H19B HGA3 0.090 44
+ H19C HGA3 0.090 45
+ C1 CG321 -0.180 46
+ H1A HGA2 0.090 47
+ H1B HGA2 0.090 48
+ C2 CG321 -0.180 49
+ H2A HGA2 0.090 50
+ H2B HGA2 0.090 51
+ C20 CG311 -0.090 52
+ H20 HGA1 0.090 53
+ C21 CG331 -0.270 54
+ H21A HGA3 0.090 55
+ H21B HGA3 0.090 56
+ H21C HGA3 0.090 57
+ C22 CG321 -0.180 58
+ H22A HGA2 0.090 59
+ H22B HGA2 0.090 60
+ C23 CG321 -0.180 61
+ H23A HGA2 0.090 62
+ H23B HGA2 0.090 63
+ C24 CG2O1 0.510 64
+ O24 OG2D1 -0.510 65
+ N NG2S1 -0.470 66
+ HN HGP1 0.470 67
+ CC1 CG311 -0.190 68
+ HC1 HGA1 0.090 69
+ CA CG2O3 0.620 70
+ OA1 OG2D2 -0.760 71
+ OA2 OG2D2 -0.760 72
+ CC2 CG321 -0.180 73
+ HC2A HGA2 0.090 74
+ HC2B HGA2 0.090 75
+ CC3 CG321 -0.180 76
+ HC3A HGA2 0.090 77
+ HC3B HGA2 0.090 78
+ CG CG2O1 0.520 79
+ OG OG2D1 -0.520 80
+ NG NG2S1 -0.470 81
+ HG HGP1 0.330 82
+ CZ CG2R61 0.140 83
+ CD1 CG2R61 -0.115 84
+ HD1 HGR61 0.115 85
+ CE1 CG2R61 -0.115 86
+ HE1 HGR61 0.115 87
+ CP CG2R61 -0.115 88
+ HP HGR61 0.115 89
+ CE2 CG2R61 -0.115 90
+ HE2 HGR61 0.115 91
+ CD2 CG2R61 -0.115 92
+ HD2 HGR61 0.115 93
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 HO3
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5
+ C5 C10
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C10 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C7
+ C7 H7
+ C7 O7
+ O7 HO7
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C13 C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 C24
+ C24 O24
+ C24 N
+ N HN
+ N CC1
+ CC1 HC1
+ CC1 CC2
+ CC1 CA
+ CA OA1
+ CA OA2
+ CC2 HC2A
+ CC2 HC2B
+ CC2 CC3
+ CC3 HC3A
+ CC3 HC3B
+ CC3 CG
+ CG OG
+ CG NG
+ NG HG
+ NG CZ
+ CZ CD1
+ CD1 HD1
+ CD1 CE1
+ CE1 HE1
+ CE1 CP
+ CP HP
+ CP CE2
+ CE2 HE2
+ CE2 CD2
+ CD2 HD2
+ CD2 CZ
+ [ impropers ]
+ C24 C23 N O24
+ CA OA2 OA1 CC1
+ CG CC3 NG OG
+
+[ GBL ]
+ [ atoms ]
+ O1 OG3C51 -0.270 0
+ C2 CG2R53 0.150 1
+ O2 OG2D1 -0.390 2
+ C3 CG3C52 0.070 3
+ H31 HGA2 0.090 4
+ H32 HGA2 0.090 5
+ C4 CG3C52 -0.190 6
+ H41 HGA2 0.090 7
+ H42 HGA2 0.090 8
+ C5 CG3C52 0.090 9
+ H51 HGA2 0.090 10
+ H52 HGA2 0.090 11
+ [ bonds ]
+ O1 C5
+ O1 C2
+ C2 C3
+ C2 O2
+ C3 C4
+ C3 H31
+ C3 H32
+ C4 C5
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ [ impropers ]
+ C2 C3 O2 O1
+
+[ GLN ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CT2 -0.180 7
+ HG1 HA2 0.090 8
+ HG2 HA2 0.090 9
+ CD CC 0.550 10
+ OE1 O -0.550 11
+ NE2 NH2 -0.620 12
+ HE21 H 0.320 13
+ HE22 H 0.300 14
+ C C 0.510 15
+ O O -0.510 16
+ [ bonds ]
+ CB CA
+ CG CB
+ CD CG
+ NE2 CD
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CG HG1
+ CG HG2
+ NE2 HE21
+ NE2 HE22
+ O C
+ CD OE1
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ CD NE2 CG OE1
+ CD CG NE2 OE1
+ NE2 CD HE21 HE22
+ NE2 CD HE22 HE21
+ [ cmap ]
+ -C N CA C +N
+
+
+
+[ GLUP ] ; protonated GLU
+ [ atoms ]
+ N NH1 -0.47 0
+ HN H 0.31 1
+ CA CT1 0.07 2
+ HA HB1 0.09 3
+ CB CT2 -0.18 4
+ HB1 HA2 0.09 5
+ HB2 HA2 0.09 6
+ CG CT2 -0.21 7
+ HG1 HA2 0.09 8
+ HG2 HA2 0.09 9
+ CD CD 0.75 10
+ OE1 OB -0.55 11
+ OE2 OH1 -0.61 12
+ HE2 H 0.44 13
+ C C 0.51 14
+ O O -0.51 15
+ [ bonds ]
+ CB CA
+ CG CB
+ CD CG
+ OE2 CD
+ OE2 HE2
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CG HG1
+ CG HG2
+ O C
+ CD OE1
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ CD CG OE2 OE1
+ [ cmap ]
+ -C N CA C +N
+
+[ GLU ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2A -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CT2 -0.280 7
+ HG1 HA2 0.140 8
+ HG2 HA2 0.140 9
+ CD CC 1.000 10
+ OE1 OC -0.500 11
+ OE2 OC -0.500 12
+ C C 0.510 13
+ O O -0.510 14
+ [ bonds ]
+ CB CA
+ CG CB
+ CD CG
+ OE2 CD
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CG HG1
+ CG HG2
+ O C
+ CD OE1
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ CD CG OE2 OE1
+ [ cmap ]
+ -C N CA C +N
+
+[ GLY ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT2 -0.020 2
+ HA1 HB2 0.090 3
+ HA2 HB2 0.090 4
+ C C 0.510 5
+ O O -0.510 6
+ [ bonds ]
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA1
+ CA HA2
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ GLYC ]
+ [ atoms ]
+ C3 CG331 -0.270 0
+ H31 HGA3 0.090 1
+ H32 HGA3 0.090 2
+ H33 HGA3 0.090 3
+ C1 CG321 0.080 4
+ H11 HGA2 0.090 5
+ H12 HGA2 0.090 6
+ O4 OG302 -0.490 7
+ C5 CG2O2 0.900 8
+ O6 OG2D1 -0.630 9
+ C7 CG331 -0.310 10
+ H71 HGA3 0.090 11
+ H72 HGA3 0.090 12
+ H73 HGA3 0.090 13
+ C2 CG311 0.170 14
+ H21 HGA1 0.090 15
+ O8 OG302 -0.490 16
+ C9 CG2O2 0.900 17
+ O10 OG2D1 -0.630 18
+ C11 CG331 -0.310 19
+ H111 HGA3 0.090 20
+ H112 HGA3 0.090 21
+ H113 HGA3 0.090 22
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C1 O4
+ O4 C5
+ C5 C7
+ C5 O6
+ C2 O8
+ O8 C9
+ C9 C11
+ C9 O10
+ C1 H11
+ C1 H12
+ C2 H21
+ C3 H31
+ C3 H32
+ C3 H33
+ C7 H71
+ C7 H72
+ C7 H73
+ C11 H111
+ C11 H112
+ C11 H113
+ [ impropers ]
+ C5 C7 O6 O4
+ C9 C11 O10 O8
+
+[ GLYN ]
+ [ atoms ]
+ N NG321 -0.960 0
+ HT1 HGPAM2 0.340 1
+ HT2 HGPAM2 0.340 2
+ CA CG321 0.180 3
+ HA1 HGA2 0.050 4
+ HA2 HGA2 0.050 5
+ C CG2O2 0.750 6
+ OT1 OG2D1 -0.550 7
+ OT2 OG311 -0.630 8
+ HO2 HGP1 0.430 9
+ [ bonds ]
+ N CA
+ CA C
+ C OT2
+ OT2 HO2
+ N HT1
+ N HT2
+ CA HA1
+ CA HA2
+ OT1 C
+ [ impropers ]
+ C CA OT1 OT2
+
+[ GPC ]
+ [ atoms ]
+ N NG3P0 -0.600 0
+ C1 CG324 -0.100 1
+ C2 CG334 -0.350 2
+ C3 CG334 -0.350 3
+ C4 CG334 -0.350 4
+ H11 HGP5 0.250 5
+ H12 HGP5 0.250 6
+ H21 HGP5 0.250 7
+ H22 HGP5 0.250 8
+ H23 HGP5 0.250 9
+ H31 HGP5 0.250 10
+ H32 HGP5 0.250 11
+ H33 HGP5 0.250 12
+ H41 HGP5 0.250 13
+ H42 HGP5 0.250 14
+ H43 HGP5 0.250 15
+ C5 CG321 -0.080 16
+ H51 HGA2 0.090 17
+ H52 HGA2 0.090 18
+ P PG1 1.500 19
+ O3 OG2P1 -0.780 20
+ O4 OG2P1 -0.780 21
+ O1 OG303 -0.570 22
+ O2 OG303 -0.570 23
+ CG1 CG321 -0.080 24
+ HG11 HGA2 0.090 25
+ HG12 HGA2 0.090 26
+ CG2 CG311 0.140 27
+ HG21 HGA1 0.090 28
+ OG2 OG311 -0.650 29
+ HO2 HGP1 0.420 30
+ CG3 CG321 0.050 31
+ HG31 HGA2 0.090 32
+ HG32 HGA2 0.090 33
+ OG3 OG311 -0.650 34
+ HO3 HGP1 0.420 35
+ [ bonds ]
+ CG1 O2
+ CG1 HG11
+ CG1 HG12
+ CG2 CG1
+ CG2 HG21
+ CG2 OG2
+ OG2 HO2
+ CG3 CG2
+ CG3 HG31
+ CG3 HG32
+ CG3 OG3
+ OG3 HO3
+ N C1
+ N C2
+ N C3
+ N C4
+ C1 H11
+ C1 H12
+ C1 C5
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+ C4 H41
+ C4 H42
+ C4 H43
+ C5 H51
+ C5 H52
+ P O1
+ P O2
+ P O3
+ P O4
+ O1 C5
+
+[ GUA ]
+ [ atoms ]
+ P P 1.500 0
+ O1P ON3 -0.780 1
+ O2P ON3 -0.780 2
+ O5' ON2 -0.570 3
+ C5' CN8B -0.080 4
+ H5' HN8 0.090 5
+ H5'' HN8 0.090 6
+ C4' CN7 0.160 7
+ H4' HN7 0.090 8
+ O4' ON6B -0.500 9
+ C1' CN7B 0.160 10
+ H1' HN7 0.090 11
+ N9 NN2B -0.020 12
+ C4 CN5 0.260 13
+ N2 NN1 -0.680 14
+ H21 HN1 0.320 15
+ H22 HN1 0.350 16
+ N3 NN3G -0.740 17
+ C2 CN2 0.750 18
+ N1 NN2G -0.340 19
+ H1 HN2 0.260 20
+ C6 CN1 0.540 21
+ O6 ON1 -0.510 22
+ C5 CN5G 0.000 23
+ N7 NN4 -0.600 24
+ C8 CN4 0.250 25
+ H8 HN3 0.160 26
+ C2' CN7B 0.140 27
+ H2'' HN7 0.090 28
+ O2' ON5 -0.660 29
+ H2' HN5 0.430 30
+ C3' CN7 0.010 31
+ H3' HN7 0.090 32
+ O3' ON2 -0.570 33
+ [ bonds ]
+ P O1P
+ P O2P
+ P O5'
+ O5' C5'
+ C5' C4'
+ C4' O4'
+ C4' C3'
+ O4' C1'
+ C1' N9
+ C1' C2'
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N2
+ C2 N1
+ N2 H21
+ N2 H22
+ N1 H1
+ N1 C6
+ C6 C5
+ C5 N7
+ C2' C3'
+ C3' O3'
+ O3' +P
+ C2' O2'
+ O2' H2'
+ C1' H1'
+ C2' H2''
+ C3' H3'
+ C4' H4'
+ C5' H5'
+ C5' H5''
+ C8 H8
+ C2 N3
+ C4 C5
+ N7 C8
+ C6 O6
+ [ impropers ]
+ C2 N3 N1 N2
+ C6 N1 C5 O6
+ N2 H21 C2 H22
+
+[ GUAN ]
+ [ atoms ]
+ C CG2N1 0.640 0
+ N1 NG2P1 -0.800 1
+ H11 HGP2 0.460 2
+ H12 HGP2 0.460 3
+ N2 NG2P1 -0.800 4
+ H21 HGP2 0.460 5
+ H22 HGP2 0.460 6
+ N3 NG2P1 -0.800 7
+ H31 HGP2 0.460 8
+ H32 HGP2 0.460 9
+ [ bonds ]
+ C N2
+ C N3
+ N1 H11
+ N1 H12
+ N2 H21
+ N2 H22
+ N3 H31
+ N3 H32
+ C N1
+ [ impropers ]
+ C N2 N1 N3
+
+[ HDZ1 ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG2O1 0.580 4
+ O2 OG2D1 -0.490 5
+ N3 NG2S1 -0.340 6
+ H3 HGP1 0.310 7
+ N4 NG2D1 -0.310 8
+ C5 CG2D1 -0.240 9
+ H5 HGA4 0.240 10
+ C6 CG331 -0.020 11
+ H61 HGA3 0.090 12
+ H62 HGA3 0.090 13
+ H63 HGA3 0.090 14
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 O2
+ C2 N3
+ N3 H3
+ N3 N4
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+ N4 C5
+ [ impropers ]
+ C2 C1 N3 O2
+ C5 C6 N4 H5
+
+[ HDZ1B ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG2O1 0.580 4
+ O2 OG2D1 -0.490 5
+ N3 NG2S1 -0.340 6
+ H3 HGP1 0.310 7
+ N4 NG2D1 -0.310 8
+ C5 CG2DC1 -0.240 9
+ H5 HGA4 0.240 10
+ C6G CG2R61 0.250 11
+ C6D1 CG2R61 -0.115 12
+ H6D1 HGR61 0.115 13
+ C6D2 CG2R61 -0.115 14
+ H6D2 HGR61 0.115 15
+ C6E1 CG2R61 -0.115 16
+ H6E1 HGR61 0.115 17
+ C6E2 CG2R61 -0.115 18
+ H6E2 HGR61 0.115 19
+ C6Z CG2R61 -0.115 20
+ H6Z HGR61 0.115 21
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 O2
+ C2 N3
+ N3 H3
+ N3 N4
+ C5 H5
+ N4 C5
+ C5 C6G
+ C6D2 C6G
+ C6E1 C6D1
+ C6Z C6E2
+ C6D1 H6D1
+ C6D2 H6D2
+ C6E1 H6E1
+ C6E2 H6E2
+ C6Z H6Z
+ C6D1 C6G
+ C6E2 C6D2
+ C6Z C6E1
+ [ impropers ]
+ C2 C1 N3 O2
+ C5 C6G N4 H5
+
+[ HDZ2 ]
+ [ atoms ]
+ HG HGR51 0.140 0
+ CG CG2R51 -0.170 1
+ CD2 CG2RC0 0.110 2
+ CD1 CG2R51 -0.150 3
+ HD1 HGR52 0.220 4
+ NE1 NG2R51 -0.510 5
+ HE1 HGP1 0.370 6
+ CE2 CG2RC0 0.240 7
+ CE3 CG2R61 -0.250 8
+ HE3 HGR61 0.170 9
+ CZ2 CG2R61 -0.110 10
+ CZ3 CG2R61 -0.200 11
+ HZ3 HGR61 0.140 12
+ CH2 CG2R61 -0.140 13
+ HH2 HGR61 0.140 14
+ C2 CG2O1 0.580 15
+ O2 OG2D1 -0.490 16
+ N3 NG2S1 -0.340 17
+ H3 HGP1 0.310 18
+ N4 NG2D1 -0.310 19
+ C5 CG2DC1 -0.240 20
+ H5 HGA4 0.240 21
+ CPG CG2R61 0.250 22
+ CPD1 CG2R61 -0.115 23
+ HPD1 HGR61 0.115 24
+ CPD2 CG2R61 -0.115 25
+ HPD2 HGR61 0.115 26
+ CPE1 CG2R61 -0.115 27
+ HPE1 HGR61 0.115 28
+ CPE2 CG2R61 -0.115 29
+ HPE2 HGR61 0.115 30
+ CPZ CG2R61 0.110 31
+ OPH OG311 -0.530 32
+ HPH HGP1 0.420 33
+ [ bonds ]
+ CG HG
+ CD2 CG
+ NE1 CD1
+ CZ2 CE2
+ CZ3 CH2
+ CD2 CE3
+ NE1 CE2
+ CD1 HD1
+ NE1 HE1
+ CE3 HE3
+ CZ3 HZ3
+ CH2 HH2
+ CD1 CG
+ CE2 CD2
+ CH2 CZ2
+ CZ3 CE3
+ CZ2 C2
+ C2 O2
+ C2 N3
+ N3 H3
+ N3 N4
+ C5 H5
+ N4 C5
+ C5 CPG
+ CPD2 CPG
+ CPE1 CPD1
+ CPZ CPE2
+ CPD1 HPD1
+ CPD2 HPD2
+ CPE1 HPE1
+ CPE2 HPE2
+ CPZ OPH
+ OPH HPH
+ CPD1 CPG
+ CPE2 CPD2
+ CPZ CPE1
+ [ impropers ]
+ C2 CZ2 N3 O2
+ C5 CPG N4 H5
+
+[ HDZN ]
+ [ atoms ]
+ N1 NG3N1 -0.780 0
+ H11 HGP1 0.390 1
+ H12 HGP1 0.390 2
+ N2 NG3N1 -0.780 3
+ H21 HGP1 0.390 4
+ H22 HGP1 0.390 5
+ [ bonds ]
+ N1 H11
+ N1 H12
+ N1 N2
+ N2 H21
+ N2 H22
+
+[ HEME ]
+ [ atoms ]
+ FE FE 0.240 0
+ NA NPH -0.180 1
+ NB NPH -0.180 2
+ NC NPH -0.180 3
+ ND NPH -0.180 4
+ C1A CPA 0.120 5
+ C2A CPB -0.060 6
+ C3A CPB -0.060 7
+ C4A CPA 0.120 8
+ C1B CPA 0.120 9
+ C2B CPB -0.060 10
+ C3B CPB -0.060 11
+ C4B CPA 0.120 12
+ C1C CPA 0.120 13
+ C2C CPB -0.060 14
+ C3C CPB -0.060 15
+ C4C CPA 0.120 16
+ C1D CPA 0.120 17
+ C2D CPB -0.060 18
+ C3D CPB -0.060 19
+ C4D CPA 0.120 20
+ CHA CPM -0.100 21
+ HA HA 0.100 22
+ CHB CPM -0.100 23
+ HB HA 0.100 24
+ CHC CPM -0.100 25
+ HC HA 0.100 26
+ CHD CPM -0.100 27
+ HD HA 0.100 28
+ CMA CT3 -0.270 29
+ HMA1 HA3 0.090 30
+ HMA2 HA3 0.090 31
+ HMA3 HA3 0.090 32
+ CAA CT2 -0.180 33
+ HAA1 HA2 0.090 34
+ HAA2 HA2 0.090 35
+ CBA CT2 -0.280 36
+ HBA1 HA2 0.090 37
+ HBA2 HA2 0.090 38
+ CGA CC 0.620 39
+ O1A OC -0.760 40
+ O2A OC -0.760 41
+ CMB CT3 -0.270 42
+ HMB1 HA3 0.090 43
+ HMB2 HA3 0.090 44
+ HMB3 HA3 0.090 45
+ CAB CE1 -0.150 46
+ HAB HE1 0.150 47
+ CBB CE2 -0.420 48
+ HBB1 HE2 0.210 49
+ HBB2 HE2 0.210 50
+ CMC CT3 -0.270 51
+ HMC1 HA3 0.090 52
+ HMC2 HA3 0.090 53
+ HMC3 HA3 0.090 54
+ CAC CE1 -0.150 55
+ HAC HE1 0.150 56
+ CBC CE2 -0.420 57
+ HBC1 HE2 0.210 58
+ HBC2 HE2 0.210 59
+ CMD CT3 -0.270 60
+ HMD1 HA3 0.090 61
+ HMD2 HA3 0.090 62
+ HMD3 HA3 0.090 63
+ CAD CT2 -0.180 64
+ HAD1 HA2 0.090 65
+ HAD2 HA2 0.090 66
+ CBD CT2 -0.280 67
+ HBD1 HA2 0.090 68
+ HBD2 HA2 0.090 69
+ CGD CC 0.620 70
+ O1D OC -0.760 71
+ O2D OC -0.760 72
+ [ bonds ]
+ FE NA
+ FE NB
+ FE NC
+ FE ND
+ NA C1A
+ C1A C2A
+ C2A C3A
+ C3A C4A
+ NA C4A
+ C2A CAA
+ CAA CBA
+ CBA CGA
+ CGA O1A
+ CGA O2A
+ C3A CMA
+ CHB C4A
+ CHB C1B
+ NB C1B
+ C1B C2B
+ C2B C3B
+ C3B C4B
+ NB C4B
+ C2B CMB
+ C3B CAB
+ CAB CBB
+ CHC C4B
+ CHC C1C
+ NC C1C
+ C1C C2C
+ C2C C3C
+ C3C C4C
+ NC C4C
+ C2C CMC
+ C3C CAC
+ CAC CBC
+ CHD C4C
+ CHD C1D
+ ND C1D
+ C1D C2D
+ C2D C3D
+ C3D C4D
+ ND C4D
+ C2D CMD
+ C3D CAD
+ CAD CBD
+ CBD CGD
+ CGD O1D
+ CGD O2D
+ CHA C4D
+ CHA C1A
+ CHA HA
+ CHB HB
+ CHC HC
+ CHD HD
+ CAA HAA1
+ CAA HAA2
+ CBA HBA1
+ CBA HBA2
+ CMA HMA1
+ CMA HMA2
+ CMA HMA3
+ CMB HMB1
+ CMB HMB2
+ CMB HMB3
+ CAB HAB
+ CBB HBB1
+ CBB HBB2
+ CMC HMC1
+ CMC HMC2
+ CMC HMC3
+ CAC HAC
+ CBC HBC1
+ CBC HBC2
+ CMD HMD1
+ CMD HMD2
+ CMD HMD3
+ CAD HAD1
+ CAD HAD2
+ CBD HBD1
+ CBD HBD2
+ [ impropers ]
+ C2A C1A C3A CAA
+ C3A C2A C4A CMA
+ C2B C1B C3B CMB
+ C3B C2B C4B CAB
+ C2C C1C C3C CMC
+ C3C C2C C4C CAC
+ C2D C1D C3D CMD
+ C3D C2D C4D CAD
+ CGA CBA O2A O1A
+ CGD CBD O2D O1D
+ C4A NA C1A C2A
+ C1A NA C4A C3A
+ C4B NB C1B C2B
+ C1B NB C4B C3B
+ C4C NC C1C C2C
+ C1C NC C4C C3C
+ C4D ND C1D C2D
+ C1D ND C4D C3D
+ NA C1A C2A C3A
+ NA C4A C3A C2A
+ NB C1B C2B C3B
+ NB C4B C3B C2B
+ NC C1C C2C C3C
+ NC C4C C3C C2C
+ ND C1D C2D C3D
+ ND C4D C3D C2D
+ NA C1A CHA C4D
+ NA C4A CHB C1B
+ NB C1B CHB C4A
+ NB C4B CHC C1C
+ NC C1C CHC C4B
+ NC C4C CHD C1D
+ ND C1D CHD C4C
+ ND C4D CHA C1A
+ CHA C1A C4D HA
+ CHB C1B C4A HB
+ CHC C1C C4B HC
+ CHD C1D C4C HD
+ C1A C2A CHA NA
+ C4A C3A CHB NA
+ C1B C2B CHB NB
+ C4B C3B CHC NB
+ C1C C2C CHC NC
+ C4C C3C CHD NC
+ C1D C2D CHD ND
+ C4D C3D CHA ND
+ NA C1A C4A FE
+ NB C1B C4B FE
+ NC C1C C4C FE
+ ND C1D C4D FE
+
+[ HEPT ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ C2 CC32A -0.180 4
+ H21 HCA2A 0.090 5
+ H22 HCA2A 0.090 6
+ C3 CC32A -0.180 7
+ H31 HCA2A 0.090 8
+ H32 HCA2A 0.090 9
+ C4 CC32A -0.180 10
+ H41 HCA2A 0.090 11
+ H42 HCA2A 0.090 12
+ C5 CC32A -0.180 13
+ H51 HCA2A 0.090 14
+ H52 HCA2A 0.090 15
+ C6 CC32A -0.180 16
+ H61 HCA2A 0.090 17
+ H62 HCA2A 0.090 18
+ C7 CC33A -0.270 19
+ H71 HCA3A 0.090 20
+ H72 HCA3A 0.090 21
+ H73 HCA3A 0.090 22
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+ C7 H71
+ C7 H72
+ C7 H73
+
+[ HEX3 ]
+ [ atoms ]
+ C1 CG2DC3 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2DC2 -0.150 3
+ H21 HGA4 0.150 4
+ C3 CG2DC1 -0.150 5
+ H31 HGA4 0.150 6
+ C4 CG2DC1 -0.150 7
+ H41 HGA4 0.150 8
+ C5 CG2DC2 -0.150 9
+ H51 HGA4 0.150 10
+ C6 CG2DC3 -0.420 11
+ H61 HGA5 0.210 12
+ H62 HGA5 0.210 13
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C1 H11
+ C1 H12
+ C2 H21
+ C3 H31
+ C4 H41
+ C5 H51
+ C6 H61
+ C6 H62
+
+[ HEXA ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ C2 CC32A -0.180 4
+ H21 HCA2A 0.090 5
+ H22 HCA2A 0.090 6
+ C3 CC32A -0.180 7
+ H31 HCA2A 0.090 8
+ H32 HCA2A 0.090 9
+ C4 CC32A -0.180 10
+ H41 HCA2A 0.090 11
+ H42 HCA2A 0.090 12
+ C5 CC32A -0.180 13
+ H51 HCA2A 0.090 14
+ H52 HCA2A 0.090 15
+ C6 CC33A -0.270 16
+ H61 HCA3A 0.090 17
+ H62 HCA3A 0.090 18
+ H63 HCA3A 0.090 19
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ HEXD ]
+ [ atoms ]
+ H11 HGA2 0.090 0
+ H12 HGA2 0.090 1
+ HO1 HGP1 0.420 2
+ C1 CG321 0.050 3
+ O1 OG311 -0.650 4
+ H21 HGA2 0.090 5
+ H22 HGA2 0.090 6
+ C2 CG321 -0.180 7
+ H31 HGA2 0.090 8
+ H32 HGA2 0.090 9
+ C3 CG321 -0.180 10
+ H41 HGA2 0.090 11
+ H42 HGA2 0.090 12
+ C4 CG321 -0.180 13
+ H51 HGA2 0.090 14
+ H52 HGA2 0.090 15
+ C5 CG321 -0.180 16
+ H61 HGA2 0.090 17
+ H62 HGA2 0.090 18
+ HO6 HGP1 0.420 19
+ C6 CG321 0.050 20
+ O6 OG311 -0.650 21
+ [ bonds ]
+ H11 C1
+ H12 C1
+ O1 C1
+ C1 C2
+ H21 C2
+ H22 C2
+ C2 C3
+ O1 HO1
+ H31 C3
+ H32 C3
+ C3 C4
+ H41 C4
+ H42 C4
+ C4 C5
+ H51 C5
+ H52 C5
+ C5 C6
+ H61 C6
+ H62 C6
+ C6 O6
+ O6 HO6
+
+[ HSD ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.090 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ ND1 NR1 -0.360 7
+ HD1 H 0.320 8
+ CG CPH1 -0.050 9
+ CE1 CPH2 0.250 10
+ HE1 HR1 0.130 11
+ NE2 NR2 -0.700 12
+ CD2 CPH1 0.220 13
+ HD2 HR3 0.100 14
+ C C 0.510 15
+ O O -0.510 16
+ [ bonds ]
+ CB CA
+ CG CB
+ ND1 CG
+ CE1 ND1
+ NE2 CD2
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ ND1 HD1
+ CD2 HD2
+ CE1 HE1
+ O C
+ CG CD2
+ CE1 NE2
+ [ impropers ]
+ ND1 CG CE1 HD1
+ CD2 CG NE2 HD2
+ CE1 ND1 NE2 HE1
+ ND1 CE1 CG HD1
+ CD2 NE2 CG HD2
+ CE1 NE2 ND1 HE1
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ HSE ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.080 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ ND1 NR2 -0.700 7
+ CG CPH1 0.220 8
+ CE1 CPH2 0.250 9
+ HE1 HR1 0.130 10
+ NE2 NR1 -0.360 11
+ HE2 H 0.320 12
+ CD2 CPH1 -0.050 13
+ HD2 HR3 0.090 14
+ C C 0.510 15
+ O O -0.510 16
+ [ bonds ]
+ CB CA
+ CG CB
+ ND1 CG
+ NE2 CD2
+ N HN
+ N CA
+ C CA
+ C +N
+ NE2 CE1
+ CA HA
+ CB HB1
+ CB HB2
+ NE2 HE2
+ CD2 HD2
+ CE1 HE1
+ O C
+ CD2 CG
+ CE1 ND1
+ [ impropers ]
+ NE2 CD2 CE1 HE2
+ CD2 CG NE2 HD2
+ CE1 ND1 NE2 HE1
+ NE2 CE1 CD2 HE2
+ CD2 NE2 CG HD2
+ CE1 NE2 ND1 HE1
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ HSP ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2A -0.100 4
+ HB1 HA2 0.050 5
+ HB2 HA2 0.050 6
+ CD2 CPH1 0.050 7
+ HD2 HR1 0.000 8
+ CG CPH1 0.050 9
+ NE2 NR3 -0.550 10
+ HE2 H 0.450 11
+ ND1 NR3 -0.550 12
+ HD1 H 0.450 13
+ CE1 CPH2 0.100 14
+ HE1 HR2 0.000 15
+ C C 0.510 16
+ O O -0.510 17
+ [ bonds ]
+ CB CA
+ CG CB
+ ND1 CG
+ CE1 ND1
+ NE2 CD2
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ ND1 HD1
+ NE2 HE2
+ CD2 HD2
+ CE1 HE1
+ O C
+ CD2 CG
+ NE2 CE1
+ [ impropers ]
+ ND1 CG CE1 HD1
+ ND1 CE1 CG HD1
+ NE2 CD2 CE1 HE2
+ NE2 CE1 CD2 HE2
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ HXE2 ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG2D1 -0.150 4
+ H21 HGA4 0.150 5
+ C3 CG2D1 -0.150 6
+ H31 HGA4 0.150 7
+ C4 CG321 -0.180 8
+ H41 HGA2 0.090 9
+ H42 HGA2 0.090 10
+ C5 CG321 -0.180 11
+ H51 HGA2 0.090 12
+ H52 HGA2 0.090 13
+ C6 CG331 -0.270 14
+ H61 HGA3 0.090 15
+ H62 HGA3 0.090 16
+ H63 HGA3 0.090 17
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 H21
+ C3 H31
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+ C2 C3
+
+[ IBUT ]
+ [ atoms ]
+ CT CC31A -0.090 0
+ HT HCA1A 0.090 1
+ C1 CC33A -0.270 2
+ H11 HCA3A 0.090 3
+ H12 HCA3A 0.090 4
+ H13 HCA3A 0.090 5
+ C2 CC33A -0.270 6
+ H21 HCA3A 0.090 7
+ H22 HCA3A 0.090 8
+ H23 HCA3A 0.090 9
+ C3 CC33A -0.270 10
+ H31 HCA3A 0.090 11
+ H32 HCA3A 0.090 12
+ H33 HCA3A 0.090 13
+ [ bonds ]
+ ct c1
+ ct c2
+ ct c3
+ ct ht
+ c1 h11
+ c1 h12
+ c1 h13
+ c2 h21
+ c2 h22
+ c2 h23
+ c3 h31
+ c3 h32
+ c3 h33
+
+[ ILE ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT1 -0.090 4
+ HB HA1 0.090 5
+ CG2 CT3 -0.270 6
+ HG21 HA3 0.090 7
+ HG22 HA3 0.090 8
+ HG23 HA3 0.090 9
+ CG1 CT2 -0.180 10
+ HG11 HA2 0.090 11
+ HG12 HA2 0.090 12
+ CD CT3 -0.270 13
+ HD1 HA3 0.090 14
+ HD2 HA3 0.090 15
+ HD3 HA3 0.090 16
+ C C 0.510 17
+ O O -0.510 18
+ [ bonds ]
+ CB CA
+ CG1 CB
+ CG2 CB
+ CD CG1
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB
+ CG1 HG11
+ CG1 HG12
+ CG2 HG21
+ CG2 HG22
+ CG2 HG23
+ CD HD1
+ CD HD2
+ CD HD3
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ IMDP ]
+ [ atoms ]
+ N1 NG3C51 -0.890 0
+ H1 HGP1 0.500 1
+ C2 CG3C54 0.160 2
+ H21 HGA2 0.280 3
+ H22 HGA2 0.280 4
+ N3 NG3P2 -0.890 5
+ H31 HGP2 0.540 6
+ H32 HGP2 0.540 7
+ C4 CG3C54 -0.220 8
+ H41 HGA2 0.280 9
+ H42 HGA2 0.280 10
+ C5 CG3C52 -0.040 11
+ H51 HGA2 0.090 12
+ H52 HGA2 0.090 13
+ [ bonds ]
+ N1 H1
+ C2 H21
+ C2 H22
+ N3 H31
+ N3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ N1 C2
+ C2 N3
+ C4 C5
+ C5 N1
+ N3 C4
+
+[ IMIA ]
+ [ atoms ]
+ CG CG2R51 -0.050 0
+ HG HGR52 0.090 1
+ CD2 CG2R51 0.220 2
+ HD2 HGR52 0.100 3
+ ND1 NG2R51 -0.360 4
+ HD1 HGP1 0.320 5
+ CE1 CG2R53 0.250 6
+ HE1 HGR52 0.130 7
+ NE2 NG2R50 -0.700 8
+ [ bonds ]
+ NE2 CD2
+ ND1 CG
+ CE1 ND1
+ CG HG
+ ND1 HD1
+ CD2 HD2
+ CE1 HE1
+ NE2 CE1
+ CD2 CG
+
+[ IMIM ]
+ [ atoms ]
+ CG CG2R51 0.190 0
+ HG HGR52 0.130 1
+ CD2 CG2R51 0.190 2
+ HD2 HGR52 0.130 3
+ ND1 NG2R52 -0.510 4
+ HD1 HGP2 0.440 5
+ NE2 NG2R52 -0.510 6
+ HE2 HGP2 0.440 7
+ CE1 CG2R53 0.320 8
+ HE1 HGR53 0.180 9
+ [ bonds ]
+ NE2 CD2
+ ND1 CG
+ CE1 ND1
+ CG HG
+ ND1 HD1
+ CD2 HD2
+ CE1 HE1
+ NE2 HE2
+ NE2 CE1
+ CD2 CG
+
+[ INDA ]
+ [ atoms ]
+ N1 NG2R51 -0.050 0
+ H1 HGP1 0.280 1
+ N2 NG2R50 -0.600 2
+ C3 CG2R52 0.280 3
+ H3 HGR52 0.090 4
+ C4 CG2RC0 -0.110 5
+ C5 CG2R61 -0.430 6
+ H5 HGR61 0.300 7
+ C6 CG2R61 -0.380 8
+ H6 HGR61 0.280 9
+ C7 CG2R61 -0.260 10
+ H7 HGR61 0.240 11
+ C8 CG2R61 -0.200 12
+ H8 HGR61 0.150 13
+ C9 CG2RC0 0.410 14
+ [ bonds ]
+ C3 H3
+ C4 C3
+ N1 N2
+ C8 C9
+ C6 C7
+ C4 C5
+ N1 C9
+ N1 H1
+ C5 H5
+ C6 H6
+ C7 H7
+ C8 H8
+ N2 C3
+ C9 C4
+ C7 C8
+ C6 C5
+
+[ INDE ]
+ [ atoms ]
+ C1 CG3C52 0.020 0
+ H11 HGA2 0.090 1
+ H12 HGA2 0.090 2
+ C2 CG2R51 -0.300 3
+ H2 HGR51 0.220 4
+ C3 CG2R51 -0.430 5
+ H3 HGR51 0.260 6
+ C4 CG2RC0 0.240 7
+ C5 CG2R61 -0.330 8
+ H5 HGR61 0.220 9
+ C6 CG2R61 -0.190 10
+ H6 HGR61 0.200 11
+ C7 CG2R61 -0.220 12
+ H7 HGR61 0.210 13
+ C8 CG2R61 -0.360 14
+ H8 HGR61 0.220 15
+ C9 CG2RC0 0.060 16
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C4 C9
+ C9 C1
+ C1 H11
+ C1 H12
+ C2 H2
+ C3 H3
+ C5 H5
+ C6 H6
+ C7 H7
+ C8 H8
+
+[ INDI ]
+ [ atoms ]
+ N1 NG3C51 -0.680 0
+ H1 HGP1 0.330 1
+ C2 CG3C52 0.000 2
+ H21 HGA2 0.090 3
+ H22 HGA2 0.090 4
+ C3 CG3C52 -0.120 5
+ H31 HGA2 0.090 6
+ H32 HGA2 0.090 7
+ C4 CG2RC0 0.110 8
+ C5 CG2R61 -0.400 9
+ H5 HGR61 0.240 10
+ C6 CG2R61 -0.270 11
+ H6 HGR61 0.220 12
+ C7 CG2R61 -0.200 13
+ H7 HGR61 0.200 14
+ C8 CG2R61 -0.290 15
+ H8 HGR61 0.210 16
+ C9 CG2RC0 0.290 17
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 N1
+ C4 C9
+ N1 H1
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C5 H5
+ C6 H6
+ C7 H7
+ C8 H8
+
+[ INDO ]
+ [ atoms ]
+ HG HGR51 0.140 0
+ CG CG2R51 -0.170 1
+ CD2 CG2RC0 0.110 2
+ CD1 CG2R51 -0.150 3
+ HD1 HGR52 0.220 4
+ NE1 NG2R51 -0.510 5
+ HE1 HGP1 0.370 6
+ CE2 CG2RC0 0.240 7
+ CE3 CG2R61 -0.250 8
+ HE3 HGR61 0.170 9
+ CZ2 CG2R61 -0.270 10
+ HZ2 HGR61 0.160 11
+ CZ3 CG2R61 -0.200 12
+ HZ3 HGR61 0.140 13
+ CH2 CG2R61 -0.140 14
+ HH2 HGR61 0.140 15
+ [ bonds ]
+ CG HG
+ CD2 CG
+ NE1 CD1
+ CZ2 CE2
+ CZ3 CH2
+ CD2 CE3
+ NE1 CE2
+ CD1 HD1
+ NE1 HE1
+ CE3 HE3
+ CZ3 HZ3
+ CH2 HH2
+ CZ2 HZ2
+ CD1 CG
+ CE2 CD2
+ CH2 CZ2
+ CZ3 CE3
+
+[ INDZ ]
+ [ atoms ]
+ C1 CG2R51 -0.280 0
+ H1 HGR51 0.230 1
+ C2 CG2R51 -0.230 2
+ H2 HGR51 0.190 3
+ C3 CG2R51 0.070 4
+ H3 HGR52 0.140 5
+ N4 NG2RC0 -0.280 6
+ C5 CG2R61 -0.100 7
+ H5 HGR62 0.240 8
+ C6 CG2R61 -0.140 9
+ H6 HGR61 0.170 10
+ C7 CG2R61 -0.150 11
+ H7 HGR61 0.180 12
+ C8 CG2R61 -0.220 13
+ H8 HGR61 0.240 14
+ C9 CG2RC0 -0.060 15
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 N4
+ N4 C9
+ C9 C1
+ N4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C1 H1
+ C2 H2
+ C3 H3
+ C5 H5
+ C6 H6
+ C7 H7
+ C8 H8
+
+[ INI1 ]
+ [ atoms ]
+ C1 CC3161 0.140 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C2 CC3161 0.140 4
+ H2 HCA1 0.090 5
+ O2 OC311 -0.650 6
+ HO2 HCP1 0.420 7
+ C3 CC3161 0.140 8
+ H3 HCA1 0.090 9
+ O3 OC311 -0.650 10
+ HO3 HCP1 0.420 11
+ C4 CC3161 0.140 12
+ H4 HCA1 0.090 13
+ O4 OC311 -0.650 14
+ HO4 HCP1 0.420 15
+ C5 CC3161 0.140 16
+ H5 HCA1 0.090 17
+ O5 OC311 -0.650 18
+ HO5 HCP1 0.420 19
+ C6 CC3161 0.140 20
+ H6 HCA1 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 C6
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ INI2 ]
+ [ atoms ]
+ C1 CC3161 0.140 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3161 0.140 4
+ H5 HCA1 0.090 5
+ O5 OC311 -0.650 6
+ HO5 HCP1 0.420 7
+ C2 CC3161 0.140 8
+ H2 HCA1 0.090 9
+ O2 OC311 -0.650 10
+ HO2 HCP1 0.420 11
+ C3 CC3161 0.140 12
+ H3 HCA1 0.090 13
+ O3 OC311 -0.650 14
+ HO3 HCP1 0.420 15
+ C4 CC3161 0.140 16
+ H4 HCA1 0.090 17
+ O4 OC311 -0.650 18
+ HO4 HCP1 0.420 19
+ C6 CC3161 0.140 20
+ H6 HCA1 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 C6
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ INI3 ]
+ [ atoms ]
+ C1 CC3161 0.140 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3161 0.140 4
+ H5 HCA1 0.090 5
+ O5 OC311 -0.650 6
+ HO5 HCP1 0.420 7
+ C2 CC3161 0.140 8
+ H2 HCA1 0.090 9
+ O2 OC311 -0.650 10
+ HO2 HCP1 0.420 11
+ C3 CC3161 0.140 12
+ H3 HCA1 0.090 13
+ O3 OC311 -0.650 14
+ HO3 HCP1 0.420 15
+ C4 CC3161 0.140 16
+ H4 HCA1 0.090 17
+ O4 OC311 -0.650 18
+ HO4 HCP1 0.420 19
+ C6 CC3161 0.140 20
+ H6 HCA1 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 C6
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ INI4 ]
+ [ atoms ]
+ C1 CC3161 0.140 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3161 0.140 4
+ H5 HCA1 0.090 5
+ O5 OC311 -0.650 6
+ HO5 HCP1 0.420 7
+ C2 CC3161 0.140 8
+ H2 HCA1 0.090 9
+ O2 OC311 -0.650 10
+ HO2 HCP1 0.420 11
+ C3 CC3161 0.140 12
+ H3 HCA1 0.090 13
+ O3 OC311 -0.650 14
+ HO3 HCP1 0.420 15
+ C4 CC3161 0.140 16
+ H4 HCA1 0.090 17
+ O4 OC311 -0.650 18
+ HO4 HCP1 0.420 19
+ C6 CC3161 0.140 20
+ H6 HCA1 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 C6
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ INI5 ]
+ [ atoms ]
+ C1 CC3161 0.140 0
+ H1 HCA1 0.090 1
+ O1 OC311 -0.650 2
+ HO1 HCP1 0.420 3
+ C5 CC3161 0.140 4
+ H5 HCA1 0.090 5
+ O5 OC311 -0.650 6
+ HO5 HCP1 0.420 7
+ C2 CC3161 0.140 8
+ H2 HCA1 0.090 9
+ O2 OC311 -0.650 10
+ HO2 HCP1 0.420 11
+ C3 CC3161 0.140 12
+ H3 HCA1 0.090 13
+ O3 OC311 -0.650 14
+ HO3 HCP1 0.420 15
+ C4 CC3161 0.140 16
+ H4 HCA1 0.090 17
+ O4 OC311 -0.650 18
+ HO4 HCP1 0.420 19
+ C6 CC3161 0.140 20
+ H6 HCA1 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H1
+ O1 HO1
+ C1 C6
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ IODB ]
+ [ atoms ]
+ C1 CG2R61 -0.060 0
+ H1 HGR62 0.140 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 -0.060 8
+ H5 HGR62 0.140 9
+ C6 CG2R61 -0.080 10
+ I6 IGR1 -0.080 11
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 C1
+ C6 I6
+
+[ IPAA ]
+ [ atoms ]
+ CL CG331 -0.270 0
+ HL1 HGA3 0.090 1
+ HL2 HGA3 0.090 2
+ HL3 HGA3 0.090 3
+ C CG2O1 0.510 4
+ O OG2D1 -0.510 5
+ N NG2S1 -0.470 6
+ H HGP1 0.310 7
+ CR CG311 0.070 8
+ HR HGA1 0.090 9
+ C21 CG331 -0.270 10
+ H211 HGA3 0.090 11
+ H212 HGA3 0.090 12
+ H213 HGA3 0.090 13
+ C22 CG331 -0.270 14
+ H221 HGA3 0.090 15
+ H222 HGA3 0.090 16
+ H223 HGA3 0.090 17
+ [ bonds ]
+ HL1 CL
+ HL2 CL
+ HL3 CL
+ CL C
+ C N
+ N CR
+ N H
+ HR CR
+ C21 CR
+ C22 CR
+ C21 H211
+ C21 H212
+ C21 H213
+ C22 H221
+ C22 H222
+ C22 H223
+ C O
+ [ impropers ]
+ C CL N O
+
+[ IPPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C13 CTL5 -0.350 1
+ H13A HL 0.250 2
+ H13B HL 0.250 3
+ H13C HL 0.250 4
+ C14 CTL5 -0.350 5
+ H14A HL 0.250 6
+ H14B HL 0.250 7
+ H14C HL 0.250 8
+ C15 CTL5 -0.350 9
+ H15A HL 0.250 10
+ H15B HL 0.250 11
+ H15C HL 0.250 12
+ C12 CTL2 -0.100 13
+ H12A HL 0.250 14
+ H12B HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O11 OSLP -0.570 22
+ O12 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CTL2 -0.180 50
+ H5R HAL2 0.090 51
+ H5S HAL2 0.090 52
+ C26 CTL2 -0.180 53
+ H6R HAL2 0.090 54
+ H6S HAL2 0.090 55
+ C27 CTL2 -0.180 56
+ H7R HAL2 0.090 57
+ H7S HAL2 0.090 58
+ C28 CTL2 -0.180 59
+ H8R HAL2 0.090 60
+ H8S HAL2 0.090 61
+ C29 CTL2 -0.180 62
+ H9R HAL2 0.090 63
+ H9S HAL2 0.090 64
+ C210 CTL2 -0.180 65
+ H10R HAL2 0.090 66
+ H10S HAL2 0.090 67
+ C211 CTL2 -0.180 68
+ H11R HAL2 0.090 69
+ H11S HAL2 0.090 70
+ C212 CTL2 -0.180 71
+ H12R HAL2 0.090 72
+ H12S HAL2 0.090 73
+ C213 CTL2 -0.180 74
+ H13R HAL2 0.090 75
+ H13S HAL2 0.090 76
+ C214 CTL1 -0.090 77
+ H14R HAL1 0.090 78
+ C216 CTL3 -0.270 79
+ H16R HAL3 0.090 80
+ H16S HAL3 0.090 81
+ H16T HAL3 0.090 82
+ C215 CTL3 -0.270 83
+ H15R HAL3 0.090 84
+ H15S HAL3 0.090 85
+ H15T HAL3 0.090 86
+ C33 CTL2 -0.180 87
+ H3X HAL2 0.090 88
+ H3Y HAL2 0.090 89
+ C34 CTL2 -0.180 90
+ H4X HAL2 0.090 91
+ H4Y HAL2 0.090 92
+ C35 CTL2 -0.180 93
+ H5X HAL2 0.090 94
+ H5Y HAL2 0.090 95
+ C36 CTL2 -0.180 96
+ H6X HAL2 0.090 97
+ H6Y HAL2 0.090 98
+ C37 CTL2 -0.180 99
+ H7X HAL2 0.090 100
+ H7Y HAL2 0.090 101
+ C38 CTL2 -0.180 102
+ H8X HAL2 0.090 103
+ H8Y HAL2 0.090 104
+ C39 CTL2 -0.180 105
+ H9X HAL2 0.090 106
+ H9Y HAL2 0.090 107
+ C310 CTL2 -0.180 108
+ H10X HAL2 0.090 109
+ H10Y HAL2 0.090 110
+ C311 CTL2 -0.180 111
+ H11X HAL2 0.090 112
+ H11Y HAL2 0.090 113
+ C312 CTL2 -0.180 114
+ H12X HAL2 0.090 115
+ H12Y HAL2 0.090 116
+ C313 CTL2 -0.180 117
+ H13X HAL2 0.090 118
+ H13Y HAL2 0.090 119
+ C314 CTL2 -0.180 120
+ H14X HAL2 0.090 121
+ H14Y HAL2 0.090 122
+ C315 CTL2 -0.180 123
+ H15X HAL2 0.090 124
+ H15Y HAL2 0.090 125
+ C316 CTL3 -0.270 126
+ H16X HAL3 0.090 127
+ H16Y HAL3 0.090 128
+ H16Z HAL3 0.090 129
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 C216
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 H15T
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ IP_2 ]
+ [ atoms ]
+ P1 PG2 1.100 0
+ O1 OG303 -0.400 1
+ O2 OG2P1 -0.900 2
+ O3 OG2P1 -0.900 3
+ O4 OG2P1 -0.900 4
+ C1 CG311 -0.090 5
+ H11 HGA1 0.090 6
+ C2 CG331 -0.270 7
+ H21 HGA3 0.090 8
+ H22 HGA3 0.090 9
+ H23 HGA3 0.090 10
+ C3 CG331 -0.270 11
+ H31 HGA3 0.090 12
+ H32 HGA3 0.090 13
+ H33 HGA3 0.090 14
+ [ bonds ]
+ P1 O1
+ P1 O2
+ P1 O3
+ P1 O4
+ O1 C1
+ C1 H11
+ C1 C2
+ C1 C3
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ IQIN ]
+ [ atoms ]
+ C1 CG2R61 0.170 0
+ H1 HGR62 0.150 1
+ N2 NG2R60 -0.610 2
+ C3 CG2R61 0.120 3
+ H3 HGR62 0.140 4
+ C4 CG2R61 -0.115 5
+ H4 HGR61 0.115 6
+ C5 CG2R61 0.050 7
+ C6 CG2R61 -0.115 8
+ H6 HGR61 0.115 9
+ C7 CG2R61 -0.115 10
+ H7 HGR61 0.115 11
+ C8 CG2R61 -0.115 12
+ H8 HGR61 0.115 13
+ C9 CG2R61 -0.115 14
+ H9 HGR61 0.115 15
+ C10 CG2R61 -0.020 16
+ [ bonds ]
+ C1 N2
+ N2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C5 C10
+ C1 C10
+ C1 H1
+ C3 H3
+ C4 H4
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+
+[ ISOI ]
+ [ atoms ]
+ HG HGR52 0.150 0
+ CG CG2R51 -0.160 1
+ CD2 CG2RC0 0.170 2
+ ND1 NG2R51 -0.290 3
+ HD1 HGP1 0.350 4
+ CE1 CG2R51 -0.160 5
+ HE1 HGR52 0.150 6
+ CE2 CG2RC0 0.170 7
+ CE3 CG2R61 -0.360 8
+ HE3 HGR61 0.230 9
+ CZ2 CG2R61 -0.360 10
+ HZ2 HGR61 0.230 11
+ CZ3 CG2R61 -0.300 12
+ HZ3 HGR61 0.240 13
+ CH2 CG2R61 -0.300 14
+ HH2 HGR61 0.240 15
+ [ bonds ]
+ CD2 CE2
+ CE1 ND1
+ ND1 CG
+ CD2 CE3
+ CZ3 CH2
+ CZ2 CE2
+ CE1 HE1
+ ND1 HD1
+ CG HG
+ CE3 HE3
+ CZ3 HZ3
+ CH2 HH2
+ CZ2 HZ2
+ CE2 CE1
+ CG CD2
+ CE3 CZ3
+ CH2 CZ2
+
+[ ISOT ]
+ [ atoms ]
+ C1 CG2R51 -0.040 0
+ H1 HGR52 0.160 1
+ C2 CG2R51 -0.200 2
+ H2 HGR51 0.130 3
+ C3 CG2R52 0.230 4
+ H3 HGR52 0.110 5
+ N4 NG2R50 -0.530 6
+ S5 SG2R50 0.140 7
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 N4
+ C3 H3
+ N4 S5
+ S5 C1
+
+[ ISOX ]
+ [ atoms ]
+ C1 CG2R51 0.280 0
+ H1 HGR52 0.130 1
+ C2 CG2R51 -0.430 2
+ H2 HGR51 0.180 3
+ C3 CG2R52 0.350 4
+ H3 HGR52 0.110 5
+ N4 NG2R50 -0.450 6
+ O5 OG2R50 -0.170 7
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 N4
+ C3 H3
+ N4 O5
+ O5 C1
+
+[ LALTOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ LARAOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC322 0.050 17
+ H51 HCA2 0.090 18
+ H52 HCA2 0.090 19
+ O5 OC311 -0.650 20
+ HO5 HCP1 0.420 21
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H51
+ C5 O5
+ O5 HO5
+ C5 H52
+
+[ LCA ]
+ [ atoms ]
+ C3 CG311 0.140 0
+ O3 OG311 -0.650 1
+ H3' HGP1 0.420 2
+ H3 HGA1 0.090 3
+ C4 CG321 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CG311 -0.090 7
+ H5 HGA1 0.090 8
+ C6 CG321 -0.180 9
+ H6A HGA2 0.090 10
+ H6B HGA2 0.090 11
+ C7 CG321 -0.180 12
+ H7A HGA2 0.090 13
+ H7B HGA2 0.090 14
+ C8 CG311 -0.090 15
+ H8 HGA1 0.090 16
+ C14 CG3RC1 -0.090 17
+ H14 HGA1 0.090 18
+ C15 CG3C52 -0.180 19
+ H15A HGA2 0.090 20
+ H15B HGA2 0.090 21
+ C16 CG3C52 -0.180 22
+ H16A HGA2 0.090 23
+ H16B HGA2 0.090 24
+ C17 CG3C51 -0.090 25
+ H17 HGA1 0.090 26
+ C13 CG3RC1 0.000 27
+ C18 CG331 -0.270 28
+ H18A HGA3 0.090 29
+ H18B HGA3 0.090 30
+ H18C HGA3 0.090 31
+ C12 CG321 -0.180 32
+ H12A HGA2 0.090 33
+ H12B HGA2 0.090 34
+ C11 CG321 -0.180 35
+ H11A HGA2 0.090 36
+ H11B HGA2 0.090 37
+ C9 CG311 -0.090 38
+ H9 HGA1 0.090 39
+ C10 CG301 0.000 40
+ C19 CG331 -0.270 41
+ H19A HGA3 0.090 42
+ H19B HGA3 0.090 43
+ H19C HGA3 0.090 44
+ C1 CG321 -0.180 45
+ H1A HGA2 0.090 46
+ H1B HGA2 0.090 47
+ C2 CG321 -0.180 48
+ H2A HGA2 0.090 49
+ H2B HGA2 0.090 50
+ C20 CG311 -0.090 51
+ H20 HGA1 0.090 52
+ C21 CG331 -0.270 53
+ H21A HGA3 0.090 54
+ H21B HGA3 0.090 55
+ H21C HGA3 0.090 56
+ C22 CG321 -0.180 57
+ H22A HGA2 0.090 58
+ H22B HGA2 0.090 59
+ C23 CG321 -0.180 60
+ H23A HGA2 0.090 61
+ H23B HGA2 0.090 62
+ CD CG2O3 0.520 63
+ OE1 OG2D2 -0.760 64
+ OE2 OG2D2 -0.760 65
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 H3'
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5
+ C5 C10
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C10 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C7
+ C7 H7A
+ C7 H7B
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C13 C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 CD
+ CD OE1
+ CD OE2
+ [ impropers ]
+ CD OE2 OE1 C23
+
+[ LEU ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CT1 -0.090 7
+ HG HA1 0.090 8
+ CD1 CT3 -0.270 9
+ HD11 HA3 0.090 10
+ HD12 HA3 0.090 11
+ HD13 HA3 0.090 12
+ CD2 CT3 -0.270 13
+ HD21 HA3 0.090 14
+ HD22 HA3 0.090 15
+ HD23 HA3 0.090 16
+ C C 0.510 17
+ O O -0.510 18
+ [ bonds ]
+ CB CA
+ CG CB
+ CD1 CG
+ CD2 CG
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CG HG
+ CD1 HD11
+ CD1 HD12
+ CD1 HD13
+ CD2 HD21
+ CD2 HD22
+ CD2 HD23
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ LGLUOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ LGULOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ LIDIOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ LIT ]
+ [ atoms ]
+ LIT LIT 1.000 0
+
+[ LMANOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ LPPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C13 CTL5 -0.350 1
+ H13A HL 0.250 2
+ H13B HL 0.250 3
+ H13C HL 0.250 4
+ C14 CTL5 -0.350 5
+ H14A HL 0.250 6
+ H14B HL 0.250 7
+ H14C HL 0.250 8
+ C15 CTL5 -0.350 9
+ H15A HL 0.250 10
+ H15B HL 0.250 11
+ H15C HL 0.250 12
+ C12 CTL2 -0.100 13
+ H12A HL 0.250 14
+ H12B HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O11 OSLP -0.570 22
+ O12 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL2 -0.180 27
+ HS HAL2 0.090 28
+ HR HAL2 0.090 29
+ C3 CTL2 0.080 30
+ HX HAL2 0.090 31
+ HY HAL2 0.090 32
+ O31 OSL -0.490 33
+ C31 CL 0.900 34
+ O32 OBL -0.630 35
+ C32 CTL2 -0.220 36
+ H2X HAL2 0.090 37
+ H2Y HAL2 0.090 38
+ C33 CTL2 -0.180 39
+ H3X HAL2 0.090 40
+ H3Y HAL2 0.090 41
+ C34 CTL2 -0.180 42
+ H4X HAL2 0.090 43
+ H4Y HAL2 0.090 44
+ C35 CTL2 -0.180 45
+ H5X HAL2 0.090 46
+ H5Y HAL2 0.090 47
+ C36 CTL2 -0.180 48
+ H6X HAL2 0.090 49
+ H6Y HAL2 0.090 50
+ C37 CTL2 -0.180 51
+ H7X HAL2 0.090 52
+ H7Y HAL2 0.090 53
+ C38 CTL2 -0.180 54
+ H8X HAL2 0.090 55
+ H8Y HAL2 0.090 56
+ C39 CTL2 -0.180 57
+ H9X HAL2 0.090 58
+ H9Y HAL2 0.090 59
+ C310 CTL2 -0.180 60
+ H10X HAL2 0.090 61
+ H10Y HAL2 0.090 62
+ C311 CTL2 -0.180 63
+ H11X HAL2 0.090 64
+ H11Y HAL2 0.090 65
+ C312 CTL3 -0.270 66
+ H12X HAL3 0.090 67
+ H12Y HAL3 0.090 68
+ H12Z HAL3 0.090 69
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 HR
+ C2 C3
+ C3 HX
+ C3 HY
+ C3 O31
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 H12Z
+ C31 O32
+ [ impropers ]
+ C31 O31 C32 O32
+
+[ LTHROL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC322 0.050 13
+ H41 HCA2 0.090 14
+ H42 HCA2 0.090 15
+ O4 OC311 -0.650 16
+ HO4 HCP1 0.420 17
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H41
+ C4 O4
+ O4 HO4
+ C4 H42
+
+
+
+[ LSN ] ; neutral lysine
+ [ atoms ]
+ N NH1 -0.47 0
+ HN H 0.31 1
+ CA CT1 0.07 2
+ HA HB1 0.09 3
+ CB CT2 -0.18 4
+ HB1 HA2 0.09 5
+ HB2 HA2 0.09 6
+ CG CT2 -0.18 7
+ HG1 HA2 0.09 8
+ HG2 HA2 0.09 9
+ CD CT2 -0.18 10
+ HD1 HA2 0.09 11
+ HD2 HA2 0.09 12
+ CE CT2 0.13 13
+ HE1 HA2 0.075 14
+ HE2 HA2 0.075 15
+ NZ NH2 -0.96 16
+ HZ1 HC 0.34 17
+ HZ2 HC 0.34 18
+ C C 0.51 19
+ O O -0.51 20
+ [ bonds ]
+ CB CA
+ CG CB
+ CD CG
+ CE CD
+ NZ CE
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CG HG1
+ CG HG2
+ CD HD1
+ CD HD2
+ CE HE1
+ CE HE2
+ O C
+ NZ HZ1
+ NZ HZ2
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+[ cmap ]
+ -C N CA C +N
+
+[ LYS ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CT2 -0.180 7
+ HG1 HA2 0.090 8
+ HG2 HA2 0.090 9
+ CD CT2 -0.180 10
+ HD1 HA2 0.090 11
+ HD2 HA2 0.090 12
+ CE CT2 0.000 13
+ HE1 HA2 0.000 14
+ HE2 HA2 0.000 15
+ NZ NH3 -0.900 16
+ HZ1 HC 0.300 17
+ HZ2 HC 0.300 18
+ HZ3 HC 0.300 19
+ C C 0.510 20
+ O O -0.510 21
+ [ bonds ]
+ CB CA
+ CG CB
+ CD CG
+ CE CD
+ NZ CE
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CG HG1
+ CG HG2
+ CD HD1
+ CD HD2
+ CE HE1
+ CE HE2
+ NZ HZ1
+ NZ HZ2
+ NZ HZ3
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ MALLOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ MAM1 ]
+ [ atoms ]
+ N1 NG321 -0.990 0
+ C1 CG3AM2 -0.060 1
+ HN1 HGPAM2 0.390 2
+ HN2 HGPAM2 0.390 3
+ HC1 HGAAM2 0.090 4
+ HC2 HGAAM2 0.090 5
+ HC3 HGAAM2 0.090 6
+ [ bonds ]
+ N1 C1
+ N1 HN1
+ N1 HN2
+ C1 HC1
+ C1 HC2
+ C1 HC3
+
+[ MAMM ]
+ [ atoms ]
+ CE CG334 0.160 0
+ NZ NG3P3 -0.300 1
+ HE1 HGA3 0.050 2
+ HE2 HGA3 0.050 3
+ HE3 HGA3 0.050 4
+ HZ1 HGP2 0.330 5
+ HZ2 HGP2 0.330 6
+ HZ3 HGP2 0.330 7
+ [ bonds ]
+ CE HE1
+ CE HE2
+ CE HE3
+ CE NZ
+ NZ HZ1
+ NZ HZ2
+ NZ HZ3
+
+[ MAS ]
+ [ atoms ]
+ C1 CG331 -0.310 0
+ C CG2O2 0.900 1
+ OM OG302 -0.490 2
+ C2 CG331 -0.010 3
+ O OG2D1 -0.630 4
+ H11 HGA3 0.090 5
+ H12 HGA3 0.090 6
+ H13 HGA3 0.090 7
+ H21 HGA3 0.090 8
+ H22 HGA3 0.090 9
+ H23 HGA3 0.090 10
+ [ bonds ]
+ C1 C
+ C OM
+ OM C2
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+ C O
+ [ impropers ]
+ C C1 O OM
+
+[ MBET ]
+ [ atoms ]
+ C1 CC33A -0.100 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ O2 OC30A -0.340 4
+ C3 CC32A -0.010 5
+ H31 HCA2A 0.090 6
+ H32 HCA2A 0.090 7
+ C4 CC32A -0.180 8
+ H41 HCA2A 0.090 9
+ H42 HCA2A 0.090 10
+ C5 CC32A -0.180 11
+ H51 HCA2A 0.090 12
+ H52 HCA2A 0.090 13
+ C6 CC33A -0.270 14
+ H61 HCA3A 0.090 15
+ H62 HCA3A 0.090 16
+ H63 HCA3A 0.090 17
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 O2
+ O2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ MBOA ]
+ [ atoms ]
+ C2 CG2R61 -0.115 0
+ H2 HGR61 0.115 1
+ C3 CG2R61 -0.115 2
+ H3 HGR61 0.115 3
+ C4 CG2R61 -0.115 4
+ H4 HGR61 0.115 5
+ C5 CG2R61 -0.115 6
+ H5 HGR61 0.115 7
+ C6 CG2R61 -0.115 8
+ H6 HGR61 0.115 9
+ C1 CG2R61 0.080 10
+ C7 CG2O2 0.460 11
+ O7 OG2D1 -0.460 12
+ O8 OG302 -0.310 13
+ C8 CG331 -0.040 14
+ H81 HGA3 0.090 15
+ H82 HGA3 0.090 16
+ H83 HGA3 0.090 17
+ [ bonds ]
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 C1
+ C1 C7
+ C7 O7
+ C7 O8
+ O8 C8
+ C8 H81
+ C8 H82
+ C8 H83
+ [ impropers ]
+ C7 C1 O7 O8
+
+[ MBSM ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CE1 CG2R61 -0.115 4
+ HE1 HGR61 0.115 5
+ CD2 CG2R61 -0.115 6
+ HD2 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ CG2R61 0.240 10
+ S1 SG3O2 0.580 11
+ O11 OG2P1 -0.420 12
+ O12 OG2P1 -0.420 13
+ N2 NG311 -0.570 14
+ H21 HGP1 0.350 15
+ C3 CG331 -0.030 16
+ H31 HGA3 0.090 17
+ H32 HGA3 0.090 18
+ H33 HGA3 0.090 19
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ S1
+ S1 N2
+ S1 O11
+ S1 O12
+ N2 H21
+ N2 C3
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ MBUE ]
+ [ atoms ]
+ C1 CG331 -0.100 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ O2 OG301 -0.340 4
+ C3 CG321 -0.010 5
+ H31 HGA2 0.090 6
+ H32 HGA2 0.090 7
+ C4 CG321 -0.180 8
+ H41 HGA2 0.090 9
+ H42 HGA2 0.090 10
+ C5 CG321 -0.180 11
+ H51 HGA2 0.090 12
+ H52 HGA2 0.090 13
+ C6 CG331 -0.270 14
+ H61 HGA3 0.090 15
+ H62 HGA3 0.090 16
+ H63 HGA3 0.090 17
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 O2
+ O2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ MBUT ]
+ [ atoms ]
+ C4 CG331 -0.270 0
+ H41 HGA3 0.090 1
+ H42 HGA3 0.090 2
+ H43 HGA3 0.090 3
+ C3 CG321 -0.180 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ C2 CG321 -0.220 7
+ H21 HGA2 0.090 8
+ H22 HGA2 0.090 9
+ C1 CG2O2 0.900 10
+ O1 OG2D1 -0.630 11
+ OM OG302 -0.490 12
+ CM CG331 -0.010 13
+ HM1 HGA3 0.090 14
+ HM2 HGA3 0.090 15
+ HM3 HGA3 0.090 16
+ [ bonds ]
+ C1 OM
+ OM CM
+ CM HM1
+ CM HM2
+ CM HM3
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 H43
+ C1 O1
+ [ impropers ]
+ C1 C2 O1 OM
+
+[ MCPE ]
+ [ atoms ]
+ C1 CG3C52 -0.180 0
+ H11 HGA2 0.090 1
+ H12 HGA2 0.090 2
+ C2 CG3C52 -0.180 3
+ H21 HGA2 0.090 4
+ H22 HGA2 0.090 5
+ C3 CG3C52 -0.180 6
+ H31 HGA2 0.090 7
+ H32 HGA2 0.090 8
+ C4 CG3C52 -0.180 9
+ H41 HGA2 0.090 10
+ H42 HGA2 0.090 11
+ C5 CG3C51 -0.090 12
+ H51 HGA1 0.090 13
+ C6 CG331 -0.270 14
+ H61 HGA3 0.090 15
+ H62 HGA3 0.090 16
+ H63 HGA3 0.090 17
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C1
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ MECH ]
+ [ atoms ]
+ C1 CG301 0.000 0
+ C2 CG321 -0.180 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG321 -0.180 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ C4 CG321 -0.180 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG2DC2 0.000 10
+ C6 CG2DC2 0.000 11
+ C7 CG2DC1 -0.150 12
+ H71 HGA4 0.150 13
+ C8 CG2DC3 -0.420 14
+ H81 HGA5 0.210 15
+ H82 HGA5 0.210 16
+ C16 CG331 -0.270 17
+ H161 HGA3 0.090 18
+ H162 HGA3 0.090 19
+ H163 HGA3 0.090 20
+ C17 CG331 -0.270 21
+ H171 HGA3 0.090 22
+ H172 HGA3 0.090 23
+ H173 HGA3 0.090 24
+ C18 CG331 -0.270 25
+ H181 HGA3 0.090 26
+ H182 HGA3 0.090 27
+ H183 HGA3 0.090 28
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C1
+ C6 C7
+ C7 C8
+ C1 C16
+ C1 C17
+ C5 C18
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C16 H161
+ C16 H162
+ C16 H163
+ C17 H171
+ C17 H172
+ C17 H173
+ C7 H71
+ C8 H81
+ C8 H82
+ C18 H181
+ C18 H182
+ C18 H183
+
+[ MEET ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ C2 CC32A -0.010 4
+ H21 HCA2A 0.090 5
+ H22 HCA2A 0.090 6
+ O3 OC30A -0.340 7
+ C4 CC33A -0.100 8
+ H41 HCA3A 0.090 9
+ H42 HCA3A 0.090 10
+ H43 HCA3A 0.090 11
+ [ bonds ]
+ C1 C2
+ C2 O3
+ O3 C4
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ MEOB ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ CG2R61 0.220 10
+ OZ OG301 -0.390 11
+ CM CG331 -0.100 12
+ HM1 HGA3 0.090 13
+ HM2 HGA3 0.090 14
+ HM3 HGA3 0.090 15
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ OZ
+ OZ CM
+ CM HM1
+ CM HM2
+ CM HM3
+
+[ MEOH ]
+ [ atoms ]
+ CB CG331 -0.040 0
+ OG OG311 -0.650 1
+ HG1 HGP1 0.420 2
+ HB1 HGA3 0.090 3
+ HB2 HGA3 0.090 4
+ HB3 HGA3 0.090 5
+ [ bonds ]
+ CB OG
+ OG HG1
+ CB HB1
+ CB HB2
+ CB HB3
+
+[ MEOI ]
+ [ atoms ]
+ C5 CG2DC3 -0.520 0
+ H51 HGA5 0.290 1
+ H52 HGA5 0.240 2
+ C6 CG25C2 -0.100 3
+ C7 CG2R53 0.670 4
+ O7 OG2D1 -0.570 5
+ N8 NG2R51 -0.450 6
+ H8 HGP1 0.320 7
+ C9 CG2RC0 0.250 8
+ C10 CG2R61 -0.340 9
+ H10 HGR61 0.240 10
+ C11 CG2R61 -0.200 11
+ H11 HGR61 0.220 12
+ C12 CG2R61 -0.230 13
+ H12 HGR61 0.210 14
+ C13 CG2R61 -0.320 15
+ H13 HGR61 0.280 16
+ C14 CG2RC0 0.010 17
+ [ bonds ]
+ C6 C7
+ C7 N8
+ N8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 C13
+ C13 C14
+ C14 C6
+ C9 C14
+ C7 O7
+ N8 H8
+ C10 H10
+ C11 H11
+ C12 H12
+ C13 H13
+ C6 C5
+ C5 H51
+ C5 H52
+ [ impropers ]
+ C7 C6 N8 O7
+
+[ MERYOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC322 0.050 13
+ H41 HCA2 0.090 14
+ H42 HCA2 0.090 15
+ O4 OC311 -0.650 16
+ HO4 HCP1 0.420 17
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H41
+ C4 O4
+ O4 HO4
+ C4 H42
+
+[ MES1 ]
+ [ atoms ]
+ S SG302 -0.800 0
+ C1 CG323 -0.470 1
+ H11 HGA3 0.090 2
+ H12 HGA3 0.090 3
+ H13 HGA3 0.090 4
+ [ bonds ]
+ S C1
+ C1 H11
+ C1 H12
+ C1 H13
+
+[ MESH ]
+ [ atoms ]
+ H1 HGA3 0.090 0
+ H2 HGA3 0.090 1
+ H3 HGA3 0.090 2
+ CM CG331 -0.200 3
+ S SG311 -0.230 4
+ H4 HGP3 0.160 5
+ [ bonds ]
+ CM H1
+ CM H2
+ CM H3
+ CM S
+ S H4
+
+[ MESI ]
+ [ atoms ]
+ C1 CG331 -0.020 0
+ N2 NG311 -0.630 1
+ H2 HGP1 0.370 2
+ H11 HGA3 0.090 3
+ H13 HGA3 0.090 4
+ H12 HGA3 0.090 5
+ S3 SG3O2 0.800 6
+ N4 NG311 -0.500 7
+ H4 HGP1 0.330 8
+ C5 CG321 0.060 9
+ C6 CG331 -0.270 10
+ H61 HGA3 0.090 11
+ H62 HGA3 0.090 12
+ H63 HGA3 0.090 13
+ H51 HGA2 0.090 14
+ H52 HGA2 0.090 15
+ O31 OG2P1 -0.430 16
+ O32 OG2P1 -0.430 17
+ [ bonds ]
+ C1 N2
+ C1 H11
+ C1 H13
+ C1 H12
+ N2 H2
+ N2 S3
+ S3 N4
+ S3 O31
+ S3 O32
+ N4 H4
+ N4 C5
+ C5 C6
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ MESM ]
+ [ atoms ]
+ S SS -0.800 0
+ C1 CS -0.470 1
+ H11 HA 0.090 2
+ H12 HA 0.090 3
+ H13 HA 0.090 4
+ [ bonds ]
+ S C1
+ C1 H11
+ C1 H12
+ C1 H13
+
+[ MESN ]
+ [ atoms ]
+ S SG3O2 0.140 0
+ O1 OG2P1 -0.360 1
+ O2 OG2P1 -0.360 2
+ C3 CG331 0.020 3
+ H31 HGA3 0.090 4
+ H32 HGA3 0.090 5
+ H33 HGA3 0.090 6
+ C4 CG321 0.110 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG331 -0.270 10
+ H51 HGA3 0.090 11
+ H52 HGA3 0.090 12
+ H53 HGA3 0.090 13
+ [ bonds ]
+ S O1
+ S O2
+ S C3
+ S C4
+ C3 H31
+ C3 H32
+ C3 H33
+ C4 H41
+ C4 H42
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ MESO ]
+ [ atoms ]
+ O OG2P1 -0.550 0
+ S SG3O3 0.310 1
+ C3 CG331 -0.150 2
+ H31 HGA3 0.090 3
+ H32 HGA3 0.090 4
+ H33 HGA3 0.090 5
+ C2 CG321 -0.060 6
+ H21 HGA2 0.090 7
+ H22 HGA2 0.090 8
+ C1 CG331 -0.270 9
+ H11 HGA3 0.090 10
+ H12 HGA3 0.090 11
+ H13 HGA3 0.090 12
+ [ bonds ]
+ S C3
+ S C2
+ C3 H31
+ C3 H32
+ C3 H33
+ C2 H21
+ C2 H22
+ C2 C1
+ C1 H11
+ C1 H12
+ C1 H13
+ O S
+
+[ MET ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CT2 -0.140 7
+ HG1 HA2 0.090 8
+ HG2 HA2 0.090 9
+ SD S -0.090 10
+ CE CT3 -0.220 11
+ HE1 HA3 0.090 12
+ HE2 HA3 0.090 13
+ HE3 HA3 0.090 14
+ C C 0.510 15
+ O O -0.510 16
+ [ bonds ]
+ CB CA
+ CG CB
+ SD CG
+ CE SD
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CG HG1
+ CG HG2
+ CE HE1
+ CE HE2
+ CE HE3
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ METE ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG321 -0.010 4
+ H21 HGA2 0.090 5
+ H22 HGA2 0.090 6
+ O3 OG301 -0.340 7
+ C4 CG331 -0.100 8
+ H41 HGA3 0.090 9
+ H42 HGA3 0.090 10
+ H43 HGA3 0.090 11
+ [ bonds ]
+ C1 C2
+ C2 O3
+ O3 C4
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ METO ]
+ [ atoms ]
+ CB CG331 -0.410 0
+ OG OG312 -0.920 1
+ HB1 HGA3 0.110 2
+ HB2 HGA3 0.110 3
+ HB3 HGA3 0.110 4
+ [ bonds ]
+ CB OG
+ CB HB1
+ CB HB2
+ CB HB3
+
+[ METP ]
+ [ atoms ]
+ C1 CG331 -0.170 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ O1 OG303 -0.620 4
+ P2 PG1 1.500 5
+ O21 OG2P1 -0.820 6
+ O22 OG2P1 -0.820 7
+ O2 OG304 -0.740 8
+ P3 PG1 1.500 9
+ O31 OG2P1 -0.820 10
+ O32 OG2P1 -0.820 11
+ O3 OG304 -0.860 12
+ P4 PG2 1.100 13
+ O41 OG2P1 -0.900 14
+ O42 OG2P1 -0.900 15
+ O43 OG2P1 -0.900 16
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 O1
+ O1 P2
+ P2 O21
+ P2 O22
+ P2 O2
+ O2 P3
+ P3 O31
+ P3 O32
+ P3 O3
+ O3 P4
+ P4 O41
+ P4 O42
+ P4 O43
+
+[ MG ]
+ [ atoms ]
+ MG MG 2.000 0
+
+[ MGALOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC312 0.140 17
+ H5 HCA1 0.090 18
+ O5 OC311 -0.650 19
+ HO5 HCP1 0.420 20
+ C6 CC322 0.050 21
+ H61 HCA2 0.090 22
+ H62 HCA2 0.090 23
+ O6 OC311 -0.650 24
+ HO6 HCP1 0.420 25
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+
+[ MGLYOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC322 0.050 9
+ H31 HCA2 0.090 10
+ H32 HCA2 0.090 11
+ O3 OC311 -0.650 12
+ HO3 HCP1 0.420 13
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H31
+ C3 O3
+ O3 HO3
+ C3 H32
+
+[ MGU1 ]
+ [ atoms ]
+ C CG2N1 0.660 0
+ N1 NG321 -0.600 1
+ H11 HGPAM2 0.290 2
+ H12 HGPAM2 0.290 3
+ N2 NG321 -0.600 4
+ H21 HGPAM2 0.290 5
+ H22 HGPAM2 0.290 6
+ N3 NG2D1 -0.860 7
+ C4 CG331 -0.030 8
+ H41 HGA3 0.090 9
+ H42 HGA3 0.090 10
+ H43 HGA3 0.090 11
+ [ bonds ]
+ C N1
+ C N2
+ C N3
+ N3 C4
+ N1 H11
+ N1 H12
+ N2 H21
+ N2 H22
+ C4 H41
+ C4 H42
+ C4 H43
+ [ impropers ]
+ C N1 N2 N3
+
+[ MGU2 ]
+ [ atoms ]
+ C CG2N1 0.590 0
+ N1 NG2D1 -0.910 1
+ H11 HGP1 0.370 2
+ N2 NG321 -0.600 3
+ H21 HGPAM2 0.330 4
+ H22 HGPAM2 0.330 5
+ N3 NG311 -0.540 6
+ H31 HGPAM1 0.360 7
+ C4 CG331 -0.200 8
+ H41 HGA3 0.090 9
+ H42 HGA3 0.090 10
+ H43 HGA3 0.090 11
+ [ bonds ]
+ C N1
+ C N2
+ C N3
+ N3 C4
+ N1 H11
+ N2 H21
+ N2 H22
+ N3 H31
+ C4 H41
+ C4 H42
+ C4 H43
+ [ impropers ]
+ C N1 N3 N2
+
+[ MGUA ]
+ [ atoms ]
+ C CG2N1 0.640 0
+ N1 NG2P1 -0.800 1
+ H11 HGP2 0.460 2
+ H12 HGP2 0.460 3
+ N2 NG2P1 -0.800 4
+ H21 HGP2 0.460 5
+ H22 HGP2 0.460 6
+ N3 NG2P1 -0.700 7
+ H31 HGP2 0.440 8
+ C2 CG334 0.110 9
+ HC1 HGA3 0.090 10
+ HC2 HGA3 0.090 11
+ HC3 HGA3 0.090 12
+ [ bonds ]
+ C N2
+ C N3
+ N1 H11
+ N1 H12
+ N2 H21
+ N2 H22
+ N3 H31
+ N3 C2
+ C2 HC1
+ C2 HC2
+ C2 HC3
+ C N1
+ [ impropers ]
+ C N2 N1 N3
+
+[ MHYO ]
+ [ atoms ]
+ N1 NG2R53 -0.180 0
+ C2 CG2R53 0.250 1
+ O2 OG2D1 -0.430 2
+ N3 NG2R53 -0.250 3
+ H3 HGP1 0.350 4
+ C4 CG2R53 0.260 5
+ O4 OG2D1 -0.410 6
+ C5 CG252O 0.090 7
+ C6 CG2DC3 -0.460 8
+ H61 HGA5 0.230 9
+ H62 HGA5 0.240 10
+ H1 HGP1 0.310 11
+ [ bonds ]
+ N1 C2
+ C2 N3
+ N3 C4
+ C4 C5
+ C5 N1
+ C2 O2
+ N3 H3
+ C4 O4
+ C5 C6
+ C6 H61
+ C6 H62
+ N1 H1
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ MICY ]
+ [ atoms ]
+ O OG2D5 -0.430 0
+ C CG2O7 0.680 1
+ N NG2D1 -0.520 2
+ C1 CG331 -0.000 3
+ H11 HGA3 0.090 4
+ H12 HGA3 0.090 5
+ H13 HGA3 0.090 6
+ [ bonds ]
+ C1 N
+ C1 H11
+ C1 H12
+ C1 H13
+ O C
+ C N
+
+[ MIMI ]
+ [ atoms ]
+ ND1 NG2R51 -0.360 0
+ HD1 HGP1 0.320 1
+ CG CG2R51 -0.050 2
+ CB CG331 -0.180 3
+ HB1 HGA3 0.090 4
+ HB2 HGA3 0.090 5
+ HB3 HGA3 0.090 6
+ NE2 NG2R50 -0.700 7
+ CD2 CG2R51 0.220 8
+ HD2 HGR52 0.100 9
+ CE1 CG2R53 0.250 10
+ HE1 HGR52 0.130 11
+ [ bonds ]
+ NE2 CD2
+ ND1 CG
+ CE1 ND1
+ CG CB
+ ND1 HD1
+ CD2 HD2
+ CE1 HE1
+ CB HB1
+ CB HB2
+ CB HB3
+ NE2 CE1
+ CD2 CG
+
+[ MIND ]
+ [ atoms ]
+ CB CG331 -0.270 0
+ HB1 HGA3 0.090 1
+ HB2 HGA3 0.090 2
+ HB3 HGA3 0.090 3
+ CG CG2R51 -0.030 4
+ CD2 CG2RC0 0.110 5
+ CD1 CG2R51 -0.150 6
+ HD1 HGR52 0.220 7
+ NE1 NG2R51 -0.510 8
+ HE1 HGP1 0.370 9
+ CE2 CG2RC0 0.240 10
+ CE3 CG2R61 -0.250 11
+ HE3 HGR61 0.170 12
+ CZ2 CG2R61 -0.270 13
+ HZ2 HGR61 0.160 14
+ CZ3 CG2R61 -0.200 15
+ HZ3 HGR61 0.140 16
+ CH2 CG2R61 -0.140 17
+ HH2 HGR61 0.140 18
+ [ bonds ]
+ CB HB1
+ CB HB2
+ CB HB3
+ CG CB
+ CD2 CG
+ NE1 CD1
+ CZ2 CE2
+ CZ3 CH2
+ CD2 CE3
+ NE1 CE2
+ CD1 HD1
+ NE1 HE1
+ CE3 HE3
+ CZ3 HZ3
+ CH2 HH2
+ CZ2 HZ2
+ CD1 CG
+ CE2 CD2
+ CH2 CZ2
+ CZ3 CE3
+
+[ MMSM ]
+ [ atoms ]
+ C3 CG331 -0.050 0
+ H31 HGA3 0.090 1
+ H32 HGA3 0.090 2
+ H33 HGA3 0.090 3
+ S1 SG3O2 0.600 4
+ O11 OG2P1 -0.420 5
+ O12 OG2P1 -0.420 6
+ N2 NG311 -0.570 7
+ H21 HGP1 0.350 8
+ C4 CG331 -0.030 9
+ H41 HGA3 0.090 10
+ H42 HGA3 0.090 11
+ H43 HGA3 0.090 12
+ [ bonds ]
+ C3 S1
+ S1 N2
+ S1 O11
+ S1 O12
+ N2 H21
+ N2 C4
+ C3 H31
+ C3 H32
+ C3 H33
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ MMST ]
+ [ atoms ]
+ S1 SG3O2 0.240 0
+ C2 CG331 0.050 1
+ H21 HGA3 0.090 2
+ H22 HGA3 0.090 3
+ H23 HGA3 0.090 4
+ O3 OG2P1 -0.320 5
+ O4 OG2P1 -0.320 6
+ O5 OG303 -0.240 7
+ C6 CG331 0.050 8
+ H61 HGA3 0.090 9
+ H62 HGA3 0.090 10
+ H63 HGA3 0.090 11
+ [ bonds ]
+ S1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+ S1 O3
+ S1 O4
+ S1 O5
+ O5 C6
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ MOBU ]
+ [ atoms ]
+ C1 CG2D1O -0.140 0
+ H11 HGA4 0.210 1
+ C2 CG2DC1 -0.300 2
+ H21 HGA4 0.230 3
+ O1 OG301 -0.280 4
+ C CG331 0.010 5
+ H1 HGA3 0.090 6
+ H2 HGA3 0.090 7
+ H3 HGA3 0.090 8
+ C3 CG2DC2 -0.150 9
+ H31 HGA4 0.150 10
+ C4 CG2DC3 -0.420 11
+ H41 HGA5 0.210 12
+ H42 HGA5 0.210 13
+ [ bonds ]
+ C1 C2
+ C1 O1
+ O1 C
+ C1 H11
+ C2 H21
+ C H1
+ C H2
+ C H3
+ C2 C3
+ C3 C4
+ C3 H31
+ C4 H41
+ C4 H42
+ [ impropers ]
+ C1 C2 O1 H11
+
+[ MOET ]
+ [ atoms ]
+ C1 CG2D2 -0.530 0
+ H11 HGA5 0.230 1
+ H12 HGA5 0.230 2
+ C2 CG2D1O -0.140 3
+ H21 HGA4 0.210 4
+ O3 OG301 -0.280 5
+ C4 CG331 0.010 6
+ H41 HGA3 0.090 7
+ H42 HGA3 0.090 8
+ H43 HGA3 0.090 9
+ [ bonds ]
+ C1 C2
+ C2 O3
+ O3 C4
+ C1 H11
+ C1 H12
+ C2 H21
+ C4 H41
+ C4 H42
+ C4 H43
+ [ impropers ]
+ C2 C1 O3 H21
+
+[ MORP ]
+ [ atoms ]
+ O1 OG3C61 -0.280 0
+ C2 CG321 -0.040 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG324 0.200 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ N4 NG3P2 -0.460 7
+ H41 HGP2 0.350 8
+ H42 HGP2 0.350 9
+ C5 CG324 0.200 10
+ H51 HGA2 0.090 11
+ H52 HGA2 0.090 12
+ C6 CG321 -0.040 13
+ H61 HGA2 0.090 14
+ H62 HGA2 0.090 15
+ [ bonds ]
+ O1 C2
+ C2 C3
+ C3 N4
+ N4 C5
+ C5 C6
+ C6 O1
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ N4 H41
+ N4 H42
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+
+[ MPET ]
+ [ atoms ]
+ C1 CC33A -0.100 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ O2 OC30A -0.340 4
+ C3 CC32A -0.010 5
+ H31 HCA2A 0.090 6
+ H32 HCA2A 0.090 7
+ C4 CC32A -0.180 8
+ H41 HCA2A 0.090 9
+ H42 HCA2A 0.090 10
+ C5 CC33A -0.270 11
+ H51 HCA3A 0.090 12
+ H52 HCA3A 0.090 13
+ H53 HCA3A 0.090 14
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 O2
+ O2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ MPRE ]
+ [ atoms ]
+ C1 CG331 -0.100 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ O2 OG301 -0.340 4
+ C3 CG321 -0.010 5
+ H31 HGA2 0.090 6
+ H32 HGA2 0.090 7
+ C4 CG321 -0.180 8
+ H41 HGA2 0.090 9
+ H42 HGA2 0.090 10
+ C5 CG331 -0.270 11
+ H51 HGA3 0.090 12
+ H52 HGA3 0.090 13
+ H53 HGA3 0.090 14
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 O2
+ O2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ MPRO ]
+ [ atoms ]
+ C1 CG321 -0.220 0
+ C CG2O2 0.900 1
+ OM OG302 -0.490 2
+ C2 CG331 -0.010 3
+ O OG2D1 -0.630 4
+ H12 HGA2 0.090 5
+ H13 HGA2 0.090 6
+ H21 HGA3 0.090 7
+ H22 HGA3 0.090 8
+ H23 HGA3 0.090 9
+ C11 CG331 -0.270 10
+ H111 HGA3 0.090 11
+ H112 HGA3 0.090 12
+ H113 HGA3 0.090 13
+ [ bonds ]
+ C1 C
+ C OM
+ C O
+ OM C2
+ C1 C11
+ C1 H12
+ C1 H13
+ C11 H111
+ C11 H112
+ C11 H113
+ C2 H21
+ C2 H22
+ C2 H23
+ [ impropers ]
+ C C1 O OM
+
+[ MP_0 ]
+ [ atoms ]
+ C1 CG331 -0.170 0
+ O1 OG303 -0.560 1
+ P1 PG0 1.500 2
+ O2 OG311 -0.620 3
+ O3 OG311 -0.620 4
+ O4 OG2P1 -0.640 5
+ H11 HGA3 0.090 6
+ H12 HGA3 0.090 7
+ H13 HGA3 0.090 8
+ H2 HGP1 0.420 9
+ H3 HGP1 0.420 10
+ [ bonds ]
+ P1 O1
+ P1 O2
+ P1 O3
+ P1 O4
+ O1 C1
+ C1 H11
+ C1 H12
+ C1 H13
+ O2 H2
+ O3 H3
+
+[ MP_1 ]
+ [ atoms ]
+ C1 CG331 -0.170 0
+ O1 OG303 -0.620 1
+ P1 PG1 1.500 2
+ O2 OG311 -0.670 3
+ O3 OG2P1 -0.820 4
+ O4 OG2P1 -0.820 5
+ H11 HGA3 0.090 6
+ H12 HGA3 0.090 7
+ H13 HGA3 0.090 8
+ H2 HGP1 0.330 9
+ [ bonds ]
+ P1 O1
+ P1 O2
+ P1 O3
+ P1 O4
+ O1 C1
+ C1 H11
+ C1 H12
+ C1 H13
+ O2 H2
+
+[ MP_2 ]
+ [ atoms ]
+ P1 PG2 1.100 0
+ O1 OG303 -0.400 1
+ O2 OG2P1 -0.900 2
+ O3 OG2P1 -0.900 3
+ O4 OG2P1 -0.900 4
+ C1 CG331 -0.270 5
+ H11 HGA3 0.090 6
+ H12 HGA3 0.090 7
+ H13 HGA3 0.090 8
+ [ bonds ]
+ P1 O1
+ P1 O2
+ P1 O3
+ P1 O4
+ O1 C1
+ C1 H11
+ C1 H12
+ C1 H13
+
+[ MRDN ]
+ [ atoms ]
+ S1 SG311 -0.140 0
+ C2 CG2R53 0.260 1
+ S2 SG2D1 -0.270 2
+ N3 NG2R53 -0.250 3
+ H3 HGP1 0.320 4
+ C4 CG2R53 0.290 5
+ O4 OG2D1 -0.390 6
+ C5 CG252O 0.100 7
+ C6 CG2DC3 -0.490 8
+ H61 HGA5 0.240 9
+ H62 HGA5 0.330 10
+ [ bonds ]
+ S1 C2
+ C2 N3
+ N3 C4
+ C4 C5
+ C5 S1
+ C2 S2
+ N3 H3
+ C4 O4
+ C5 C6
+ C6 H61
+ C6 H62
+ [ impropers ]
+ C2 N3 S2 S1
+ C4 C5 N3 O4
+
+[ MRIBOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC322 0.050 17
+ H51 HCA2 0.090 18
+ H52 HCA2 0.090 19
+ O5 OC311 -0.650 20
+ HO5 HCP1 0.420 21
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H51
+ C5 O5
+ O5 HO5
+ C5 H52
+
+[ MSAM ]
+ [ atoms ]
+ C3 CG331 -0.070 0
+ H31 HGA3 0.090 1
+ H32 HGA3 0.090 2
+ H33 HGA3 0.090 3
+ S1 SG3O2 0.650 4
+ O11 OG2P1 -0.420 5
+ O12 OG2P1 -0.420 6
+ N2 NG321 -0.770 7
+ H21 HGP1 0.380 8
+ H22 HGP1 0.380 9
+ [ bonds ]
+ C3 S1
+ S1 N2
+ S1 O11
+ S1 O12
+ N2 H21
+ N2 H22
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ MSMT ]
+ [ atoms ]
+ S1 SG3O2 0.220 0
+ N2 NG321 -0.460 1
+ H21 HGP1 0.350 2
+ H22 HGP1 0.350 3
+ O11 OG2P1 -0.280 4
+ O12 OG2P1 -0.280 5
+ O3 OG303 -0.240 6
+ C4 CG331 0.070 7
+ H41 HGA3 0.090 8
+ H42 HGA3 0.090 9
+ H43 HGA3 0.090 10
+ [ bonds ]
+ S1 N2
+ N2 H21
+ N2 H22
+ S1 O11
+ S1 O12
+ S1 O3
+ O3 C4
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ MSNA ]
+ [ atoms ]
+ S SG3O1 0.730 0
+ O1 OG2P1 -0.550 1
+ O2 OG2P1 -0.550 2
+ O3 OG2P1 -0.550 3
+ C1 CG331 -0.350 4
+ H11 HGA3 0.090 5
+ H12 HGA3 0.090 6
+ H13 HGA3 0.090 7
+ [ bonds ]
+ S O1
+ S O2
+ S O3
+ S C1
+ C1 H11
+ C1 H12
+ C1 H13
+
+[ MSO4 ]
+ [ atoms ]
+ S SG3O1 1.330 0
+ OS1 OG303 -0.280 1
+ OS2 OG2P1 -0.650 2
+ OS3 OG2P1 -0.650 3
+ OS4 OG2P1 -0.650 4
+ C1 CG331 -0.370 5
+ H11 HGA3 0.090 6
+ H12 HGA3 0.090 7
+ H13 HGA3 0.090 8
+ [ bonds ]
+ S OS1
+ S OS2
+ S OS3
+ S OS4
+ OS1 C1
+ C1 H11
+ C1 H12
+ C1 H13
+
+[ MTDO ]
+ [ atoms ]
+ S1 SG311 -0.150 0
+ C2 CG2R53 0.420 1
+ O2 OG2D1 -0.460 2
+ N3 NG2R53 -0.360 3
+ H3 HGP1 0.440 4
+ C4 CG2R53 0.260 5
+ O4 OG2D1 -0.450 6
+ C5 CG252O 0.220 7
+ C6 CG2DC3 -0.580 8
+ H61 HGA5 0.330 9
+ H62 HGA5 0.330 10
+ [ bonds ]
+ S1 C2
+ C2 N3
+ N3 C4
+ C4 C5
+ C5 S1
+ C2 O2
+ N3 H3
+ C4 O4
+ C5 C6
+ C6 H61
+ C6 H62
+ [ impropers ]
+ C2 N3 O2 S1
+ C4 C5 N3 O4
+
+[ MXYL ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 0.000 4
+ CE1 CG2R61 -0.115 5
+ HE1 HGR61 0.115 6
+ CE2 CG2R61 -0.115 7
+ HE2 HGR61 0.115 8
+ CZ CG2R61 0.000 9
+ C1 CG331 -0.270 10
+ H11 HGA3 0.090 11
+ H12 HGA3 0.090 12
+ H13 HGA3 0.090 13
+ C2 CG331 -0.270 14
+ H21 HGA3 0.090 15
+ H22 HGA3 0.090 16
+ H23 HGA3 0.090 17
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 C2
+ CE1 HE1
+ CE2 HE2
+ CZ C1
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ MXYLOL ]
+ [ atoms ]
+ C1 CC322 0.050 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC312 0.140 5
+ H2 HCA1 0.090 6
+ O2 OC311 -0.650 7
+ HO2 HCP1 0.420 8
+ C3 CC312 0.140 9
+ H3 HCA1 0.090 10
+ O3 OC311 -0.650 11
+ HO3 HCP1 0.420 12
+ C4 CC312 0.140 13
+ H4 HCA1 0.090 14
+ O4 OC311 -0.650 15
+ HO4 HCP1 0.420 16
+ C5 CC322 0.050 17
+ H51 HCA2 0.090 18
+ H52 HCA2 0.090 19
+ O5 OC311 -0.650 20
+ HO5 HCP1 0.420 21
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 H2
+ C2 O2
+ O2 HO2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H51
+ C5 O5
+ O5 HO5
+ C5 H52
+
+[ NACT ]
+ [ atoms ]
+ S SG3O1 0.730 0
+ O1 OG2P1 -0.550 1
+ O2 OG2P1 -0.550 2
+ O3 OG2P1 -0.550 3
+ C1 CG321 -0.260 4
+ H11 HGA2 0.090 5
+ H12 HGA2 0.090 6
+ C2 CG321 -0.020 7
+ H21 HGA2 0.090 8
+ H22 HGA2 0.090 9
+ N NG2S1 -0.470 10
+ H HGP1 0.310 11
+ C CG2O1 0.510 12
+ O OG2D1 -0.510 13
+ C3 CG331 -0.270 14
+ H31 HGA3 0.090 15
+ H32 HGA3 0.090 16
+ H33 HGA3 0.090 17
+ [ bonds ]
+ S O1
+ S O2
+ S O3
+ S C1
+ C1 H11
+ C1 H12
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 N
+ N C
+ N H
+ C C3
+ C3 H31
+ C3 H32
+ C3 H33
+ C O
+ [ impropers ]
+ C C3 N O
+
+[ NAD ]
+ [ atoms ]
+ AC4' CG3C51 0.110 0
+ AH4' HGA1 0.090 1
+ AO4' OG3C51 -0.400 2
+ AC1' CG3C51 0.110 3
+ AH1' HGA1 0.090 4
+ AC5 CG2RC0 0.280 5
+ AN7 NG2R50 -0.710 6
+ AC8 CG2R53 0.340 7
+ AH8 HGR52 0.120 8
+ AN9 NG2R51 -0.050 9
+ AN1 NG2R62 -0.740 10
+ AC2 CG2R64 0.500 11
+ AH2 HGR62 0.130 12
+ AN3 NG2R62 -0.750 13
+ AC4 CG2RC0 0.430 14
+ AC6 CG2R64 0.460 15
+ AN6 NG2S3 -0.770 16
+ AH61 HGP4 0.380 17
+ AH62 HGP4 0.380 18
+ AC2' CG3C51 0.140 19
+ AH2' HGA1 0.090 20
+ AO2' OG311 -0.650 21
+ AH2T HGP1 0.420 22
+ AC3' CG3C51 0.140 23
+ AH3' HGA1 0.090 24
+ AO3' OG311 -0.650 25
+ AH3T HGP1 0.420 26
+ AC5' CG321 -0.080 27
+ AH5' HGA2 0.090 28
+ AH5S HGA2 0.090 29
+ AP PG1 1.500 30
+ AO1 OG2P1 -0.820 31
+ AO2 OG2P1 -0.820 32
+ AO5' OG303 -0.620 33
+ O3 OG304 -0.680 34
+ NP PG1 1.500 35
+ NO1 OG2P1 -0.820 36
+ NO2 OG2P1 -0.820 37
+ NO5' OG303 -0.620 38
+ NC5' CG321 -0.080 39
+ NH5S HGA2 0.090 40
+ NH5' HGA2 0.090 41
+ NC2' CG3C51 0.140 42
+ NH2' HGA1 0.090 43
+ NO2' OG311 -0.650 44
+ NH2T HGP1 0.420 45
+ NC3' CG3C51 0.140 46
+ NH3' HGA1 0.090 47
+ NO3' OG311 -0.650 48
+ NH3T HGP1 0.420 49
+ NC1' CG3C53 0.110 50
+ NH1' HGA1 0.090 51
+ NC4' CG3C51 0.110 52
+ NH4' HGA1 0.090 53
+ NO4' OG3C51 -0.400 54
+ NN1 NG2R61 -0.070 55
+ NC6 CG2R62 0.160 56
+ NH6 HGR63 0.190 57
+ NC5 CG2R62 -0.100 58
+ NH5 HGR63 0.160 59
+ NC4 CG2R62 -0.050 60
+ NH4 HGR63 0.160 61
+ NC3 CG2R62 0.050 62
+ NC2 CG2R62 0.180 63
+ NH2 HGR63 0.160 64
+ NC7 CG2O1 0.680 65
+ NO7 OG2D1 -0.400 66
+ NN7 NG2S2 -0.820 67
+ NH71 HGP1 0.340 68
+ NH72 HGP1 0.360 69
+ [ bonds ]
+ AN1 AC2
+ AN3 AC4
+ AC5 AC6
+ AC6 AN6
+ AC5 AN7
+ AC8 AN9
+ AN9 AC4
+ AC2 AH2
+ AN6 AH61
+ AN6 AH62
+ AC8 AH8
+ AN9 AC1'
+ AC1' AC2'
+ AC2' AC3'
+ AC3' AC4'
+ AC4' AO4'
+ AO4' AC1'
+ AC1' AH1'
+ AC2' AO2'
+ AO2' AH2T
+ AC2' AH2'
+ AC3' AH3'
+ AC3' AO3'
+ AO3' AH3T
+ AC4' AH4'
+ AC4' AC5'
+ AC5' AH5S
+ AC5' AH5'
+ AC5' AO5'
+ AO5' AP
+ AP AO1
+ AP AO2
+ AP O3
+ O3 NP
+ NP NO1
+ NP NO2
+ NP NO5'
+ NO5' NC5'
+ NC5' NH5S
+ NC5' NH5'
+ NC5' NC4'
+ NC4' NO4'
+ NO4' NC1'
+ NC1' NC2'
+ NC2' NC3'
+ NC3' NC4'
+ NC1' NH1'
+ NC2' NH2'
+ NC2' NO2'
+ NO2' NH2T
+ NC3' NH3'
+ NC3' NO3'
+ NO3' NH3T
+ NC4' NH4'
+ NC1' NN1
+ NN1 NC2
+ NC3 NC4
+ NC5 NC6
+ NC2 NH2
+ NC3 NC7
+ NC7 NO7
+ NC7 NN7
+ NN7 NH71
+ NN7 NH72
+ NC4 NH4
+ NC5 NH5
+ NC6 NH6
+ AC6 AN1
+ AC2 AN3
+ AC4 AC5
+ AN7 AC8
+ NC2 NC3
+ NC4 NC5
+ NC6 NN1
+ [ impropers ]
+ AC6 AC5 AN1 AN6
+ AN6 AH62 AH61 AC6
+ NC7 NC3 NN7 NO7
+
+[ NADE ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C51 0.110 1
+ H12' HGA1 0.090 2
+ C4' CG3C51 0.110 3
+ H42' HGA1 0.090 4
+ C5 CG2RC0 0.300 5
+ N7 NG2R50 -0.690 6
+ C8 CG2R53 0.340 7
+ H8 HGR52 0.100 8
+ N9 NG2R51 -0.060 9
+ N1 NG2R62 -0.740 10
+ C2 CG2R64 0.500 11
+ H2 HGR62 0.130 12
+ N3 NG2R62 -0.750 13
+ C4 CG2RC0 0.430 14
+ C6 CG2R64 0.440 15
+ N6 NG2S3 -0.750 16
+ H61 HGP4 0.380 17
+ H62 HGP4 0.370 18
+ C2' CG3C52 -0.180 19
+ H21' HGA2 0.090 20
+ H22' HGA2 0.090 21
+ C3' CG3C51 0.010 22
+ H31' HGA1 0.090 23
+ O3' OG303 -0.570 24
+ P PG1 1.500 25
+ O1P OG2P1 -0.780 26
+ O2P OG2P1 -0.780 27
+ O3P OG303 -0.570 28
+ C3T CG331 -0.170 29
+ H3T1 HGA3 0.090 30
+ H3T2 HGA3 0.090 31
+ H3T3 HGA3 0.090 32
+ C5' CG321 0.050 33
+ H51' HGA2 0.090 34
+ H52' HGA2 0.090 35
+ H5T HGP1 0.420 36
+ O5' OG311 -0.650 37
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+ O3P C3T
+ C3T H3T1
+ C3T H3T2
+ C3T H3T3
+ C4' C5'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ C1' N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C8 H8
+ C2 H2
+ N1 C6
+ C2 N3
+ C4 C5
+ N7 C8
+ [ impropers ]
+ C6 C5 N1 N6
+ N6 H62 H61 C6
+
+[ NADH ]
+ [ atoms ]
+ AC4' CG3C51 0.110 0
+ AH4' HGA1 0.090 1
+ AO4' OG3C51 -0.400 2
+ AC1' CG3C51 0.110 3
+ AH1' HGA1 0.090 4
+ AC5 CG2RC0 0.280 5
+ AN7 NG2R50 -0.710 6
+ AC8 CG2R53 0.340 7
+ AH8 HGR52 0.120 8
+ AN9 NG2R51 -0.050 9
+ AN1 NG2R62 -0.740 10
+ AC2 CG2R64 0.500 11
+ AH2 HGR62 0.130 12
+ AN3 NG2R62 -0.750 13
+ AC4 CG2RC0 0.430 14
+ AC6 CG2R64 0.460 15
+ AN6 NG2S3 -0.770 16
+ AH61 HGP4 0.380 17
+ AH62 HGP4 0.380 18
+ AC2' CG3C51 0.140 19
+ AH2' HGA1 0.090 20
+ AO2' OG311 -0.650 21
+ AH2T HGP1 0.420 22
+ AC3' CG3C51 0.140 23
+ AH3' HGA1 0.090 24
+ AO3' OG311 -0.650 25
+ AH3T HGP1 0.420 26
+ AC5' CG321 -0.080 27
+ AH5' HGA2 0.090 28
+ AH5S HGA2 0.090 29
+ AP PG1 1.500 30
+ AO1 OG2P1 -0.820 31
+ AO2 OG2P1 -0.820 32
+ AO5' OG303 -0.620 33
+ O3 OG304 -0.680 34
+ NP PG1 1.500 35
+ NO1 OG2P1 -0.820 36
+ NO2 OG2P1 -0.820 37
+ NO5' OG303 -0.620 38
+ NC5' CG321 -0.080 39
+ NH5S HGA2 0.090 40
+ NH5' HGA2 0.090 41
+ NC2' CG3C51 0.140 42
+ NH2' HGA1 0.090 43
+ NO2' OG311 -0.650 44
+ NH2T HGP1 0.420 45
+ NC3' CG3C51 0.140 46
+ NH3' HGA1 0.090 47
+ NO3' OG311 -0.650 48
+ NH3T HGP1 0.420 49
+ NC1' CG3C51 0.110 50
+ NH1' HGA1 0.090 51
+ NC4' CG3C51 0.110 52
+ NH4' HGA1 0.090 53
+ NO4' OG3C51 -0.400 54
+ NN1 NG301 -0.270 55
+ NC6 CG2D1O -0.060 56
+ NH6 HGA4 0.170 57
+ NC5 CG2D1 -0.180 58
+ NH5 HGA4 0.140 59
+ NC4 CG321 -0.280 60
+ NH4 HGA2 0.090 61
+ NH42 HGA2 0.090 62
+ NC3 CG2DC1 0.360 63
+ NC2 CG2D1O -0.100 64
+ NH2 HGA4 0.140 65
+ NC7 CG2O1 0.550 66
+ NO7 OG2D1 -0.510 67
+ NN7 NG2S2 -0.720 68
+ NH71 HGP1 0.260 69
+ NH72 HGP1 0.320 70
+ [ bonds ]
+ AN1 AC2
+ AN3 AC4
+ AC5 AC6
+ AC6 AN6
+ AC5 AN7
+ AC8 AN9
+ AN9 AC4
+ AC2 AH2
+ AN6 AH61
+ AN6 AH62
+ AC8 AH8
+ AN9 AC1'
+ AC1' AC2'
+ AC2' AC3'
+ AC3' AC4'
+ AC4' AO4'
+ AO4' AC1'
+ AC1' AH1'
+ AC2' AO2'
+ AO2' AH2T
+ AC2' AH2'
+ AC3' AH3'
+ AC3' AO3'
+ AO3' AH3T
+ AC4' AH4'
+ AC4' AC5'
+ AC5' AH5S
+ AC5' AH5'
+ AC5' AO5'
+ AO5' AP
+ AP AO1
+ AP AO2
+ AP O3
+ O3 NP
+ NP NO1
+ NP NO2
+ NP NO5'
+ NO5' NC5'
+ NC5' NH5S
+ NC5' NH5'
+ NC5' NC4'
+ NC4' NO4'
+ NO4' NC1'
+ NC1' NC2'
+ NC2' NC3'
+ NC3' NC4'
+ NC1' NH1'
+ NC2' NH2'
+ NC2' NO2'
+ NO2' NH2T
+ NC3' NH3'
+ NC3' NO3'
+ NO3' NH3T
+ NC4' NH4'
+ NC1' NN1
+ NN1 NC2
+ NC3 NC4
+ NC4 NC5
+ NC6 NN1
+ NC2 NH2
+ NC3 NC7
+ NC7 NO7
+ NC7 NN7
+ NN7 NH71
+ NN7 NH72
+ NC4 NH4
+ NC4 NH42
+ NC5 NH5
+ NC6 NH6
+ AC6 AN1
+ AC2 AN3
+ AC4 AC5
+ AN7 AC8
+ NC2 NC3
+ NC5 NC6
+ [ impropers ]
+ AC6 AC5 AN1 AN6
+ AN6 AH62 AH61 AC6
+ NC6 NC5 NN1 NH6
+ NC2 NC3 NN1 NH2
+ NC7 NC3 NN7 NO7
+
+[ NADP ]
+ [ atoms ]
+ AC4' CG3C51 0.110 0
+ AH4' HGA1 0.090 1
+ AO4' OG3C51 -0.400 2
+ AC1' CG3C51 0.110 3
+ AH1' HGA1 0.090 4
+ AC5 CG2RC0 0.280 5
+ AN7 NG2R50 -0.710 6
+ AC8 CG2R53 0.340 7
+ AH8 HGR52 0.120 8
+ AN9 NG2R51 -0.050 9
+ AN1 NG2R62 -0.740 10
+ AC2 CG2R64 0.500 11
+ AH2 HGR62 0.130 12
+ AN3 NG2R62 -0.750 13
+ AC4 CG2RC0 0.430 14
+ AC6 CG2R64 0.460 15
+ AN6 NG2S3 -0.770 16
+ AH61 HGP4 0.380 17
+ AH62 HGP4 0.380 18
+ AC2' CG3C51 0.010 19
+ AH2' HGA1 0.090 20
+ AO2' OG303 -0.620 21
+ AP2 PG1 1.500 22
+ AO1P OG2P1 -0.820 23
+ AO2P OG2P1 -0.820 24
+ AO2T OG311 -0.670 25
+ AH2T HGP1 0.330 26
+ AC3' CG3C51 0.140 27
+ AH3' HGA1 0.090 28
+ AO3' OG311 -0.650 29
+ AH3T HGP1 0.420 30
+ AC5' CG321 -0.080 31
+ AH5' HGA2 0.090 32
+ AH5S HGA2 0.090 33
+ AP PG1 1.500 34
+ AO1 OG2P1 -0.820 35
+ AO2 OG2P1 -0.820 36
+ AO5' OG303 -0.620 37
+ O3 OG304 -0.680 38
+ NP PG1 1.500 39
+ NO1 OG2P1 -0.820 40
+ NO2 OG2P1 -0.820 41
+ NO5' OG303 -0.620 42
+ NC5' CG321 -0.080 43
+ NH5S HGA2 0.090 44
+ NH5' HGA2 0.090 45
+ NC2' CG3C51 0.140 46
+ NH2' HGA1 0.090 47
+ NO2' OG311 -0.650 48
+ NH2T HGP1 0.420 49
+ NC3' CG3C51 0.140 50
+ NH3' HGA1 0.090 51
+ NO3' OG311 -0.650 52
+ NH3T HGP1 0.420 53
+ NC1' CG3C53 0.110 54
+ NH1' HGA1 0.090 55
+ NC4' CG3C51 0.110 56
+ NH4' HGA1 0.090 57
+ NO4' OG3C51 -0.400 58
+ NN1 NG2R61 -0.070 59
+ NC6 CG2R62 0.160 60
+ NH6 HGR63 0.190 61
+ NC5 CG2R62 -0.100 62
+ NH5 HGR63 0.160 63
+ NC4 CG2R62 -0.050 64
+ NH4 HGR63 0.160 65
+ NC3 CG2R62 0.050 66
+ NC2 CG2R62 0.180 67
+ NH2 HGR63 0.160 68
+ NC7 CG2O1 0.680 69
+ NO7 OG2D1 -0.400 70
+ NN7 NG2S2 -0.820 71
+ NH71 HGP1 0.340 72
+ NH72 HGP1 0.360 73
+ [ bonds ]
+ AN1 AC2
+ AN3 AC4
+ AC5 AC6
+ AC6 AN6
+ AC5 AN7
+ AC8 AN9
+ AN9 AC4
+ AC2 AH2
+ AN6 AH61
+ AN6 AH62
+ AC8 AH8
+ AN9 AC1'
+ AC1' AC2'
+ AC2' AC3'
+ AC3' AC4'
+ AC4' AO4'
+ AO4' AC1'
+ AC1' AH1'
+ AC2' AO2'
+ AO2' AP2
+ AC2' AH2'
+ AC3' AH3'
+ AC3' AO3'
+ AO3' AH3T
+ AC4' AH4'
+ AC4' AC5'
+ AC5' AH5S
+ AC5' AH5'
+ AC5' AO5'
+ AO5' AP
+ AP AO1
+ AP AO2
+ AP O3
+ O3 NP
+ NP NO1
+ NP NO2
+ NP NO5'
+ NO5' NC5'
+ NC5' NH5S
+ NC5' NH5'
+ NC5' NC4'
+ NC4' NO4'
+ NO4' NC1'
+ NC1' NC2'
+ NC2' NC3'
+ NC3' NC4'
+ NC1' NH1'
+ NC2' NH2'
+ NC2' NO2'
+ NO2' NH2T
+ NC3' NH3'
+ NC3' NO3'
+ NO3' NH3T
+ NC4' NH4'
+ NC1' NN1
+ NN1 NC2
+ NC3 NC4
+ NC5 NC6
+ NC2 NH2
+ NC3 NC7
+ NC7 NO7
+ NC7 NN7
+ NN7 NH71
+ NN7 NH72
+ NC4 NH4
+ NC5 NH5
+ NC6 NH6
+ AP2 AO1P
+ AP2 AO2P
+ AP2 AO2T
+ AO2T AH2T
+ AC6 AN1
+ AC2 AN3
+ AC4 AC5
+ AN7 AC8
+ NC2 NC3
+ NC4 NC5
+ NC6 NN1
+ [ impropers ]
+ AC6 AC5 AN1 AN6
+ AN6 AH62 AH61 AC6
+ NC7 NC3 NN7 NO7
+
+[ NAFT ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ H1 HGR61 0.115 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 0.000 8
+ C6 CG2R61 -0.115 9
+ H6 HGR61 0.115 10
+ C7 CG2R61 -0.115 11
+ H7 HGR61 0.115 12
+ C8 CG2R61 -0.115 13
+ H8 HGR61 0.115 14
+ C9 CG2R61 -0.115 15
+ H9 HGR61 0.115 16
+ C10 CG2R61 0.000 17
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C5 C10
+ C1 C10
+ C1 H1
+ C2 H2
+ C3 H3
+ C4 H4
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+
+[ NC4 ]
+ [ atoms ]
+ N NG3P0 -0.600 0
+ C1 CG334 -0.350 1
+ C2 CG334 -0.350 2
+ C3 CG334 -0.350 3
+ C4 CG334 -0.350 4
+ H11 HGP5 0.250 5
+ H12 HGP5 0.250 6
+ H13 HGP5 0.250 7
+ H21 HGP5 0.250 8
+ H22 HGP5 0.250 9
+ H23 HGP5 0.250 10
+ H31 HGP5 0.250 11
+ H32 HGP5 0.250 12
+ H33 HGP5 0.250 13
+ H41 HGP5 0.250 14
+ H42 HGP5 0.250 15
+ H43 HGP5 0.250 16
+ [ bonds ]
+ N C1
+ N C2
+ N C3
+ N C4
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ NC5 ]
+ [ atoms ]
+ N NG3P0 -0.600 0
+ C1 CG324 -0.100 1
+ C2 CG334 -0.350 2
+ C3 CG334 -0.350 3
+ C4 CG334 -0.350 4
+ H11 HGP5 0.250 5
+ H12 HGP5 0.250 6
+ H21 HGP5 0.250 7
+ H22 HGP5 0.250 8
+ H23 HGP5 0.250 9
+ H31 HGP5 0.250 10
+ H32 HGP5 0.250 11
+ H33 HGP5 0.250 12
+ H41 HGP5 0.250 13
+ H42 HGP5 0.250 14
+ H43 HGP5 0.250 15
+ C5 CG331 -0.270 16
+ H51 HGA3 0.090 17
+ H52 HGA3 0.090 18
+ H53 HGA3 0.090 19
+ [ bonds ]
+ N C1
+ N C2
+ N C3
+ N C4
+ C1 H11
+ C1 H12
+ C1 C5
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+ C4 H41
+ C4 H42
+ C4 H43
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ NDPH ]
+ [ atoms ]
+ AC4' CG3C51 0.110 0
+ AH4' HGA1 0.090 1
+ AO4' OG3C51 -0.400 2
+ AC1' CG3C51 0.110 3
+ AH1' HGA1 0.090 4
+ AC5 CG2RC0 0.280 5
+ AN7 NG2R50 -0.710 6
+ AC8 CG2R53 0.340 7
+ AH8 HGR52 0.120 8
+ AN9 NG2R51 -0.050 9
+ AN1 NG2R62 -0.740 10
+ AC2 CG2R64 0.500 11
+ AH2 HGR62 0.130 12
+ AN3 NG2R62 -0.750 13
+ AC4 CG2RC0 0.430 14
+ AC6 CG2R64 0.460 15
+ AN6 NG2S3 -0.770 16
+ AH61 HGP4 0.380 17
+ AH62 HGP4 0.380 18
+ AC2' CG3C51 0.010 19
+ AH2' HGA1 0.090 20
+ AO2' OG303 -0.620 21
+ AP2 PG1 1.500 22
+ AO1P OG2P1 -0.820 23
+ AO2P OG2P1 -0.820 24
+ AO2T OG311 -0.670 25
+ AH2T HGP1 0.330 26
+ AC3' CG3C51 0.140 27
+ AH3' HGA1 0.090 28
+ AO3' OG311 -0.650 29
+ AH3T HGP1 0.420 30
+ AC5' CG321 -0.080 31
+ AH5' HGA2 0.090 32
+ AH5S HGA2 0.090 33
+ AP PG1 1.500 34
+ AO1 OG2P1 -0.820 35
+ AO2 OG2P1 -0.820 36
+ AO5' OG303 -0.620 37
+ O3 OG304 -0.680 38
+ NP PG1 1.500 39
+ NO1 OG2P1 -0.820 40
+ NO2 OG2P1 -0.820 41
+ NO5' OG303 -0.620 42
+ NC5' CG321 -0.080 43
+ NH5S HGA2 0.090 44
+ NH5' HGA2 0.090 45
+ NC2' CG3C51 0.140 46
+ NH2' HGA1 0.090 47
+ NO2' OG311 -0.650 48
+ NH2T HGP1 0.420 49
+ NC3' CG3C51 0.140 50
+ NH3' HGA1 0.090 51
+ NO3' OG311 -0.650 52
+ NH3T HGP1 0.420 53
+ NC1' CG3C51 0.110 54
+ NH1' HGA1 0.090 55
+ NC4' CG3C51 0.110 56
+ NH4' HGA1 0.090 57
+ NO4' OG3C51 -0.400 58
+ NN1 NG301 -0.270 59
+ NC6 CG2D1O -0.060 60
+ NH6 HGA4 0.170 61
+ NC5 CG2D1 -0.180 62
+ NH5 HGA4 0.140 63
+ NC4 CG321 -0.280 64
+ NH4 HGA2 0.090 65
+ NH42 HGA2 0.090 66
+ NC3 CG2DC1 0.360 67
+ NC2 CG2D1O -0.100 68
+ NH2 HGA4 0.140 69
+ NC7 CG2O1 0.550 70
+ NO7 OG2D1 -0.510 71
+ NN7 NG2S2 -0.720 72
+ NH71 HGP1 0.260 73
+ NH72 HGP1 0.320 74
+ [ bonds ]
+ AN1 AC2
+ AN3 AC4
+ AC5 AC6
+ AC6 AN6
+ AC5 AN7
+ AC8 AN9
+ AN9 AC4
+ AC2 AH2
+ AN6 AH61
+ AN6 AH62
+ AC8 AH8
+ AN9 AC1'
+ AC1' AC2'
+ AC2' AC3'
+ AC3' AC4'
+ AC4' AO4'
+ AO4' AC1'
+ AC1' AH1'
+ AC2' AO2'
+ AO2' AP2
+ AC2' AH2'
+ AC3' AH3'
+ AC3' AO3'
+ AO3' AH3T
+ AC4' AH4'
+ AC4' AC5'
+ AC5' AH5S
+ AC5' AH5'
+ AC5' AO5'
+ AO5' AP
+ AP AO1
+ AP AO2
+ AP O3
+ O3 NP
+ NP NO1
+ NP NO2
+ NP NO5'
+ NO5' NC5'
+ NC5' NH5S
+ NC5' NH5'
+ NC5' NC4'
+ NC4' NO4'
+ NO4' NC1'
+ NC1' NC2'
+ NC2' NC3'
+ NC3' NC4'
+ NC1' NH1'
+ NC2' NH2'
+ NC2' NO2'
+ NO2' NH2T
+ NC3' NH3'
+ NC3' NO3'
+ NO3' NH3T
+ NC4' NH4'
+ NC1' NN1
+ NN1 NC2
+ NC3 NC4
+ NC4 NC5
+ NC6 NN1
+ NC2 NH2
+ NC3 NC7
+ NC7 NO7
+ NC7 NN7
+ NN7 NH71
+ NN7 NH72
+ NC4 NH4
+ NC4 NH42
+ NC5 NH5
+ NC6 NH6
+ AP2 AO1P
+ AP2 AO2P
+ AP2 AO2T
+ AO2T AH2T
+ AC6 AN1
+ AC2 AN3
+ AC4 AC5
+ AN7 AC8
+ NC2 NC3
+ NC5 NC6
+ [ impropers ]
+ AC6 AC5 AN1 AN6
+ AN6 AH62 AH61 AC6
+ NC6 NC5 NN1 NH6
+ NC2 NC3 NN1 NH2
+ NC7 NC3 NN7 NO7
+
+[ NEOP ]
+ [ atoms ]
+ CT CC30A 0.000 0
+ c1 CC33A -0.270 1
+ h11 HCA3A 0.090 2
+ h12 HCA3A 0.090 3
+ h13 HCA3A 0.090 4
+ c2 CC33A -0.270 5
+ h21 HCA3A 0.090 6
+ h22 HCA3A 0.090 7
+ h23 HCA3A 0.090 8
+ c3 CC33A -0.270 9
+ h31 HCA3A 0.090 10
+ h32 HCA3A 0.090 11
+ h33 HCA3A 0.090 12
+ c4 CC33A -0.270 13
+ h41 HCA3A 0.090 14
+ h42 HCA3A 0.090 15
+ h43 HCA3A 0.090 16
+ [ bonds ]
+ ct c1
+ ct c2
+ ct c3
+ ct c4
+ c1 h11
+ c1 h12
+ c1 h13
+ c2 h21
+ c2 h22
+ c2 h23
+ c3 h31
+ c3 h32
+ c3 h33
+ c4 h41
+ c4 h42
+ c4 h43
+
+[ NESM ]
+ [ atoms ]
+ S1 SG3O1 0.620 0
+ O11 OG2P1 -0.500 1
+ O12 OG2P1 -0.500 2
+ O13 OG2P1 -0.500 3
+ N2 NG2S3 -0.520 4
+ H21 HGP1 0.330 5
+ C3 CG321 -0.110 6
+ H31 HGA2 0.090 7
+ H32 HGA2 0.090 8
+ C4 CG331 -0.270 9
+ H41 HGA3 0.090 10
+ H42 HGA3 0.090 11
+ H43 HGA3 0.090 12
+ [ bonds ]
+ S1 O11
+ S1 O12
+ S1 O13
+ S1 N2
+ N2 H21
+ N2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 H43
+
+[ NIC ]
+ [ atoms ]
+ H1 HGP2 0.450 0
+ N2 NG2R61 -0.520 1
+ C3 CG2R62 0.160 2
+ H4 HGR63 0.190 3
+ C5 CG2R62 -0.100 4
+ H6 HGR63 0.160 5
+ C7 CG2R62 -0.050 6
+ H8 HGR63 0.160 7
+ C9 CG2R62 0.050 8
+ C10 CG2R62 0.180 9
+ H11 HGR63 0.160 10
+ C12 CG2O1 0.680 11
+ O13 OG2D1 -0.400 12
+ N14 NG2S2 -0.820 13
+ H15 HGP1 0.340 14
+ H16 HGP1 0.360 15
+ [ bonds ]
+ N2 H1
+ C3 H4
+ C3 C5
+ C5 H6
+ C7 H8
+ C7 C9
+ N2 C10
+ C10 H11
+ C9 C12
+ C12 N14
+ N14 H15
+ N14 H16
+ C12 O13
+ C9 C10
+ C5 C7
+ N2 C3
+ [ impropers ]
+ C12 C9 N14 O13
+
+[ NICH ]
+ [ atoms ]
+ H1 HGPAM1 0.420 0
+ N2 NG311 -0.690 1
+ C3 CG2D1O -0.060 2
+ H4 HGA4 0.170 3
+ C5 CG2D1 -0.180 4
+ H6 HGA4 0.140 5
+ C7 CG321 -0.280 6
+ H8 HGA2 0.090 7
+ H17 HGA2 0.090 8
+ C10 CG2D1O -0.100 9
+ H11 HGA4 0.140 10
+ C9 CG2DC1 0.360 11
+ C12 CG2O1 0.550 12
+ O13 OG2D1 -0.510 13
+ N14 NG2S2 -0.720 14
+ H15 HGP1 0.260 15
+ H16 HGP1 0.320 16
+ [ bonds ]
+ N2 H1
+ N2 C3
+ C3 H4
+ C5 H6
+ C5 C7
+ C7 H8
+ C7 H17
+ C7 C9
+ N2 C10
+ C10 H11
+ C9 C12
+ C12 N14
+ N14 H15
+ N14 H16
+ C12 O13
+ C9 C10
+ C3 C5
+ [ impropers ]
+ C3 C5 N2 H4
+ C10 C9 N2 H11
+ C12 C9 N14 O13
+
+[ NIME ]
+ [ atoms ]
+ C1 CG334 0.200 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ N2 NG2O1 0.110 4
+ O21 OG2N1 -0.290 5
+ O22 OG2N1 -0.290 6
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 N2
+ N2 O21
+ N2 O22
+ [ impropers ]
+ N2 O21 O22 C1
+
+[ NIPR ]
+ [ atoms ]
+ C1 CG324 0.260 0
+ H11 HGA2 0.090 1
+ H12 HGA2 0.090 2
+ N1 NG2O1 0.140 3
+ O11 OG2N1 -0.290 4
+ O12 OG2N1 -0.290 5
+ C2 CG321 -0.180 6
+ H21 HGA2 0.090 7
+ H22 HGA2 0.090 8
+ C3 CG331 -0.270 9
+ H31 HGA3 0.090 10
+ H32 HGA3 0.090 11
+ H33 HGA3 0.090 12
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 N1
+ C1 C2
+ N1 O11
+ N1 O12
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 H33
+ [ impropers ]
+ N1 O11 O12 C1
+
+[ NITB ]
+ [ atoms ]
+ C1 CG2R61 -0.180 0
+ H1 HGR61 0.160 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 -0.115 4
+ H3 HGR61 0.115 5
+ C4 CG2R61 -0.115 6
+ H4 HGR61 0.115 7
+ C5 CG2R61 -0.180 8
+ H5 HGR61 0.160 9
+ C6 CG2R61 0.320 10
+ N6 NG2O1 0.400 11
+ O6A OG2N1 -0.340 12
+ O6B OG2N1 -0.340 13
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 C1
+ C6 N6
+ N6 O6A
+ N6 O6B
+
+[ NMSM ]
+ [ atoms ]
+ S1 SG3O1 0.620 0
+ O11 OG2P1 -0.500 1
+ O12 OG2P1 -0.500 2
+ O13 OG2P1 -0.500 3
+ N2 NG2S3 -0.520 4
+ H21 HGP1 0.330 5
+ C3 CG331 -0.200 6
+ H31 HGA3 0.090 7
+ H32 HGA3 0.090 8
+ H33 HGA3 0.090 9
+ [ bonds ]
+ S1 O11
+ S1 O12
+ S1 O13
+ S1 N2
+ N2 H21
+ N2 C3
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ NORB ]
+ [ atoms ]
+ C1 CG3RC1 -0.090 0
+ H1 HGA1 0.090 1
+ C2 CG3C52 -0.180 2
+ H21 HGA2 0.090 3
+ H22 HGA2 0.090 4
+ C3 CG3C52 -0.180 5
+ H31 HGA2 0.090 6
+ H32 HGA2 0.090 7
+ C4 CG3RC1 -0.090 8
+ H4 HGA1 0.090 9
+ C5 CG3C52 -0.180 10
+ H51 HGA2 0.090 11
+ H52 HGA2 0.090 12
+ C6 CG3C52 -0.180 13
+ H61 HGA2 0.090 14
+ H62 HGA2 0.090 15
+ C7 CG3C52 -0.180 16
+ H71 HGA2 0.090 17
+ H72 HGA2 0.090 18
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C1
+ C1 C7
+ C7 C4
+ C1 H1
+ C4 H4
+ C7 H71
+ C7 H72
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+
+[ NTHY ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C51 0.110 1
+ H12' HGA1 0.090 2
+ C4' CG3C51 0.110 3
+ H42' HGA1 0.090 4
+ N1 NG2R61 -0.340 5
+ C6 CG2R62 0.170 6
+ H6 HGR62 0.170 7
+ C2 CG2R63 0.510 8
+ O2 OG2D4 -0.410 9
+ N3 NG2R61 -0.460 10
+ H3 HGP1 0.360 11
+ C4 CG2R63 0.500 12
+ O4 OG2D4 -0.450 13
+ C5 CG2R62 -0.150 14
+ C5M CG331 -0.110 15
+ H51 HGA3 0.070 16
+ H52 HGA3 0.070 17
+ H53 HGA3 0.070 18
+ C2' CG3C52 -0.180 19
+ H21' HGA2 0.090 20
+ H22' HGA2 0.090 21
+ C3' CG3C51 0.010 22
+ H31' HGA1 0.090 23
+ O3' OG303 -0.570 24
+ P PG1 1.500 25
+ O1P OG2P1 -0.780 26
+ O2P OG2P1 -0.780 27
+ O3P OG303 -0.570 28
+ C3T CG331 -0.170 29
+ H3T1 HGA3 0.090 30
+ H3T2 HGA3 0.090 31
+ H3T3 HGA3 0.090 32
+ C5' CG321 0.050 33
+ H51' HGA2 0.090 34
+ H52' HGA2 0.090 35
+ H5T HGP1 0.420 36
+ O5' OG311 -0.650 37
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+ O3P C3T
+ C3T H3T1
+ C3T H3T2
+ C3T H3T3
+ C4' C5'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ C1' N1
+ N1 C2
+ N1 C6
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 C5
+ C5 C5M
+ C6 H6
+ C5M H51
+ C5M H52
+ C5M H53
+ C2 O2
+ C4 O4
+ C5 C6
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ NUCL ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C51 0.110 1
+ H12' HGA1 0.090 2
+ C4' CG3C51 0.110 3
+ H42' HGA1 0.090 4
+ CG CG2R51 -0.050 5
+ HG HGR52 0.090 6
+ CD2 CG2R51 0.220 7
+ HD2 HGR52 0.100 8
+ ND1 NG2R51 -0.040 9
+ CE1 CG2R53 0.250 10
+ HE1 HGR52 0.130 11
+ NE2 NG2R50 -0.700 12
+ C2' CG3C52 -0.180 13
+ H21' HGA2 0.090 14
+ H22' HGA2 0.090 15
+ C3' CG3C51 0.010 16
+ H31' HGA1 0.090 17
+ O3' OG303 -0.570 18
+ P PG1 1.500 19
+ O1P OG2P1 -0.780 20
+ O2P OG2P1 -0.780 21
+ O3P OG303 -0.570 22
+ C3T CG331 -0.170 23
+ H3T1 HGA3 0.090 24
+ H3T2 HGA3 0.090 25
+ H3T3 HGA3 0.090 26
+ C5' CG321 0.050 27
+ H51' HGA2 0.090 28
+ H52' HGA2 0.090 29
+ H5T HGP1 0.420 30
+ O5' OG311 -0.650 31
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+ O3P C3T
+ C3T H3T1
+ C3T H3T2
+ C3T H3T3
+ C4' C5'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ C1' ND1
+ ND1 CE1
+ NE2 CD2
+ CG ND1
+ CE1 HE1
+ CD2 HD2
+ CG HG
+ CG CD2
+ CE1 NE2
+
+[ NUSA ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ C2' CG3C52 -0.180 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ C5 CG2RC0 0.280 8
+ N7 NG2R50 -0.710 9
+ C8 CG2R53 0.340 10
+ H8 HGR52 0.120 11
+ N9 NG2R51 -0.050 12
+ N1 NG2R62 -0.740 13
+ C2 CG2R64 0.500 14
+ H2 HGR62 0.130 15
+ N3 NG2R62 -0.750 16
+ C4 CG2RC0 0.430 17
+ C6 CG2R64 0.460 18
+ N6 NG2S3 -0.770 19
+ H61 HGP4 0.380 20
+ H62 HGP4 0.380 21
+ H31' HGA1 0.090 22
+ C3' CG3C51 0.140 23
+ O3' OG311 -0.650 24
+ H32' HGP1 0.420 25
+ C5' CG321 0.050 26
+ H51' HGA2 0.090 27
+ H52' HGA2 0.090 28
+ O5' OG311 -0.650 29
+ H5T HGP1 0.420 30
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ O3' H32'
+ C1' N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C8 H8
+ C2 H2
+ N1 C6
+ C2 N3
+ C4 C5
+ N7 C8
+ [ impropers ]
+ C6 C5 N1 N6
+ N6 H62 H61 C6
+
+[ NUSC ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ C2' CG3C52 -0.180 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ N1 NG2R61 -0.130 8
+ C6 CG2R62 0.050 9
+ H6 HGR62 0.170 10
+ C2 CG2R63 0.520 11
+ O2 OG2D4 -0.490 12
+ N3 NG2R62 -0.660 13
+ C4 CG2R64 0.650 14
+ N4 NG2S3 -0.750 15
+ H41 HGP4 0.370 16
+ H42 HGP4 0.330 17
+ C5 CG2R62 -0.130 18
+ H5 HGR62 0.070 19
+ H31' HGA1 0.090 20
+ C3' CG3C51 0.140 21
+ O3' OG311 -0.650 22
+ H32' HGP1 0.420 23
+ C5' CG321 0.050 24
+ H51' HGA2 0.090 25
+ H52' HGA2 0.090 26
+ O5' OG311 -0.650 27
+ H5T HGP1 0.420 28
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ O3' H32'
+ C1' N1
+ N1 C2
+ N1 C6
+ C4 N4
+ N4 H41
+ N4 H42
+ C2 N3
+ C4 C5
+ C5 H5
+ C6 H6
+ C2 O2
+ C5 C6
+ N3 C4
+ [ impropers ]
+ C4 C5 N3 N4
+ C2 N1 N3 O2
+ N4 H42 H41 C4
+
+[ NUSG ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ C2' CG3C52 -0.180 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ N9 NG2R51 -0.020 8
+ C4 CG2RC0 0.260 9
+ N3 NG2R62 -0.740 10
+ C2 CG2R64 0.750 11
+ N1 NG2R61 -0.340 12
+ H1 HGP1 0.260 13
+ N2 NG2S3 -0.680 14
+ H21 HGP4 0.320 15
+ H22 HGP4 0.350 16
+ C6 CG2R63 0.540 17
+ O6 OG2D4 -0.510 18
+ C5 CG2RC0 0.000 19
+ N7 NG2R50 -0.600 20
+ C8 CG2R53 0.250 21
+ H8 HGR52 0.160 22
+ H31' HGA1 0.090 23
+ C3' CG3C51 0.140 24
+ O3' OG311 -0.650 25
+ H32' HGP1 0.420 26
+ C5' CG321 0.050 27
+ H51' HGA2 0.090 28
+ H52' HGA2 0.090 29
+ O5' OG311 -0.650 30
+ H5T HGP1 0.420 31
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ O3' H32'
+ C1' N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N2
+ C2 N1
+ N2 H21
+ N2 H22
+ N1 H1
+ N1 C6
+ C6 C5
+ C5 N7
+ C8 H8
+ C2 N3
+ C4 C5
+ N7 C8
+ C6 O6
+ [ impropers ]
+ C2 N1 N3 N2
+ N2 H22 H21 C2
+ C6 C5 N1 O6
+
+[ NUST ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ C2' CG3C52 -0.180 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ N1 NG2R61 -0.340 8
+ C6 CG2R62 0.170 9
+ H6 HGR62 0.170 10
+ C2 CG2R63 0.510 11
+ O2 OG2D4 -0.410 12
+ N3 NG2R61 -0.460 13
+ H3 HGP1 0.360 14
+ C4 CG2R63 0.500 15
+ O4 OG2D4 -0.450 16
+ C5 CG2R62 -0.150 17
+ C5M CG331 -0.110 18
+ H51 HGA3 0.070 19
+ H52 HGA3 0.070 20
+ H53 HGA3 0.070 21
+ H31' HGA1 0.090 22
+ C3' CG3C51 0.140 23
+ O3' OG311 -0.650 24
+ H32' HGP1 0.420 25
+ C5' CG321 0.050 26
+ H51' HGA2 0.090 27
+ H52' HGA2 0.090 28
+ O5' OG311 -0.650 29
+ H5T HGP1 0.420 30
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ O3' H32'
+ C1' N1
+ N1 C2
+ N1 C6
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 C5
+ C5 C5M
+ C6 H6
+ C5M H51
+ C5M H52
+ C5M H53
+ C2 O2
+ C4 O4
+ C5 C6
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ NUSU ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ C2' CG3C52 -0.180 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ N1 NG2R61 -0.340 8
+ C6 CG2R62 0.200 9
+ H6 HGR62 0.140 10
+ C2 CG2R63 0.550 11
+ O2 OG2D4 -0.450 12
+ N3 NG2R61 -0.460 13
+ H3 HGP1 0.360 14
+ C4 CG2R63 0.530 15
+ O4 OG2D4 -0.480 16
+ C5 CG2R62 -0.150 17
+ H5 HGR62 0.100 18
+ H31' HGA1 0.090 19
+ C3' CG3C51 0.140 20
+ O3' OG311 -0.650 21
+ H32' HGP1 0.420 22
+ C5' CG321 0.050 23
+ H51' HGA2 0.090 24
+ H52' HGA2 0.090 25
+ O5' OG311 -0.650 26
+ H5T HGP1 0.420 27
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ O3' H32'
+ C1' N1
+ N1 C2
+ N1 C6
+ C2 O2
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 O4
+ C4 C5
+ C5 C6
+ C5 H5
+ C6 H6
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ NZAD ]
+ [ atoms ]
+ C1 CG2R61 0.000 0
+ C2 CG2R61 -0.115 1
+ C3 CG2R61 -0.115 2
+ C4 CG2R61 -0.115 3
+ C5 CG2R61 -0.115 4
+ C6 CG2R61 -0.115 5
+ H2 HGR61 0.115 6
+ H3 HGR61 0.115 7
+ H4 HGR61 0.115 8
+ H5 HGR61 0.115 9
+ H6 HGR61 0.115 10
+ C7 CG321 -0.020 11
+ H71 HGA2 0.090 12
+ H72 HGA2 0.090 13
+ N8 NG2S1 -0.470 14
+ H8 HGP1 0.310 15
+ C9 CG2O1 0.510 16
+ O9 OG2D1 -0.510 17
+ C10 CG331 -0.270 18
+ H101 HGA3 0.090 19
+ H102 HGA3 0.090 20
+ H103 HGA3 0.090 21
+ [ bonds ]
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 C1
+ C1 C7
+ C7 H71
+ C7 H72
+ C7 N8
+ N8 H8
+ N8 C9
+ C9 O9
+ C9 C10
+ C10 H101
+ C10 H102
+ C10 H103
+ [ impropers ]
+ C9 C10 N8 O9
+
+[ O2 ]
+ [ atoms ]
+ O1 OM 0.021 0
+ O2 OM -0.021 1
+ [ bonds ]
+ O1 O2
+
+[ OBTZ ]
+ [ atoms ]
+ S1 SG3O2 0.330 0
+ N2 NG311 -0.550 1
+ H2 HGP1 0.380 2
+ O11 OG2P1 -0.340 3
+ O12 OG2P1 -0.340 4
+ C3 CG321 0.290 5
+ H31 HGA2 0.090 6
+ H32 HGA2 0.090 7
+ N4 NG311 -0.760 8
+ H4 HGPAM1 0.390 9
+ C5 CG2R61 0.320 10
+ C6 CG2R61 -0.115 11
+ H6 HGR61 0.115 12
+ C7 CG2R61 -0.115 13
+ H7 HGR61 0.115 14
+ C8 CG2R61 -0.115 15
+ H8 HGR61 0.115 16
+ C9 CG2R61 -0.115 17
+ H9 HGR61 0.115 18
+ C10 CG2R61 0.100 19
+ [ bonds ]
+ S1 N2
+ N2 C3
+ C3 N4
+ N4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 S1
+ C5 C10
+ S1 O11
+ S1 O12
+ N2 H2
+ C3 H31
+ C3 H32
+ N4 H4
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+
+[ OCOH ]
+ [ atoms ]
+ C1 CG321 0.050 0
+ H11 HGA2 0.090 1
+ H12 HGA2 0.090 2
+ O1 OG311 -0.650 3
+ HO1 HGP1 0.420 4
+ C2 CG321 -0.180 5
+ H21 HGA2 0.090 6
+ H22 HGA2 0.090 7
+ C3 CG321 -0.180 8
+ H31 HGA2 0.090 9
+ H32 HGA2 0.090 10
+ C4 CG321 -0.180 11
+ H41 HGA2 0.090 12
+ H42 HGA2 0.090 13
+ C5 CG321 -0.180 14
+ H51 HGA2 0.090 15
+ H52 HGA2 0.090 16
+ C6 CG321 -0.180 17
+ H61 HGA2 0.090 18
+ H62 HGA2 0.090 19
+ C7 CG321 -0.180 20
+ H71 HGA2 0.090 21
+ H72 HGA2 0.090 22
+ C8 CG331 -0.270 23
+ H81 HGA3 0.090 24
+ H82 HGA3 0.090 25
+ H83 HGA3 0.090 26
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C1 O1
+ O1 HO1
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+ C7 H71
+ C7 H72
+ C8 H81
+ C8 H82
+ C8 H83
+
+[ OCT ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ C2 CC32A -0.180 4
+ H21 HCA2A 0.090 5
+ H22 HCA2A 0.090 6
+ C3 CC32A -0.180 7
+ H31 HCA2A 0.090 8
+ H32 HCA2A 0.090 9
+ C4 CC32A -0.180 10
+ H41 HCA2A 0.090 11
+ H42 HCA2A 0.090 12
+ C5 CC32A -0.180 13
+ H51 HCA2A 0.090 14
+ H52 HCA2A 0.090 15
+ C6 CC32A -0.180 16
+ H61 HCA2A 0.090 17
+ H62 HCA2A 0.090 18
+ C7 CC32A -0.180 19
+ H71 HCA2A 0.090 20
+ H72 HCA2A 0.090 21
+ C8 CC33A -0.270 22
+ H81 HCA3A 0.090 23
+ H82 HCA3A 0.090 24
+ H83 HCA3A 0.090 25
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+ C7 H71
+ C7 H72
+ C8 H81
+ C8 H82
+ C8 H83
+
+[ OCT2 ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ C2 CC32A -0.180 4
+ H21 HCA2A 0.090 5
+ H22 HCA2A 0.090 6
+ C3 CC32A -0.180 7
+ H31 HCA2A 0.090 8
+ H32 HCA2A 0.090 9
+ C4 CC32A -0.180 10
+ H41 HCA2A 0.090 11
+ H42 HCA2A 0.090 12
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+
+[ OCTD ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H1A HCA3A 0.090 1
+ H1B HCA3A 0.090 2
+ H1C HCA3A 0.090 3
+ C2 CC32A -0.180 4
+ H2A HCA2A 0.090 5
+ H2B HCA2A 0.090 6
+ C3 CC32A -0.180 7
+ H3A HCA2A 0.090 8
+ H3B HCA2A 0.090 9
+ C4 CC32A -0.180 10
+ H4A HCA2A 0.090 11
+ H4B HCA2A 0.090 12
+ C5 CC32A -0.180 13
+ H5A HCA2A 0.090 14
+ H5B HCA2A 0.090 15
+ C6 CC32A -0.180 16
+ H6A HCA2A 0.090 17
+ H6B HCA2A 0.090 18
+ C7 CC32A -0.180 19
+ H7A HCA2A 0.090 20
+ H7B HCA2A 0.090 21
+ C8 CC32A -0.180 22
+ H8A HCA2A 0.090 23
+ H8B HCA2A 0.090 24
+ C9 CC32A -0.180 25
+ H9A HCA2A 0.090 26
+ H9B HCA2A 0.090 27
+ C10 CC32A -0.180 28
+ H10A HCA2A 0.090 29
+ H10B HCA2A 0.090 30
+ C11 CC32A -0.180 31
+ H11A HCA2A 0.090 32
+ H11B HCA2A 0.090 33
+ C12 CC32A -0.180 34
+ H12A HCA2A 0.090 35
+ H12B HCA2A 0.090 36
+ C13 CC32A -0.180 37
+ H13A HCA2A 0.090 38
+ H13B HCA2A 0.090 39
+ C14 CC32A -0.180 40
+ H14A HCA2A 0.090 41
+ H14B HCA2A 0.090 42
+ C15 CC32A -0.180 43
+ H15A HCA2A 0.090 44
+ H15B HCA2A 0.090 45
+ C16 CC32A -0.180 46
+ H16A HCA2A 0.090 47
+ H16B HCA2A 0.090 48
+ C17 CC32A -0.180 49
+ H17A HCA2A 0.090 50
+ H17B HCA2A 0.090 51
+ C18 CC33A -0.270 52
+ H18A HCA3A 0.090 53
+ H18B HCA3A 0.090 54
+ H18C HCA3A 0.090 55
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 C13
+ C13 C14
+ C14 C15
+ C15 C16
+ C16 C17
+ C17 C18
+ C1 H1A
+ C1 H1B
+ C1 H1C
+ C2 H2A
+ C2 H2B
+ C3 H3A
+ C3 H3B
+ C4 H4A
+ C4 H4B
+ C5 H5A
+ C5 H5B
+ C6 H6A
+ C6 H6B
+ C7 H7A
+ C7 H7B
+ C8 H8A
+ C8 H8B
+ C9 H9A
+ C9 H9B
+ C10 H10A
+ C10 H10B
+ C11 H11A
+ C11 H11B
+ C12 H12A
+ C12 H12B
+ C13 H13A
+ C13 H13B
+ C14 H14A
+ C14 H14B
+ C15 H15A
+ C15 H15B
+ C16 H16A
+ C16 H16B
+ C17 H17A
+ C17 H17B
+ C18 H18A
+ C18 H18B
+ C18 H18C
+
+[ OH ]
+ [ atoms ]
+ O1 OX -1.320 0
+ H1 HX 0.320 1
+ [ bonds ]
+ O1 H1
+
+[ OSPE ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL2 0.130 4
+ H12A HAL2 0.090 5
+ H12B HAL2 0.090 6
+ C11 CTL2 -0.080 7
+ H11A HAL2 0.090 8
+ H11B HAL2 0.090 9
+ P PL 1.500 10
+ O13 O2L -0.780 11
+ O14 O2L -0.780 12
+ O11 OSLP -0.570 13
+ O12 OSLP -0.570 14
+ C1 CTL2 -0.080 15
+ HA HAL2 0.090 16
+ HB HAL2 0.090 17
+ C2 CTL1 0.170 18
+ HS HAL1 0.090 19
+ O21 OSL -0.490 20
+ C21 CL 0.900 21
+ O22 OBL -0.630 22
+ C22 CTL2 -0.220 23
+ H2R HAL2 0.090 24
+ H2S HAL2 0.090 25
+ C3 CTL2 0.080 26
+ HX HAL2 0.090 27
+ HY HAL2 0.090 28
+ O31 OSL -0.490 29
+ C31 CL 0.900 30
+ O32 OBL -0.630 31
+ C32 CTL2 -0.220 32
+ H2X HAL2 0.090 33
+ H2Y HAL2 0.090 34
+ C23 CTL2 -0.180 35
+ H3R HAL2 0.090 36
+ H3S HAL2 0.090 37
+ C24 CTL2 -0.180 38
+ H4R HAL2 0.090 39
+ H4S HAL2 0.090 40
+ C25 CTL2 -0.180 41
+ H5R HAL2 0.090 42
+ H5S HAL2 0.090 43
+ C26 CTL2 -0.180 44
+ H6R HAL2 0.090 45
+ H6S HAL2 0.090 46
+ C27 CTL2 -0.180 47
+ H7R HAL2 0.090 48
+ H7S HAL2 0.090 49
+ C28 CTL2 -0.180 50
+ H8R HAL2 0.090 51
+ H8S HAL2 0.090 52
+ C29 CEL1 -0.150 53
+ H9R HEL1 0.150 54
+ C210 CEL1 -0.150 55
+ H10R HEL1 0.150 56
+ C211 CTL2 -0.180 57
+ H11R HAL2 0.090 58
+ H11S HAL2 0.090 59
+ C212 CTL2 -0.180 60
+ H12R HAL2 0.090 61
+ H12S HAL2 0.090 62
+ C213 CTL2 -0.180 63
+ H13R HAL2 0.090 64
+ H13S HAL2 0.090 65
+ C214 CTL2 -0.180 66
+ H14R HAL2 0.090 67
+ H14S HAL2 0.090 68
+ C215 CTL2 -0.180 69
+ H15R HAL2 0.090 70
+ H15S HAL2 0.090 71
+ C216 CTL3 -0.270 72
+ H16R HAL3 0.090 73
+ H16S HAL3 0.090 74
+ H16T HAL3 0.090 75
+ C33 CTL2 -0.180 76
+ H3X HAL2 0.090 77
+ H3Y HAL2 0.090 78
+ C34 CTL2 -0.180 79
+ H4X HAL2 0.090 80
+ H4Y HAL2 0.090 81
+ C35 CTL2 -0.180 82
+ H5X HAL2 0.090 83
+ H5Y HAL2 0.090 84
+ C36 CTL2 -0.180 85
+ H6X HAL2 0.090 86
+ H6Y HAL2 0.090 87
+ C37 CTL2 -0.180 88
+ H7X HAL2 0.090 89
+ H7Y HAL2 0.090 90
+ C38 CTL2 -0.180 91
+ H8X HAL2 0.090 92
+ H8Y HAL2 0.090 93
+ C39 CEL1 -0.150 94
+ H9X HEL1 0.150 95
+ C310 CEL1 -0.150 96
+ H10X HEL1 0.150 97
+ C311 CTL2 -0.180 98
+ H11X HAL2 0.090 99
+ H11Y HAL2 0.090 100
+ C312 CTL2 -0.180 101
+ H12X HAL2 0.090 102
+ H12Y HAL2 0.090 103
+ C313 CTL2 -0.180 104
+ H13X HAL2 0.090 105
+ H13Y HAL2 0.090 106
+ C314 CTL2 -0.180 107
+ H14X HAL2 0.090 108
+ H14Y HAL2 0.090 109
+ C315 CTL2 -0.180 110
+ H15X HAL2 0.090 111
+ H15Y HAL2 0.090 112
+ C316 CTL2 -0.180 113
+ H16X HAL2 0.090 114
+ H16Y HAL2 0.090 115
+ C317 CTL2 -0.180 116
+ H17X HAL2 0.090 117
+ H17Y HAL2 0.090 118
+ C318 CTL3 -0.270 119
+ H18X HAL3 0.090 120
+ H18Y HAL3 0.090 121
+ H18Z HAL3 0.090 122
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C210 H10R
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C310 H10X
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C29 C210
+ C31 O32
+ C39 C310
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ OXAD ]
+ [ atoms ]
+ C1 CG2R51 0.170 0
+ H1 HGR52 0.140 1
+ C2 CG2R51 0.190 2
+ H2 HGR52 0.100 3
+ N3 NG2R50 -0.320 4
+ N4 NG2R50 -0.100 5
+ O5 OG2R50 -0.180 6
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 N3
+ N3 N4
+ N4 O5
+ O5 C1
+
+[ OXAZ ]
+ [ atoms ]
+ C1 CG2R51 0.110 0
+ H1 HGR52 0.120 1
+ C2 CG2R51 0.150 2
+ H2 HGR52 0.110 3
+ N3 NG2R50 -0.610 4
+ C4 CG2R53 0.220 5
+ H4 HGR52 0.190 6
+ O5 OG2R50 -0.290 7
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 N3
+ N3 C4
+ C4 H4
+ C4 O5
+ O5 C1
+
+[ OXD4 ]
+ [ atoms ]
+ C1 CG2R53 0.450 0
+ H1 HGR52 0.170 1
+ N2 NG2R50 -0.640 2
+ C3 CG2R53 0.490 3
+ H3 HGR52 0.130 4
+ N4 NG2R50 -0.420 5
+ O5 OG2R50 -0.180 6
+ [ bonds ]
+ C1 H1
+ C1 N2
+ N2 C3
+ C3 H3
+ C3 N4
+ N4 O5
+ O5 C1
+
+[ OXYL ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 0.000 8
+ CZ CG2R61 0.000 9
+ C1 CG331 -0.270 10
+ H11 HGA3 0.090 11
+ H12 HGA3 0.090 12
+ H13 HGA3 0.090 13
+ C2 CG331 -0.270 14
+ H21 HGA3 0.090 15
+ H22 HGA3 0.090 16
+ H23 HGA3 0.090 17
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 C2
+ CZ C1
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ PACP ]
+ [ atoms ]
+ C14 CG331 -0.270 0
+ H141 HGA3 0.090 1
+ H142 HGA3 0.090 2
+ H143 HGA3 0.090 3
+ C15 CG2O1 0.520 4
+ O29 OG2D1 -0.520 5
+ N21 NG2S1 -0.470 6
+ H211 HGP1 0.330 7
+ C22 CG2R61 0.140 8
+ C23 CG2R61 -0.115 9
+ H231 HGR61 0.115 10
+ C24 CG2R61 -0.115 11
+ H241 HGR61 0.115 12
+ C26 CG2R61 -0.115 13
+ H261 HGR61 0.115 14
+ C27 CG2R61 -0.115 15
+ H271 HGR61 0.115 16
+ C25 CG2R61 0.110 17
+ O28 OG311 -0.530 18
+ H281 HGP1 0.420 19
+ [ bonds ]
+ C14 C15
+ C15 N21
+ N21 C22
+ C22 C23
+ C15 O29
+ C23 C24
+ C24 C25
+ C25 C26
+ C26 C27
+ C27 C22
+ C25 O28
+ O28 H281
+ N21 H211
+ C14 H141
+ C14 H142
+ C14 H143
+ C23 H231
+ C24 H241
+ C26 H261
+ C27 H271
+ [ impropers ]
+ C15 C14 N21 O29
+
+[ PALD ]
+ [ atoms ]
+ O OG2D1 -0.400 0
+ C CG2O4 0.200 1
+ CB CG321 -0.070 2
+ HB1 HGA2 0.090 3
+ HB2 HGA2 0.090 4
+ HA HGR52 0.090 5
+ CG CG331 -0.270 6
+ HG1 HGA3 0.090 7
+ HG2 HGA3 0.090 8
+ HG3 HGA3 0.090 9
+ [ bonds ]
+ HA C
+ C CB
+ CB HB1
+ CB HB2
+ CB CG
+ CG HG1
+ CG HG3
+ CG HG2
+ C O
+ [ impropers ]
+ C CB O HA
+
+[ PBSM ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CE1 CG2R61 -0.115 4
+ HE1 HGR61 0.115 5
+ CD2 CG2R61 -0.115 6
+ HD2 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ CG2R61 0.230 10
+ S1 SG3O2 0.580 11
+ O11 OG2P1 -0.400 12
+ O12 OG2P1 -0.400 13
+ N2 NG311 -0.570 14
+ H21 HGP1 0.320 15
+ C3 CG2R61 0.240 16
+ C41 CG2R61 -0.115 17
+ H41 HGR61 0.115 18
+ C42 CG2R61 -0.115 19
+ H42 HGR61 0.115 20
+ C51 CG2R61 -0.115 21
+ H51 HGR61 0.115 22
+ C52 CG2R61 -0.115 23
+ H52 HGR61 0.115 24
+ C6 CG2R61 -0.115 25
+ H6 HGR61 0.115 26
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ S1
+ S1 N2
+ S1 O11
+ S1 O12
+ N2 H21
+ N2 C3
+ C3 C41
+ C3 C42
+ C41 C51
+ C42 C52
+ C6 C51
+ C6 C52
+ C41 H41
+ C42 H42
+ C51 H51
+ C52 H52
+ C6 H6
+
+[ PC ]
+ [ atoms ]
+ N NG3P0 -0.600 0
+ C1 CG324 -0.100 1
+ C2 CG334 -0.350 2
+ C3 CG334 -0.350 3
+ C4 CG334 -0.350 4
+ H11 HGP5 0.250 5
+ H12 HGP5 0.250 6
+ H21 HGP5 0.250 7
+ H22 HGP5 0.250 8
+ H23 HGP5 0.250 9
+ H31 HGP5 0.250 10
+ H32 HGP5 0.250 11
+ H33 HGP5 0.250 12
+ H41 HGP5 0.250 13
+ H42 HGP5 0.250 14
+ H43 HGP5 0.250 15
+ C5 CG321 -0.080 16
+ H51 HGA2 0.090 17
+ H52 HGA2 0.090 18
+ P1 PG1 1.500 19
+ O3 OG2P1 -0.780 20
+ O4 OG2P1 -0.780 21
+ O1 OG303 -0.570 22
+ O2 OG303 -0.570 23
+ C6 CG331 -0.170 24
+ H61 HGA3 0.090 25
+ H62 HGA3 0.090 26
+ H63 HGA3 0.090 27
+ [ bonds ]
+ N C1
+ N C2
+ N C3
+ N C4
+ C1 H11
+ C1 H12
+ C1 C5
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+ C4 H41
+ C4 H42
+ C4 H43
+ C5 H51
+ C5 H52
+ P1 O1
+ P1 O2
+ P1 O3
+ P1 O4
+ O1 C5
+ O2 C6
+ C6 H61
+ C6 H62
+ C6 H63
+
+[ PCLT ]
+ [ atoms ]
+ CG CG2R61 0.030 0
+ CL CLGR1 -0.130 1
+ CD1 CG2R61 -0.100 2
+ HD1 HGR62 0.150 3
+ CD2 CG2R61 -0.100 4
+ HD2 HGR62 0.150 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ CG2R61 0.000 10
+ CT CG331 -0.270 11
+ H11 HGA3 0.090 12
+ H12 HGA3 0.090 13
+ H13 HGA3 0.090 14
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG CL
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ CT
+ CT H11
+ CT H12
+ CT H13
+
+[ PCRO ]
+ [ atoms ]
+ CG CG2R61 0.110 0
+ CD1 CG2R61 -0.115 1
+ HD1 HGR61 0.115 2
+ CD2 CG2R61 -0.115 3
+ HD2 HGR61 0.115 4
+ CE1 CG2R61 -0.115 5
+ HE1 HGR61 0.115 6
+ CE2 CG2R61 -0.115 7
+ HE2 HGR61 0.115 8
+ CZ CG2R61 0.000 9
+ C1 CG331 -0.270 10
+ H11 HGA3 0.090 11
+ H12 HGA3 0.090 12
+ H13 HGA3 0.090 13
+ O2 OG311 -0.530 14
+ H2 HGP1 0.420 15
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG O2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ C1
+ O2 H2
+ C1 H11
+ C1 H12
+ C1 H13
+
+[ PDIP ]
+ [ atoms ]
+ N NG2S0 -0.290 0
+ CA CG3C51 0.020 1
+ CB CG3C52 -0.180 2
+ CG CG3C52 -0.180 3
+ CD CG3C52 0.000 4
+ CY CG2O1 0.510 5
+ OY OG2D1 -0.510 6
+ C CG2O1 0.510 7
+ HA HGA1 0.090 8
+ HB1 HGA2 0.090 9
+ HB2 HGA2 0.090 10
+ HG1 HGA2 0.090 11
+ HG2 HGA2 0.090 12
+ HD1 HGA2 0.090 13
+ HD2 HGA2 0.090 14
+ CAY CG331 -0.270 15
+ HY1 HGA3 0.090 16
+ HY2 HGA3 0.090 17
+ HY3 HGA3 0.090 18
+ O OG2D1 -0.510 19
+ NT NG2S1 -0.470 20
+ HT1 HGP1 0.310 21
+ CR CG331 -0.110 22
+ HR1 HGA3 0.090 23
+ HR2 HGA3 0.090 24
+ HR3 HGA3 0.090 25
+ [ bonds ]
+ CY N
+ CAY HY1
+ CAY HY2
+ CAY HY3
+ CY CAY
+ N CA
+ CA CB
+ CB CG
+ CG CD
+ CD N
+ HA CA
+ HG1 CG
+ HG2 CG
+ HD1 CD
+ HD2 CD
+ HB1 CB
+ HB2 CB
+ C CA
+ C NT
+ NT HT1
+ NT CR
+ CR HR1
+ CR HR2
+ CR HR3
+ C O
+ CY OY
+ [ impropers ]
+ CY CAY N OY
+ C CA NT O
+
+[ PEGM ]
+ [ atoms ]
+ C1 CC32A -0.010 0
+ H1B HCA2A 0.090 1
+ H1A HCA2A 0.090 2
+ O1 OC30A -0.340 3
+ C2 CC32A -0.010 4
+ H2A HCA2A 0.090 5
+ H2B HCA2A 0.090 6
+ [ bonds ]
+ C1 H1A
+ C1 H1B
+ C1 O1
+ O1 C2
+ C2 H2A
+ C2 H2B
+ C1 -C2
+
+[ PEND ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H1A HCA3A 0.090 1
+ H1B HCA3A 0.090 2
+ H1C HCA3A 0.090 3
+ C2 CC32A -0.180 4
+ H2A HCA2A 0.090 5
+ H2B HCA2A 0.090 6
+ C3 CC32A -0.180 7
+ H3A HCA2A 0.090 8
+ H3B HCA2A 0.090 9
+ C4 CC32A -0.180 10
+ H4A HCA2A 0.090 11
+ H4B HCA2A 0.090 12
+ C5 CC32A -0.180 13
+ H5A HCA2A 0.090 14
+ H5B HCA2A 0.090 15
+ C6 CC32A -0.180 16
+ H6A HCA2A 0.090 17
+ H6B HCA2A 0.090 18
+ C7 CC32A -0.180 19
+ H7A HCA2A 0.090 20
+ H7B HCA2A 0.090 21
+ C8 CC32A -0.180 22
+ H8A HCA2A 0.090 23
+ H8B HCA2A 0.090 24
+ C9 CC32A -0.180 25
+ H9A HCA2A 0.090 26
+ H9B HCA2A 0.090 27
+ C10 CC32A -0.180 28
+ H10A HCA2A 0.090 29
+ H10B HCA2A 0.090 30
+ C11 CC32A -0.180 31
+ H11A HCA2A 0.090 32
+ H11B HCA2A 0.090 33
+ C12 CC32A -0.180 34
+ H12A HCA2A 0.090 35
+ H12B HCA2A 0.090 36
+ C13 CC32A -0.180 37
+ H13A HCA2A 0.090 38
+ H13B HCA2A 0.090 39
+ C14 CC32A -0.180 40
+ H14A HCA2A 0.090 41
+ H14B HCA2A 0.090 42
+ C15 CC33A -0.270 43
+ H15A HCA3A 0.090 44
+ H15B HCA3A 0.090 45
+ H15C HCA3A 0.090 46
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 C13
+ C13 C14
+ C14 C15
+ C1 H1A
+ C1 H1B
+ C1 H1C
+ C2 H2A
+ C2 H2B
+ C3 H3A
+ C3 H3B
+ C4 H4A
+ C4 H4B
+ C5 H5A
+ C5 H5B
+ C6 H6A
+ C6 H6B
+ C7 H7A
+ C7 H7B
+ C8 H8A
+ C8 H8B
+ C9 H9A
+ C9 H9B
+ C10 H10A
+ C10 H10B
+ C11 H11A
+ C11 H11B
+ C12 H12A
+ C12 H12B
+ C13 H13A
+ C13 H13B
+ C14 H14A
+ C14 H14B
+ C15 H15A
+ C15 H15B
+ C15 H15C
+
+[ PENT ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H11 HCA3A 0.090 1
+ H12 HCA3A 0.090 2
+ H13 HCA3A 0.090 3
+ C2 CC32A -0.180 4
+ H21 HCA2A 0.090 5
+ H22 HCA2A 0.090 6
+ C3 CC32A -0.180 7
+ H31 HCA2A 0.090 8
+ H32 HCA2A 0.090 9
+ C4 CC32A -0.180 10
+ H41 HCA2A 0.090 11
+ H42 HCA2A 0.090 12
+ C5 CC33A -0.270 13
+ H51 HCA3A 0.090 14
+ H52 HCA3A 0.090 15
+ H53 HCA3A 0.090 16
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ PHA ]
+ [ atoms ]
+ P1 PG1 1.570 0
+ O3 OG2P1 -0.820 1
+ O4 OG2P1 -0.820 2
+ O2 OG303 -0.560 3
+ N1 NG2S3 -0.860 4
+ H1 HGP1 0.330 5
+ C1 CG331 -0.190 6
+ H11 HGA3 0.090 7
+ H12 HGA3 0.090 8
+ H13 HGA3 0.090 9
+ C2 CG331 -0.190 10
+ H21 HGA3 0.090 11
+ H22 HGA3 0.090 12
+ H23 HGA3 0.090 13
+ [ bonds ]
+ P1 N1
+ P1 O2
+ P1 O3
+ P1 O4
+ N1 C2
+ N1 H1
+ O2 C1
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ PHE ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CA 0.000 7
+ CD1 CA -0.115 8
+ HD1 HP 0.115 9
+ CE1 CA -0.115 10
+ HE1 HP 0.115 11
+ CZ CA -0.115 12
+ HZ HP 0.115 13
+ CD2 CA -0.115 14
+ HD2 HP 0.115 15
+ CE2 CA -0.115 16
+ HE2 HP 0.115 17
+ C C 0.510 18
+ O O -0.510 19
+ [ bonds ]
+ CB CA
+ CG CB
+ CD2 CG
+ CE1 CD1
+ CZ CE2
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ HZ
+ O C
+ CD1 CG
+ CZ CE1
+ CE2 CD2
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ PHEK ]
+ [ atoms ]
+ C1 CG331 -0.270 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG321 -0.170 4
+ H21 HGA2 0.090 5
+ H22 HGA2 0.090 6
+ C3 CG2O5 0.340 7
+ O3 OG2D3 -0.470 8
+ C4 CG2R61 0.120 9
+ C5 CG2R61 -0.115 10
+ H5 HGR61 0.115 11
+ C6 CG2R61 -0.115 12
+ H6 HGR61 0.115 13
+ C7 CG2R61 -0.115 14
+ H7 HGR61 0.115 15
+ C8 CG2R61 -0.115 16
+ H8 HGR61 0.115 17
+ C9 CG2R61 -0.115 18
+ H9 HGR61 0.115 19
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 O3
+ C3 C4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 C7
+ C7 H7
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C4
+ [ impropers ]
+ C3 C4 C2 O3
+
+[ PHEN ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ CG2R61 0.110 10
+ OH OG311 -0.530 11
+ HH HGP1 0.420 12
+ [ bonds ]
+ CD2 CG
+ CE1 CD1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ OH
+ OH HH
+ CD1 CG
+ CE2 CD2
+ CZ CE1
+
+[ PHEO ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.600 6
+ HE1 HGR61 0.280 7
+ CE2 CG2R61 -0.600 8
+ HE2 HGR61 0.280 9
+ CZ CG2R61 0.400 10
+ OH OG312 -0.760 11
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ OH
+
+[ PHHZ ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ C6 CG2R61 0.240 10
+ N7 NG3N1 -0.740 11
+ H71 HGP1 0.480 12
+ N8 NG3N1 -0.740 13
+ H81 HGP1 0.380 14
+ H82 HGP1 0.380 15
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ C6 CE1
+ C6 CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ C6 N7
+ N7 H71
+ N7 N8
+ N8 H81
+ N8 H82
+
+[ PHMK ]
+ [ atoms ]
+ C1 CG331 -0.230 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG2O5 0.360 4
+ O2 OG2D3 -0.470 5
+ C3 CG2R61 0.070 6
+ C4 CG2R61 -0.115 7
+ H4 HGR61 0.115 8
+ C5 CG2R61 -0.115 9
+ H5 HGR61 0.115 10
+ C6 CG2R61 -0.115 11
+ H6 HGR61 0.115 12
+ C7 CG2R61 -0.115 13
+ H7 HGR61 0.115 14
+ C8 CG2R61 -0.115 15
+ H8 HGR61 0.115 16
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 O2
+ C2 C3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 C7
+ C7 H7
+ C7 C8
+ C8 H8
+ C8 C3
+ [ impropers ]
+ C2 C3 C1 O2
+
+[ PIP ]
+ [ atoms ]
+ N1 NG3P2 -0.400 0
+ H11 HGP2 0.320 1
+ H12 HGP2 0.320 2
+ C2 CG324 0.200 3
+ H21 HGA2 0.090 4
+ H22 HGA2 0.090 5
+ C6 CG324 0.200 6
+ H61 HGA2 0.090 7
+ H62 HGA2 0.090 8
+ C3 CG321 -0.180 9
+ H31 HGA2 0.090 10
+ H32 HGA2 0.090 11
+ C4 CG321 -0.180 12
+ H41 HGA2 0.090 13
+ H42 HGA2 0.090 14
+ C5 CG321 -0.180 15
+ H51 HGA2 0.090 16
+ H52 HGA2 0.090 17
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 N1
+ N1 H11
+ N1 H12
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+
+[ PIP1 ]
+ [ atoms ]
+ C1 CG334 0.150 0
+ H1A HGA3 0.090 1
+ H1B HGA3 0.090 2
+ H1C HGA3 0.090 3
+ N1 NG3P1 -0.400 4
+ HNA HGP2 0.320 5
+ C12 CG324 0.150 6
+ H12A HGA2 0.090 7
+ H12B HGA2 0.090 8
+ C16 CG324 0.150 9
+ H16A HGA2 0.090 10
+ H16B HGA2 0.090 11
+ C13 CG321 -0.180 12
+ H13A HGA2 0.090 13
+ H13B HGA2 0.090 14
+ C14 CG321 -0.180 15
+ H14A HGA2 0.090 16
+ H14B HGA2 0.090 17
+ C15 CG321 -0.180 18
+ H15A HGA2 0.090 19
+ H15B HGA2 0.090 20
+ [ bonds ]
+ C1 H1A
+ C1 H1B
+ C1 H1C
+ C1 N1
+ N1 HNA
+ N1 C16
+ N1 C12
+ C12 H12A
+ C12 H12B
+ C12 C13
+ C13 H13A
+ C13 H13B
+ C13 C14
+ C14 H14A
+ C14 H14B
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+
+[ PIP2 ]
+ [ atoms ]
+ C1 CG334 0.150 0
+ H1A HGA3 0.090 1
+ H1B HGA3 0.090 2
+ H1C HGA3 0.090 3
+ N1 NG3P1 -0.400 4
+ HNA HGP2 0.320 5
+ C12 CG324 0.150 6
+ H12A HGA2 0.090 7
+ H12B HGA2 0.090 8
+ C16 CG324 0.150 9
+ H16A HGA2 0.090 10
+ H16B HGA2 0.090 11
+ C13 CG321 -0.180 12
+ H13A HGA2 0.090 13
+ H13B HGA2 0.090 14
+ C14 CG321 -0.180 15
+ H14A HGA2 0.090 16
+ H14B HGA2 0.090 17
+ C15 CG321 -0.180 18
+ H15A HGA2 0.090 19
+ H15B HGA2 0.090 20
+ [ bonds ]
+ C1 H1A
+ C1 H1B
+ C1 H1C
+ C1 N1
+ N1 HNA
+ N1 C16
+ N1 C12
+ C12 H12A
+ C12 H12B
+ C12 C13
+ C13 H13A
+ C13 H13B
+ C13 C14
+ C14 H14A
+ C14 H14B
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+
+[ PIP3 ]
+ [ atoms ]
+ C1 CG334 0.150 0
+ H1A HGA3 0.090 1
+ H1B HGA3 0.090 2
+ H1C HGA3 0.090 3
+ N1 NG3P1 -0.400 4
+ HNA HGP2 0.320 5
+ C12 CG324 0.150 6
+ H12A HGA2 0.090 7
+ H12B HGA2 0.090 8
+ C16 CG324 0.150 9
+ H16A HGA2 0.090 10
+ H16B HGA2 0.090 11
+ C13 CG311 0.140 12
+ H13 HGA1 0.090 13
+ O3 OG311 -0.650 14
+ HO3 HGP1 0.420 15
+ C14 CG321 -0.180 16
+ H14A HGA2 0.090 17
+ H14B HGA2 0.090 18
+ C15 CG321 -0.180 19
+ H15A HGA2 0.090 20
+ H15B HGA2 0.090 21
+ [ bonds ]
+ C1 H1A
+ C1 H1B
+ C1 H1C
+ C1 N1
+ N1 HNA
+ N1 C16
+ N1 C12
+ C12 H12A
+ C12 H12B
+ C12 C13
+ C13 H13
+ C13 O3
+ O3 HO3
+ C13 C14
+ C14 H14A
+ C14 H14B
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+
+[ PMHA ]
+ [ atoms ]
+ C1 CG2R61 0.100 0
+ C2 CG2R61 -0.140 1
+ H3 HGR62 0.220 2
+ C4 CG2R61 0.100 3
+ CL5 CLGR1 -0.180 4
+ C6 CG2R61 -0.160 5
+ H7 HGR62 0.190 6
+ C8 CG2R61 -0.120 7
+ H9 HGR61 0.120 8
+ C10 CG2R61 -0.160 9
+ H11 HGR61 0.190 10
+ N12 NG2S1 -0.470 11
+ H13 HGP1 0.310 12
+ C14 CG2O1 0.510 13
+ O15 OG2D1 -0.510 14
+ C16 CG321 -0.180 15
+ H17 HGA2 0.090 16
+ H18 HGA2 0.090 17
+ C19 CG321 -0.180 18
+ H20 HGA2 0.090 19
+ H21 HGA2 0.090 20
+ C22 CG2O1 0.580 21
+ O23 OG2D1 -0.490 22
+ N24 NG2S1 -0.340 23
+ H25 HGP1 0.310 24
+ N26 NG2D1 -0.310 25
+ C27 CG2DC1 -0.240 26
+ H28 HGA4 0.240 27
+ C29 CG2R61 0.250 28
+ C30 CG2R61 0.000 29
+ C31 CG2R61 0.000 30
+ C32 CG2R61 -0.115 31
+ H33 HGR61 0.115 32
+ C34 CG2R61 0.000 33
+ C35 CG2R61 0.000 34
+ C36 CG2R61 -0.115 35
+ H37 HGR61 0.115 36
+ C38 CG2R61 -0.115 37
+ H39 HGR61 0.115 38
+ C40 CG2R61 -0.115 39
+ H41 HGR61 0.115 40
+ C42 CG2R61 -0.115 41
+ H43 HGR61 0.115 42
+ C44 CG2R61 -0.115 43
+ H45 HGR61 0.115 44
+ C46 CG2R61 -0.115 45
+ H47 HGR61 0.115 46
+ C48 CG2R61 -0.115 47
+ H49 HGR61 0.115 48
+ C50 CG2R61 -0.115 49
+ H51 HGR61 0.115 50
+ [ bonds ]
+ C1 C2
+ C2 H3
+ C2 C4
+ C4 CL5
+ C4 C6
+ C6 H7
+ C6 C8
+ C8 H9
+ C8 C10
+ C10 H11
+ C10 C1
+ C1 N12
+ N12 H13
+ N12 C14
+ C14 O15
+ C14 C16
+ C16 H17
+ C16 H18
+ C16 C19
+ C19 H20
+ C19 H21
+ C19 C22
+ C22 O23
+ C22 N24
+ N24 H25
+ N24 N26
+ N26 C27
+ C27 H28
+ C27 C29
+ C29 C30
+ C30 C31
+ C31 C32
+ C32 H33
+ C32 C34
+ C34 C35
+ C35 C29
+ C30 C50
+ C50 H51
+ C50 C48
+ C48 H49
+ C48 C46
+ C31 C44
+ C44 H45
+ C44 C46
+ C46 H47
+ C34 C42
+ C42 H43
+ C42 C40
+ C40 H41
+ C40 C38
+ C35 C36
+ C36 H37
+ C36 C38
+ C38 H39
+ [ impropers ]
+ C14 C16 N12 O15
+ C22 C19 N24 O23
+ C27 C29 N26 H28
+
+[ PMPE ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL2 0.130 4
+ H12A HAL2 0.090 5
+ H12B HAL2 0.090 6
+ C11 CTL2 -0.080 7
+ H11A HAL2 0.090 8
+ H11B HAL2 0.090 9
+ P PL 1.500 10
+ O13 O2L -0.780 11
+ O14 O2L -0.780 12
+ O11 OSLP -0.570 13
+ O12 OSLP -0.570 14
+ C1 CTL2 -0.080 15
+ HA HAL2 0.090 16
+ HB HAL2 0.090 17
+ C2 CTL1 0.170 18
+ HS HAL1 0.090 19
+ O21 OSL -0.490 20
+ C21 CL 0.900 21
+ O22 OBL -0.630 22
+ C22 CTL2 -0.220 23
+ H2R HAL2 0.090 24
+ H2S HAL2 0.090 25
+ C3 CTL2 0.080 26
+ HX HAL2 0.090 27
+ HY HAL2 0.090 28
+ O31 OSL -0.490 29
+ C31 CL 0.900 30
+ O32 OBL -0.630 31
+ C32 CTL2 -0.220 32
+ H2X HAL2 0.090 33
+ H2Y HAL2 0.090 34
+ C23 CTL2 -0.180 35
+ H3R HAL2 0.090 36
+ H3S HAL2 0.090 37
+ C24 CTL2 -0.180 38
+ H4R HAL2 0.090 39
+ H4S HAL2 0.090 40
+ C25 CTL2 -0.180 41
+ H5R HAL2 0.090 42
+ H5S HAL2 0.090 43
+ C26 CTL2 -0.180 44
+ H6R HAL2 0.090 45
+ H6S HAL2 0.090 46
+ C27 CTL2 -0.180 47
+ H7R HAL2 0.090 48
+ H7S HAL2 0.090 49
+ C28 CTL2 -0.180 50
+ H8R HAL2 0.090 51
+ H8S HAL2 0.090 52
+ C29 CG3RC1 -0.090 53
+ H9R HGA1 0.090 54
+ C217 CG3C31 -0.180 55
+ H17R HGA2 0.090 56
+ H17S HGA2 0.090 57
+ C210 CG3RC1 -0.090 58
+ H10R HGA1 0.090 59
+ C211 CTL2 -0.180 60
+ H11R HAL2 0.090 61
+ H11S HAL2 0.090 62
+ C212 CTL2 -0.180 63
+ H12R HAL2 0.090 64
+ H12S HAL2 0.090 65
+ C213 CTL2 -0.180 66
+ H13R HAL2 0.090 67
+ H13S HAL2 0.090 68
+ C214 CTL2 -0.180 69
+ H14R HAL2 0.090 70
+ H14S HAL2 0.090 71
+ C215 CTL2 -0.180 72
+ H15R HAL2 0.090 73
+ H15S HAL2 0.090 74
+ C216 CTL3 -0.270 75
+ H16R HAL3 0.090 76
+ H16S HAL3 0.090 77
+ H16T HAL3 0.090 78
+ C33 CTL2 -0.180 79
+ H3X HAL2 0.090 80
+ H3Y HAL2 0.090 81
+ C34 CTL2 -0.180 82
+ H4X HAL2 0.090 83
+ H4Y HAL2 0.090 84
+ C35 CTL2 -0.180 85
+ H5X HAL2 0.090 86
+ H5Y HAL2 0.090 87
+ C36 CTL2 -0.180 88
+ H6X HAL2 0.090 89
+ H6Y HAL2 0.090 90
+ C37 CTL2 -0.180 91
+ H7X HAL2 0.090 92
+ H7Y HAL2 0.090 93
+ C38 CTL2 -0.180 94
+ H8X HAL2 0.090 95
+ H8Y HAL2 0.090 96
+ C39 CTL2 -0.180 97
+ H9X HAL2 0.090 98
+ H9Y HAL2 0.090 99
+ C310 CTL2 -0.180 100
+ H10X HAL2 0.090 101
+ H10Y HAL2 0.090 102
+ C311 CTL2 -0.180 103
+ H11X HAL2 0.090 104
+ H11Y HAL2 0.090 105
+ C312 CTL2 -0.180 106
+ H12X HAL2 0.090 107
+ H12Y HAL2 0.090 108
+ C313 CTL2 -0.180 109
+ H13X HAL2 0.090 110
+ H13Y HAL2 0.090 111
+ C314 CTL2 -0.180 112
+ H14X HAL2 0.090 113
+ H14Y HAL2 0.090 114
+ C315 CTL2 -0.180 115
+ H15X HAL2 0.090 116
+ H15Y HAL2 0.090 117
+ C316 CTL3 -0.270 118
+ H16X HAL3 0.090 119
+ H16Y HAL3 0.090 120
+ H16Z HAL3 0.090 121
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 C210
+ C29 C217
+ C210 H10R
+ C210 C211
+ C210 C217
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ C217 H17R
+ C217 H17S
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ PMPG ]
+ [ atoms ]
+ C13 CTL2 0.050 0
+ H13A HAL2 0.090 1
+ H13B HAL2 0.090 2
+ OC3 OHL -0.660 3
+ HO3 HOL 0.430 4
+ C12 CTL1 0.140 5
+ H12A HAL1 0.090 6
+ OC2 OHL -0.660 7
+ HO2 HOL 0.430 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O11 OSLP -0.570 15
+ O12 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CG3RC1 -0.090 55
+ H9R HGA1 0.090 56
+ C217 CG3C31 -0.180 57
+ H17R HGA2 0.090 58
+ H17S HGA2 0.090 59
+ C210 CG3RC1 -0.090 60
+ H10R HGA1 0.090 61
+ C211 CTL2 -0.180 62
+ H11R HAL2 0.090 63
+ H11S HAL2 0.090 64
+ C212 CTL2 -0.180 65
+ H12R HAL2 0.090 66
+ H12S HAL2 0.090 67
+ C213 CTL2 -0.180 68
+ H13R HAL2 0.090 69
+ H13S HAL2 0.090 70
+ C214 CTL2 -0.180 71
+ H14R HAL2 0.090 72
+ H14S HAL2 0.090 73
+ C215 CTL2 -0.180 74
+ H15R HAL2 0.090 75
+ H15S HAL2 0.090 76
+ C216 CTL3 -0.270 77
+ H16R HAL3 0.090 78
+ H16S HAL3 0.090 79
+ H16T HAL3 0.090 80
+ C33 CTL2 -0.180 81
+ H3X HAL2 0.090 82
+ H3Y HAL2 0.090 83
+ C34 CTL2 -0.180 84
+ H4X HAL2 0.090 85
+ H4Y HAL2 0.090 86
+ C35 CTL2 -0.180 87
+ H5X HAL2 0.090 88
+ H5Y HAL2 0.090 89
+ C36 CTL2 -0.180 90
+ H6X HAL2 0.090 91
+ H6Y HAL2 0.090 92
+ C37 CTL2 -0.180 93
+ H7X HAL2 0.090 94
+ H7Y HAL2 0.090 95
+ C38 CTL2 -0.180 96
+ H8X HAL2 0.090 97
+ H8Y HAL2 0.090 98
+ C39 CTL2 -0.180 99
+ H9X HAL2 0.090 100
+ H9Y HAL2 0.090 101
+ C310 CTL2 -0.180 102
+ H10X HAL2 0.090 103
+ H10Y HAL2 0.090 104
+ C311 CTL2 -0.180 105
+ H11X HAL2 0.090 106
+ H11Y HAL2 0.090 107
+ C312 CTL2 -0.180 108
+ H12X HAL2 0.090 109
+ H12Y HAL2 0.090 110
+ C313 CTL2 -0.180 111
+ H13X HAL2 0.090 112
+ H13Y HAL2 0.090 113
+ C314 CTL2 -0.180 114
+ H14X HAL2 0.090 115
+ H14Y HAL2 0.090 116
+ C315 CTL2 -0.180 117
+ H15X HAL2 0.090 118
+ H15Y HAL2 0.090 119
+ C316 CTL3 -0.270 120
+ H16X HAL3 0.090 121
+ H16Y HAL3 0.090 122
+ H16Z HAL3 0.090 123
+ [ bonds ]
+ HO3 OC3
+ OC3 C13
+ C13 H13A
+ C13 H13B
+ C13 C12
+ HO2 OC2
+ OC2 C12
+ C12 H12A
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 C210
+ C29 C217
+ C210 H10R
+ C210 C211
+ C210 C217
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ C217 H17R
+ C217 H17S
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ PMSM ]
+ [ atoms ]
+ C3 CG331 -0.030 0
+ H31 HGA3 0.090 1
+ H32 HGA3 0.090 2
+ H33 HGA3 0.090 3
+ S1 SG3O2 0.420 4
+ O11 OG2P1 -0.360 5
+ O12 OG2P1 -0.360 6
+ N2 NG311 -0.480 7
+ H21 HGP1 0.330 8
+ C4 CG2R61 0.210 9
+ C51 CG2R61 -0.115 10
+ H51 HGR61 0.115 11
+ C52 CG2R61 -0.115 12
+ H52 HGR61 0.115 13
+ C61 CG2R61 -0.115 14
+ H61 HGR61 0.115 15
+ C62 CG2R61 -0.115 16
+ H62 HGR61 0.115 17
+ C7 CG2R61 -0.115 18
+ H7 HGR61 0.115 19
+ [ bonds ]
+ C3 S1
+ S1 N2
+ S1 O11
+ S1 O12
+ N2 H21
+ N2 C4
+ C3 H31
+ C3 H32
+ C3 H33
+ C4 C51
+ C4 C52
+ C51 C61
+ C52 C62
+ C7 C61
+ C7 C62
+ C51 H51
+ C52 H52
+ C61 H61
+ C62 H62
+ C7 H7
+
+[ PMST ]
+ [ atoms ]
+ S1 SG3O2 0.240 0
+ C2 CG331 0.050 1
+ H21 HGA3 0.090 2
+ H22 HGA3 0.090 3
+ H23 HGA3 0.090 4
+ O11 OG2P1 -0.320 5
+ O12 OG2P1 -0.320 6
+ O3 OG303 -0.240 7
+ CZ CG2R61 0.320 8
+ CE1 CG2R61 -0.115 9
+ HE1 HGR61 0.115 10
+ CE2 CG2R61 -0.115 11
+ HE2 HGR61 0.115 12
+ CD1 CG2R61 -0.115 13
+ HD1 HGR61 0.115 14
+ CD2 CG2R61 -0.115 15
+ HD2 HGR61 0.115 16
+ CG CG2R61 -0.115 17
+ HG HGR61 0.115 18
+ [ bonds ]
+ S1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+ S1 O11
+ S1 O12
+ S1 O3
+ O3 CZ
+ CZ CE1
+ CZ CE2
+ CE1 HE1
+ CE2 HE2
+ CE1 CD1
+ CE2 CD2
+ CD1 HD1
+ CD2 HD2
+ CD1 CG
+ CD2 CG
+ CG HG
+
+[ PNH2 ]
+ [ atoms ]
+ N NG3P2 -0.070 0
+ HN1 HGP2 0.240 1
+ HN2 HGP2 0.240 2
+ CD CG3C54 0.160 3
+ CB CG3C52 -0.180 4
+ CG CG3C52 -0.180 5
+ CA CG3C53 0.160 6
+ C CG2O1 0.510 7
+ O OG2D1 -0.510 8
+ HA HGA1 0.090 9
+ HB1 HGA2 0.090 10
+ HB2 HGA2 0.090 11
+ HG1 HGA2 0.090 12
+ HG2 HGA2 0.090 13
+ HD1 HGA2 0.090 14
+ HD2 HGA2 0.090 15
+ NT NG2S2 -0.620 16
+ HT1 HGP1 0.310 17
+ HT2 HGP1 0.310 18
+ [ bonds ]
+ HN1 N
+ HN2 N
+ N CA
+ CA CB
+ CB CG
+ CG CD
+ CD N
+ HA CA
+ HG1 CG
+ HG2 CG
+ HD1 CD
+ HD2 CD
+ HB1 CB
+ HB2 CB
+ C CA
+ C NT
+ NT HT1
+ NT HT2
+ C O
+ [ impropers ]
+ C CA NT O
+
+[ PNPO ]
+ [ atoms ]
+ C1 CG2R61 -0.180 0
+ H1 HGR61 0.160 1
+ C2 CG2R61 -0.115 2
+ H2 HGR61 0.115 3
+ C3 CG2R61 0.110 4
+ O3 OG311 -0.530 5
+ H3 HGP1 0.420 6
+ C4 CG2R61 -0.115 7
+ H4 HGR61 0.115 8
+ C5 CG2R61 -0.180 9
+ H5 HGR61 0.160 10
+ C6 CG2R61 0.320 11
+ N6 NG2O1 0.400 12
+ O6A OG2N1 -0.340 13
+ O6B OG2N1 -0.340 14
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 O3
+ O3 H3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 C1
+ C6 N6
+ N6 O6A
+ N6 O6B
+
+[ PNTM ]
+ [ atoms ]
+ C1 CG321 -0.180 0
+ H2 HGA2 0.090 1
+ H3 HGA2 0.090 2
+ C4 CG321 -0.180 3
+ H5 HGA2 0.090 4
+ H6 HGA2 0.090 5
+ C7 CG321 -0.180 6
+ H8 HGA2 0.090 7
+ H9 HGA2 0.090 8
+ C10 CG321 -0.010 9
+ H11 HGA2 0.090 10
+ H12 HGA2 0.090 11
+ O13 OG301 -0.390 12
+ C14 CG2R61 0.220 13
+ C15 CG2R61 -0.115 14
+ H16 HGR61 0.115 15
+ C17 CG2R61 -0.115 16
+ H18 HGR61 0.115 17
+ C19 CG2R61 -0.115 18
+ H20 HGR61 0.115 19
+ C21 CG2R61 -0.115 20
+ H22 HGR61 0.115 21
+ C23 CG2R61 0.190 22
+ C24 CG2N2 0.730 23
+ N25 NG2P1 -0.600 24
+ H26 HGP2 0.320 25
+ H27 HGP2 0.320 26
+ N28 NG2P1 -0.600 27
+ H29 HGP2 0.320 28
+ H30 HGP2 0.320 29
+ C31 CG321 -0.010 30
+ H32 HGA2 0.090 31
+ H33 HGA2 0.090 32
+ O34 OG301 -0.390 33
+ C35 CG2R61 0.220 34
+ C36 CG2R61 -0.115 35
+ H37 HGR61 0.115 36
+ C38 CG2R61 -0.115 37
+ H39 HGR61 0.115 38
+ C40 CG2R61 -0.115 39
+ H41 HGR61 0.115 40
+ C42 CG2R61 -0.115 41
+ H43 HGR61 0.115 42
+ C44 CG2R61 0.190 43
+ C45 CG2N2 0.730 44
+ N46 NG2P1 -0.600 45
+ H47 HGP2 0.320 46
+ H48 HGP2 0.320 47
+ N49 NG2P1 -0.600 48
+ H50 HGP2 0.320 49
+ H51 HGP2 0.320 50
+ [ bonds ]
+ C1 H2
+ C1 H3
+ C1 C4
+ C4 H5
+ C4 H6
+ C1 C7
+ C7 H8
+ C7 H9
+ C4 C10
+ C10 H11
+ C10 H12
+ C10 O13
+ O13 C14
+ C14 C15
+ C15 H16
+ C15 C17
+ C17 H18
+ C14 C19
+ C19 H20
+ C19 C21
+ C21 H22
+ C17 C23
+ C21 C23
+ C23 C24
+ C24 N25
+ C24 N28
+ N25 H26
+ N25 H27
+ N28 H29
+ N28 H30
+ C7 C31
+ C31 H32
+ C31 H33
+ C31 O34
+ O34 C35
+ C35 C36
+ C36 H37
+ C36 C38
+ C38 H39
+ C35 C40
+ C40 H41
+ C40 C42
+ C42 H43
+ C38 C44
+ C42 C44
+ C44 C45
+ C45 N46
+ C45 N49
+ N46 H47
+ N46 H48
+ N49 H50
+ N49 H51
+ [ impropers ]
+ C24 N25 N28 C23
+ C45 N46 N49 C44
+
+[ POPA ]
+ [ atoms ]
+ P PL 1.500 0
+ O13 O2L -0.820 1
+ O14 O2L -0.820 2
+ O12 OHL -0.680 3
+ H12 HOL 0.340 4
+ O11 OSLP -0.620 5
+ C1 CTL2 -0.080 6
+ HA HAL2 0.090 7
+ HB HAL2 0.090 8
+ C2 CTL1 0.170 9
+ HS HAL1 0.090 10
+ O21 OSL -0.490 11
+ C21 CL 0.900 12
+ O22 OBL -0.630 13
+ C22 CTL2 -0.220 14
+ H2R HAL2 0.090 15
+ H2S HAL2 0.090 16
+ C3 CTL2 0.080 17
+ HX HAL2 0.090 18
+ HY HAL2 0.090 19
+ O31 OSL -0.490 20
+ C31 CL 0.900 21
+ O32 OBL -0.630 22
+ C32 CTL2 -0.220 23
+ H2X HAL2 0.090 24
+ H2Y HAL2 0.090 25
+ C23 CTL2 -0.180 26
+ H3R HAL2 0.090 27
+ H3S HAL2 0.090 28
+ C24 CTL2 -0.180 29
+ H4R HAL2 0.090 30
+ H4S HAL2 0.090 31
+ C25 CTL2 -0.180 32
+ H5R HAL2 0.090 33
+ H5S HAL2 0.090 34
+ C26 CTL2 -0.180 35
+ H6R HAL2 0.090 36
+ H6S HAL2 0.090 37
+ C27 CTL2 -0.180 38
+ H7R HAL2 0.090 39
+ H7S HAL2 0.090 40
+ C28 CTL2 -0.180 41
+ H8R HAL2 0.090 42
+ H8S HAL2 0.090 43
+ C29 CEL1 -0.150 44
+ H91 HEL1 0.150 45
+ C210 CEL1 -0.150 46
+ H101 HEL1 0.150 47
+ C211 CTL2 -0.180 48
+ H11R HAL2 0.090 49
+ H11S HAL2 0.090 50
+ C212 CTL2 -0.180 51
+ H12R HAL2 0.090 52
+ H12S HAL2 0.090 53
+ C213 CTL2 -0.180 54
+ H13R HAL2 0.090 55
+ H13S HAL2 0.090 56
+ C214 CTL2 -0.180 57
+ H14R HAL2 0.090 58
+ H14S HAL2 0.090 59
+ C215 CTL2 -0.180 60
+ H15R HAL2 0.090 61
+ H15S HAL2 0.090 62
+ C216 CTL2 -0.180 63
+ H16R HAL2 0.090 64
+ H16S HAL2 0.090 65
+ C217 CTL2 -0.180 66
+ H17R HAL2 0.090 67
+ H17S HAL2 0.090 68
+ C218 CTL3 -0.270 69
+ H18R HAL3 0.090 70
+ H18S HAL3 0.090 71
+ H18T HAL3 0.090 72
+ C33 CTL2 -0.180 73
+ H3X HAL2 0.090 74
+ H3Y HAL2 0.090 75
+ C34 CTL2 -0.180 76
+ H4X HAL2 0.090 77
+ H4Y HAL2 0.090 78
+ C35 CTL2 -0.180 79
+ H5X HAL2 0.090 80
+ H5Y HAL2 0.090 81
+ C36 CTL2 -0.180 82
+ H6X HAL2 0.090 83
+ H6Y HAL2 0.090 84
+ C37 CTL2 -0.180 85
+ H7X HAL2 0.090 86
+ H7Y HAL2 0.090 87
+ C38 CTL2 -0.180 88
+ H8X HAL2 0.090 89
+ H8Y HAL2 0.090 90
+ C39 CTL2 -0.180 91
+ H9X HAL2 0.090 92
+ H9Y HAL2 0.090 93
+ C310 CTL2 -0.180 94
+ H10X HAL2 0.090 95
+ H10Y HAL2 0.090 96
+ C311 CTL2 -0.180 97
+ H11X HAL2 0.090 98
+ H11Y HAL2 0.090 99
+ C312 CTL2 -0.180 100
+ H12X HAL2 0.090 101
+ H12Y HAL2 0.090 102
+ C313 CTL2 -0.180 103
+ H13X HAL2 0.090 104
+ H13Y HAL2 0.090 105
+ C314 CTL2 -0.180 106
+ H14X HAL2 0.090 107
+ H14Y HAL2 0.090 108
+ C315 CTL2 -0.180 109
+ H15X HAL2 0.090 110
+ H15Y HAL2 0.090 111
+ C316 CTL3 -0.270 112
+ H16X HAL3 0.090 113
+ H16Y HAL3 0.090 114
+ H16Z HAL3 0.090 115
+ [ bonds ]
+ O12 P
+ P O11
+ P O13
+ P O14
+ O12 H12
+ O11 C1
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H91
+ C210 H101
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C29 C210
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ POPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C12 CTL2 -0.100 1
+ H12A HL 0.250 2
+ H12B HL 0.250 3
+ C13 CTL5 -0.350 4
+ H13A HL 0.250 5
+ H13B HL 0.250 6
+ H13C HL 0.250 7
+ C14 CTL5 -0.350 8
+ H14A HL 0.250 9
+ H14B HL 0.250 10
+ H14C HL 0.250 11
+ C15 CTL5 -0.350 12
+ H15A HL 0.250 13
+ H15B HL 0.250 14
+ H15C HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O12 OSLP -0.570 22
+ O11 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CTL2 -0.180 50
+ H5R HAL2 0.090 51
+ H5S HAL2 0.090 52
+ C26 CTL2 -0.180 53
+ H6R HAL2 0.090 54
+ H6S HAL2 0.090 55
+ C27 CTL2 -0.180 56
+ H7R HAL2 0.090 57
+ H7S HAL2 0.090 58
+ C28 CTL2 -0.180 59
+ H8R HAL2 0.090 60
+ H8S HAL2 0.090 61
+ C29 CEL1 -0.150 62
+ H91 HEL1 0.150 63
+ C210 CEL1 -0.150 64
+ H101 HEL1 0.150 65
+ C211 CTL2 -0.180 66
+ H11R HAL2 0.090 67
+ H11S HAL2 0.090 68
+ C212 CTL2 -0.180 69
+ H12R HAL2 0.090 70
+ H12S HAL2 0.090 71
+ C213 CTL2 -0.180 72
+ H13R HAL2 0.090 73
+ H13S HAL2 0.090 74
+ C214 CTL2 -0.180 75
+ H14R HAL2 0.090 76
+ H14S HAL2 0.090 77
+ C215 CTL2 -0.180 78
+ H15R HAL2 0.090 79
+ H15S HAL2 0.090 80
+ C216 CTL2 -0.180 81
+ H16R HAL2 0.090 82
+ H16S HAL2 0.090 83
+ C217 CTL2 -0.180 84
+ H17R HAL2 0.090 85
+ H17S HAL2 0.090 86
+ C218 CTL3 -0.270 87
+ H18R HAL3 0.090 88
+ H18S HAL3 0.090 89
+ H18T HAL3 0.090 90
+ C33 CTL2 -0.180 91
+ H3X HAL2 0.090 92
+ H3Y HAL2 0.090 93
+ C34 CTL2 -0.180 94
+ H4X HAL2 0.090 95
+ H4Y HAL2 0.090 96
+ C35 CTL2 -0.180 97
+ H5X HAL2 0.090 98
+ H5Y HAL2 0.090 99
+ C36 CTL2 -0.180 100
+ H6X HAL2 0.090 101
+ H6Y HAL2 0.090 102
+ C37 CTL2 -0.180 103
+ H7X HAL2 0.090 104
+ H7Y HAL2 0.090 105
+ C38 CTL2 -0.180 106
+ H8X HAL2 0.090 107
+ H8Y HAL2 0.090 108
+ C39 CTL2 -0.180 109
+ H9X HAL2 0.090 110
+ H9Y HAL2 0.090 111
+ C310 CTL2 -0.180 112
+ H10X HAL2 0.090 113
+ H10Y HAL2 0.090 114
+ C311 CTL2 -0.180 115
+ H11X HAL2 0.090 116
+ H11Y HAL2 0.090 117
+ C312 CTL2 -0.180 118
+ H12X HAL2 0.090 119
+ H12Y HAL2 0.090 120
+ C313 CTL2 -0.180 121
+ H13X HAL2 0.090 122
+ H13Y HAL2 0.090 123
+ C314 CTL2 -0.180 124
+ H14X HAL2 0.090 125
+ H14Y HAL2 0.090 126
+ C315 CTL2 -0.180 127
+ H15X HAL2 0.090 128
+ H15Y HAL2 0.090 129
+ C316 CTL3 -0.270 130
+ H16X HAL3 0.090 131
+ H16Y HAL3 0.090 132
+ H16Z HAL3 0.090 133
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H91
+ C210 H101
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C29 C210
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ POPE ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL2 0.130 4
+ H12A HAL2 0.090 5
+ H12B HAL2 0.090 6
+ C11 CTL2 -0.080 7
+ H11A HAL2 0.090 8
+ H11B HAL2 0.090 9
+ P PL 1.500 10
+ O13 O2L -0.780 11
+ O14 O2L -0.780 12
+ O11 OSLP -0.570 13
+ O12 OSLP -0.570 14
+ C1 CTL2 -0.080 15
+ HA HAL2 0.090 16
+ HB HAL2 0.090 17
+ C2 CTL1 0.170 18
+ HS HAL1 0.090 19
+ O21 OSL -0.490 20
+ C21 CL 0.900 21
+ O22 OBL -0.630 22
+ C22 CTL2 -0.220 23
+ H2R HAL2 0.090 24
+ H2S HAL2 0.090 25
+ C3 CTL2 0.080 26
+ HX HAL2 0.090 27
+ HY HAL2 0.090 28
+ O31 OSL -0.490 29
+ C31 CL 0.900 30
+ O32 OBL -0.630 31
+ C32 CTL2 -0.220 32
+ H2X HAL2 0.090 33
+ H2Y HAL2 0.090 34
+ C23 CTL2 -0.180 35
+ H3R HAL2 0.090 36
+ H3S HAL2 0.090 37
+ C24 CTL2 -0.180 38
+ H4R HAL2 0.090 39
+ H4S HAL2 0.090 40
+ C25 CTL2 -0.180 41
+ H5R HAL2 0.090 42
+ H5S HAL2 0.090 43
+ C26 CTL2 -0.180 44
+ H6R HAL2 0.090 45
+ H6S HAL2 0.090 46
+ C27 CTL2 -0.180 47
+ H7R HAL2 0.090 48
+ H7S HAL2 0.090 49
+ C28 CTL2 -0.180 50
+ H8R HAL2 0.090 51
+ H8S HAL2 0.090 52
+ C29 CEL1 -0.150 53
+ H91 HEL1 0.150 54
+ C210 CEL1 -0.150 55
+ H101 HEL1 0.150 56
+ C211 CTL2 -0.180 57
+ H11R HAL2 0.090 58
+ H11S HAL2 0.090 59
+ C212 CTL2 -0.180 60
+ H12R HAL2 0.090 61
+ H12S HAL2 0.090 62
+ C213 CTL2 -0.180 63
+ H13R HAL2 0.090 64
+ H13S HAL2 0.090 65
+ C214 CTL2 -0.180 66
+ H14R HAL2 0.090 67
+ H14S HAL2 0.090 68
+ C215 CTL2 -0.180 69
+ H15R HAL2 0.090 70
+ H15S HAL2 0.090 71
+ C216 CTL2 -0.180 72
+ H16R HAL2 0.090 73
+ H16S HAL2 0.090 74
+ C217 CTL2 -0.180 75
+ H17R HAL2 0.090 76
+ H17S HAL2 0.090 77
+ C218 CTL3 -0.270 78
+ H18R HAL3 0.090 79
+ H18S HAL3 0.090 80
+ H18T HAL3 0.090 81
+ C33 CTL2 -0.180 82
+ H3X HAL2 0.090 83
+ H3Y HAL2 0.090 84
+ C34 CTL2 -0.180 85
+ H4X HAL2 0.090 86
+ H4Y HAL2 0.090 87
+ C35 CTL2 -0.180 88
+ H5X HAL2 0.090 89
+ H5Y HAL2 0.090 90
+ C36 CTL2 -0.180 91
+ H6X HAL2 0.090 92
+ H6Y HAL2 0.090 93
+ C37 CTL2 -0.180 94
+ H7X HAL2 0.090 95
+ H7Y HAL2 0.090 96
+ C38 CTL2 -0.180 97
+ H8X HAL2 0.090 98
+ H8Y HAL2 0.090 99
+ C39 CTL2 -0.180 100
+ H9X HAL2 0.090 101
+ H9Y HAL2 0.090 102
+ C310 CTL2 -0.180 103
+ H10X HAL2 0.090 104
+ H10Y HAL2 0.090 105
+ C311 CTL2 -0.180 106
+ H11X HAL2 0.090 107
+ H11Y HAL2 0.090 108
+ C312 CTL2 -0.180 109
+ H12X HAL2 0.090 110
+ H12Y HAL2 0.090 111
+ C313 CTL2 -0.180 112
+ H13X HAL2 0.090 113
+ H13Y HAL2 0.090 114
+ C314 CTL2 -0.180 115
+ H14X HAL2 0.090 116
+ H14Y HAL2 0.090 117
+ C315 CTL2 -0.180 118
+ H15X HAL2 0.090 119
+ H15Y HAL2 0.090 120
+ C316 CTL3 -0.270 121
+ H16X HAL3 0.090 122
+ H16Y HAL3 0.090 123
+ H16Z HAL3 0.090 124
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H91
+ C210 H101
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C29 C210
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ POPG ]
+ [ atoms ]
+ C13 CTL2 0.050 0
+ H13A HAL2 0.090 1
+ H13B HAL2 0.090 2
+ OC3 OHL -0.650 3
+ HO3 HOL 0.420 4
+ C12 CTL1 0.140 5
+ H12A HAL1 0.090 6
+ OC2 OHL -0.650 7
+ HO2 HOL 0.420 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CEL1 -0.150 55
+ H91 HEL1 0.150 56
+ C210 CEL1 -0.150 57
+ H101 HEL1 0.150 58
+ C211 CTL2 -0.180 59
+ H11R HAL2 0.090 60
+ H11S HAL2 0.090 61
+ C212 CTL2 -0.180 62
+ H12R HAL2 0.090 63
+ H12S HAL2 0.090 64
+ C213 CTL2 -0.180 65
+ H13R HAL2 0.090 66
+ H13S HAL2 0.090 67
+ C214 CTL2 -0.180 68
+ H14R HAL2 0.090 69
+ H14S HAL2 0.090 70
+ C215 CTL2 -0.180 71
+ H15R HAL2 0.090 72
+ H15S HAL2 0.090 73
+ C216 CTL2 -0.180 74
+ H16R HAL2 0.090 75
+ H16S HAL2 0.090 76
+ C217 CTL2 -0.180 77
+ H17R HAL2 0.090 78
+ H17S HAL2 0.090 79
+ C218 CTL3 -0.270 80
+ H18R HAL3 0.090 81
+ H18S HAL3 0.090 82
+ H18T HAL3 0.090 83
+ C33 CTL2 -0.180 84
+ H3X HAL2 0.090 85
+ H3Y HAL2 0.090 86
+ C34 CTL2 -0.180 87
+ H4X HAL2 0.090 88
+ H4Y HAL2 0.090 89
+ C35 CTL2 -0.180 90
+ H5X HAL2 0.090 91
+ H5Y HAL2 0.090 92
+ C36 CTL2 -0.180 93
+ H6X HAL2 0.090 94
+ H6Y HAL2 0.090 95
+ C37 CTL2 -0.180 96
+ H7X HAL2 0.090 97
+ H7Y HAL2 0.090 98
+ C38 CTL2 -0.180 99
+ H8X HAL2 0.090 100
+ H8Y HAL2 0.090 101
+ C39 CTL2 -0.180 102
+ H9X HAL2 0.090 103
+ H9Y HAL2 0.090 104
+ C310 CTL2 -0.180 105
+ H10X HAL2 0.090 106
+ H10Y HAL2 0.090 107
+ C311 CTL2 -0.180 108
+ H11X HAL2 0.090 109
+ H11Y HAL2 0.090 110
+ C312 CTL2 -0.180 111
+ H12X HAL2 0.090 112
+ H12Y HAL2 0.090 113
+ C313 CTL2 -0.180 114
+ H13X HAL2 0.090 115
+ H13Y HAL2 0.090 116
+ C314 CTL2 -0.180 117
+ H14X HAL2 0.090 118
+ H14Y HAL2 0.090 119
+ C315 CTL2 -0.180 120
+ H15X HAL2 0.090 121
+ H15Y HAL2 0.090 122
+ C316 CTL3 -0.270 123
+ H16X HAL3 0.090 124
+ H16Y HAL3 0.090 125
+ H16Z HAL3 0.090 126
+ [ bonds ]
+ HO3 OC3
+ OC3 C13
+ C13 H13A
+ C13 H13B
+ C13 C12
+ HO2 OC2
+ OC2 C12
+ C12 H12A
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H91
+ C210 H101
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C29 C210
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ POPS ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL1 0.210 4
+ H12A HBL 0.100 5
+ C13 CCL 0.340 6
+ O13A OCL -0.670 7
+ O13B OCL -0.670 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O12 OSLP -0.570 15
+ O11 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CEL1 -0.150 55
+ H91 HEL1 0.150 56
+ C210 CEL1 -0.150 57
+ H101 HEL1 0.150 58
+ C211 CTL2 -0.180 59
+ H11R HAL2 0.090 60
+ H11S HAL2 0.090 61
+ C212 CTL2 -0.180 62
+ H12R HAL2 0.090 63
+ H12S HAL2 0.090 64
+ C213 CTL2 -0.180 65
+ H13R HAL2 0.090 66
+ H13S HAL2 0.090 67
+ C214 CTL2 -0.180 68
+ H14R HAL2 0.090 69
+ H14S HAL2 0.090 70
+ C215 CTL2 -0.180 71
+ H15R HAL2 0.090 72
+ H15S HAL2 0.090 73
+ C216 CTL2 -0.180 74
+ H16R HAL2 0.090 75
+ H16S HAL2 0.090 76
+ C217 CTL2 -0.180 77
+ H17R HAL2 0.090 78
+ H17S HAL2 0.090 79
+ C218 CTL3 -0.270 80
+ H18R HAL3 0.090 81
+ H18S HAL3 0.090 82
+ H18T HAL3 0.090 83
+ C33 CTL2 -0.180 84
+ H3X HAL2 0.090 85
+ H3Y HAL2 0.090 86
+ C34 CTL2 -0.180 87
+ H4X HAL2 0.090 88
+ H4Y HAL2 0.090 89
+ C35 CTL2 -0.180 90
+ H5X HAL2 0.090 91
+ H5Y HAL2 0.090 92
+ C36 CTL2 -0.180 93
+ H6X HAL2 0.090 94
+ H6Y HAL2 0.090 95
+ C37 CTL2 -0.180 96
+ H7X HAL2 0.090 97
+ H7Y HAL2 0.090 98
+ C38 CTL2 -0.180 99
+ H8X HAL2 0.090 100
+ H8Y HAL2 0.090 101
+ C39 CTL2 -0.180 102
+ H9X HAL2 0.090 103
+ H9Y HAL2 0.090 104
+ C310 CTL2 -0.180 105
+ H10X HAL2 0.090 106
+ H10Y HAL2 0.090 107
+ C311 CTL2 -0.180 108
+ H11X HAL2 0.090 109
+ H11Y HAL2 0.090 110
+ C312 CTL2 -0.180 111
+ H12X HAL2 0.090 112
+ H12Y HAL2 0.090 113
+ C313 CTL2 -0.180 114
+ H13X HAL2 0.090 115
+ H13Y HAL2 0.090 116
+ C314 CTL2 -0.180 117
+ H14X HAL2 0.090 118
+ H14Y HAL2 0.090 119
+ C315 CTL2 -0.180 120
+ H15X HAL2 0.090 121
+ H15Y HAL2 0.090 122
+ C316 CTL3 -0.270 123
+ H16X HAL3 0.090 124
+ H16Y HAL3 0.090 125
+ H16Z HAL3 0.090 126
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ O13B C13
+ C13 C12
+ C12 H12A
+ C12 C11
+ C1 O11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H91
+ C210 H101
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C13 O13A
+ C21 O22
+ C29 C210
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+ C13 C12 O13B O13A
+
+[ POT ]
+ [ atoms ]
+ POT POT 1.000 0
+
+[ PPH1 ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.210 6
+ HE1 HGR61 0.210 7
+ CE2 CG2R61 -0.210 8
+ HE2 HGR61 0.210 9
+ CZ CG2R61 -0.160 10
+ OH OG303 -0.360 11
+ P1 PG1 1.400 12
+ O2 OG311 -0.750 13
+ H2 HGP1 0.390 14
+ O3 OG2P1 -0.760 15
+ O4 OG2P1 -0.760 16
+ [ bonds ]
+ CG CD1
+ CG CD2
+ CD1 CE1
+ CD2 CE2
+ CE1 CZ
+ CE2 CZ
+ CZ OH
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ P1 OH
+ P1 O2
+ P1 O3
+ P1 O4
+ O2 H2
+
+[ PPI1 ]
+ [ atoms ]
+ C1 CG331 -0.170 0
+ O11 OG303 -0.620 1
+ P1 PG1 1.500 2
+ O12 OG304 -0.740 3
+ O13 OG2P1 -0.820 4
+ O14 OG2P1 -0.820 5
+ P2 PG2 1.100 6
+ O22 OG2P1 -0.900 7
+ O23 OG2P1 -0.900 8
+ O24 OG2P1 -0.900 9
+ H11 HGA3 0.090 10
+ H12 HGA3 0.090 11
+ H13 HGA3 0.090 12
+ [ bonds ]
+ P1 O11
+ P1 O12
+ P1 O13
+ P1 O14
+ O11 C1
+ C1 H11
+ C1 H12
+ C1 H13
+ O12 P2
+ P2 O22
+ P2 O23
+ P2 O24
+
+[ PPI2 ]
+ [ atoms ]
+ C1 CG331 -0.170 0
+ O11 OG303 -0.620 1
+ P1 PG1 1.460 2
+ O12 OG304 -0.630 3
+ O13 OG2P1 -0.830 4
+ O14 OG2P1 -0.830 5
+ P2 PG1 1.340 6
+ O22 OG311 -0.710 7
+ H22 HGP1 0.440 8
+ O23 OG2P1 -0.860 9
+ O24 OG2P1 -0.860 10
+ H11 HGA3 0.090 11
+ H12 HGA3 0.090 12
+ H13 HGA3 0.090 13
+ [ bonds ]
+ P1 O11
+ P1 O12
+ P1 O13
+ P1 O14
+ O11 C1
+ C1 H11
+ C1 H12
+ C1 H13
+ O12 P2
+ P2 O22
+ P2 O23
+ P2 O24
+ O22 H22
+
+[ PRAC ]
+ [ atoms ]
+ C1 CG2DC3 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2DC1 -0.250 3
+ H21 HGA4 0.150 4
+ CG CG2O3 0.620 5
+ OD1 OG2D2 -0.760 6
+ OD2 OG2D2 -0.760 7
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 C2
+ C2 H21
+ C2 CG
+ CG OD1
+ CG OD2
+ [ impropers ]
+ CG OD2 OD1 C2
+
+[ PRAL ]
+ [ atoms ]
+ C1 CG2DC3 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2DC1 -0.040 3
+ H21 HGA4 0.150 4
+ CG CG2O4 0.270 5
+ OD1 OG2D1 -0.510 6
+ H HGR52 0.130 7
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 C2
+ C2 H21
+ C2 CG
+ CG OD1
+ CG H
+ [ impropers ]
+ CG C2 OD1 H
+
+[ PRAM ]
+ [ atoms ]
+ CC CG321 -0.180 0
+ C CG2O1 0.550 1
+ N NG2S2 -0.620 2
+ HC HGP1 0.320 3
+ HT HGP1 0.300 4
+ O OG2D1 -0.550 5
+ HC1 HGA2 0.090 6
+ HC2 HGA2 0.090 7
+ C1 CG331 -0.270 8
+ H11 HGA3 0.090 9
+ H12 HGA3 0.090 10
+ H13 HGA3 0.090 11
+ [ bonds ]
+ C N
+ N HC
+ N HT
+ C CC
+ CC HC1
+ CC HC2
+ CC C1
+ C1 H11
+ C1 H12
+ C1 H13
+ C O
+ [ impropers ]
+ C CC N O
+
+[ PRLD ]
+ [ atoms ]
+ N1 NG3C51 -0.860 0
+ H1 HGP1 0.360 1
+ C2 CG3C52 0.100 2
+ H21 HGA2 0.090 3
+ H22 HGA2 0.090 4
+ C3 CG3C52 -0.210 5
+ H31 HGA2 0.090 6
+ H32 HGA2 0.090 7
+ C4 CG3C52 -0.210 8
+ H41 HGA2 0.090 9
+ H42 HGA2 0.090 10
+ C5 CG3C52 0.100 11
+ H51 HGA2 0.090 12
+ H52 HGA2 0.090 13
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 N1
+ N1 H1
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+
+[ PRLP ]
+ [ atoms ]
+ N1 NG3P2 -0.220 0
+ H11 HGP2 0.340 1
+ H12 HGP2 0.340 2
+ C2 CG3C54 -0.350 3
+ H21 HGA2 0.280 4
+ H22 HGA2 0.280 5
+ C3 CG3C52 -0.120 6
+ H31 HGA2 0.090 7
+ H32 HGA2 0.090 8
+ C4 CG3C52 -0.120 9
+ H41 HGA2 0.090 10
+ H42 HGA2 0.090 11
+ C5 CG3C54 -0.350 12
+ H51 HGA2 0.280 13
+ H52 HGA2 0.280 14
+ [ bonds ]
+ N1 H11
+ N1 H12
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 N1
+
+[ PRO ]
+ [ atoms ]
+ N N -0.290 0
+ CD CP3 0.000 1
+ HD1 HA2 0.090 2
+ HD2 HA2 0.090 3
+ CA CP1 0.020 4
+ HA HB1 0.090 5
+ CB CP2 -0.180 6
+ HB1 HA2 0.090 7
+ HB2 HA2 0.090 8
+ CG CP2 -0.180 9
+ HG1 HA2 0.090 10
+ HG2 HA2 0.090 11
+ C C 0.510 12
+ O O -0.510 13
+ [ bonds ]
+ C CA
+ C +N
+ N CA
+ CA CB
+ CB CG
+ CG CD
+ N CD
+ HA CA
+ HG1 CG
+ HG2 CG
+ HD1 CD
+ HD2 CD
+ HB1 CB
+ HB2 CB
+ O C
+ [ impropers ]
+ N -C CA CD
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ PRO2 ]
+ [ atoms ]
+ C2 CG311 0.140 0
+ O2 OG311 -0.650 1
+ HO2 HGP1 0.420 2
+ H21 HGA1 0.090 3
+ C1 CG331 -0.270 4
+ H11 HGA3 0.090 5
+ H12 HGA3 0.090 6
+ H13 HGA3 0.090 7
+ C3 CG331 -0.270 8
+ H31 HGA3 0.090 9
+ H32 HGA3 0.090 10
+ H33 HGA3 0.090 11
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C2 O2
+ C2 H21
+ O2 HO2
+ C1 H11
+ C1 H12
+ C1 H13
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ PROA ]
+ [ atoms ]
+ C2 CG321 -0.280 0
+ C1 CG2O3 0.620 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ O1 OG2D2 -0.760 4
+ O2 OG2D2 -0.760 5
+ C3 CG331 -0.270 6
+ H31 HGA3 0.090 7
+ H32 HGA3 0.090 8
+ H33 HGA3 0.090 9
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C1 O1
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C3 H33
+ C1 O2
+ [ impropers ]
+ C1 O2 O1 C2
+
+[ PROH ]
+ [ atoms ]
+ O1 OG311 -0.650 0
+ HO1 HGP1 0.420 1
+ C1 CG321 0.050 2
+ H11 HGA2 0.090 3
+ H12 HGA2 0.090 4
+ C2 CG321 -0.180 5
+ H21 HGA2 0.090 6
+ H22 HGA2 0.090 7
+ C3 CG331 -0.270 8
+ H31 HGA3 0.090 9
+ H32 HGA3 0.090 10
+ H33 HGA3 0.090 11
+ [ bonds ]
+ O1 HO1
+ O1 C1
+ C1 H11
+ C1 H12
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ PROL ]
+ [ atoms ]
+ C1 CG2D2 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2D1 -0.150 3
+ H21 HGA4 0.150 4
+ C3 CG321 0.050 5
+ H31 HGA2 0.090 6
+ H32 HGA2 0.090 7
+ OR OG311 -0.650 8
+ HR HGP1 0.420 9
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 OR
+ OR HR
+ H11 C1
+ H12 C1
+ H21 C2
+ H31 C3
+ H32 C3
+
+[ PROP ]
+ [ atoms ]
+ H11 HCA3A 0.090 0
+ H12 HCA3A 0.090 1
+ H13 HCA3A 0.090 2
+ C1 CC33A -0.270 3
+ C2 CC32A -0.180 4
+ H21 HCA2A 0.090 5
+ H22 HCA2A 0.090 6
+ H31 HCA3A 0.090 7
+ H32 HCA3A 0.090 8
+ H33 HCA3A 0.090 9
+ C3 CC33A -0.270 10
+ [ bonds ]
+ c1 h11
+ c1 h12
+ c1 h13
+ c1 c2
+ c2 h21
+ c2 h22
+ c2 c3
+ c3 h31
+ c3 h32
+ c3 h33
+
+[ PRPA ]
+ [ atoms ]
+ H11 HGA3 0.090 0
+ H12 HGA3 0.090 1
+ H13 HGA3 0.090 2
+ C1 CG331 -0.270 3
+ C2 CG321 -0.180 4
+ H21 HGA2 0.090 5
+ H22 HGA2 0.090 6
+ H31 HGA3 0.090 7
+ H32 HGA3 0.090 8
+ H33 HGA3 0.090 9
+ C3 CG331 -0.270 10
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ PRPE ]
+ [ atoms ]
+ C1 CG2D2 -0.420 0
+ H11 HGA5 0.210 1
+ H12 HGA5 0.210 2
+ C2 CG2D1 -0.150 3
+ H21 HGA4 0.150 4
+ C3 CG331 -0.270 5
+ H31 HGA3 0.090 6
+ H32 HGA3 0.090 7
+ H33 HGA3 0.090 8
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C2 H21
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 H33
+ C1 C2
+
+[ PRPY ]
+ [ atoms ]
+ C1 CG331 -0.140 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ C2 CG1T1 -0.010 4
+ C3 CG1T2 -0.410 5
+ H31 HGPAM1 0.290 6
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 H31
+ C1 H11
+ C1 H12
+ C1 H13
+
+[ PRSH ]
+ [ atoms ]
+ S1 SG311 -0.230 0
+ HS1 HGP3 0.160 1
+ C1 CG321 -0.110 2
+ H11 HGA2 0.090 3
+ H12 HGA2 0.090 4
+ C2 CG321 -0.180 5
+ H21 HGA2 0.090 6
+ H22 HGA2 0.090 7
+ C3 CG331 -0.270 8
+ H31 HGA3 0.090 9
+ H32 HGA3 0.090 10
+ H33 HGA3 0.090 11
+ [ bonds ]
+ S1 HS1
+ S1 C1
+ C1 H11
+ C1 H12
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ PRZP ]
+ [ atoms ]
+ N1 NG3C51 -0.470 0
+ H1 HGP1 0.350 1
+ N2 NG3P2 -0.180 2
+ H21 HGP2 0.370 3
+ H22 HGP2 0.370 4
+ C3 CG3C54 -0.300 5
+ H31 HGA2 0.280 6
+ H32 HGA2 0.280 7
+ C4 CG3C52 -0.180 8
+ H41 HGA2 0.090 9
+ H42 HGA2 0.090 10
+ C5 CG3C52 0.120 11
+ H51 HGA2 0.090 12
+ H52 HGA2 0.090 13
+ [ bonds ]
+ N1 H1
+ N2 H21
+ N2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ N1 N2
+ N2 C3
+ C4 C5
+ C5 N1
+ C3 C4
+
+[ PSCU ]
+ [ atoms ]
+ CG CG2R61 0.000 0
+ CD1 CG2R61 -0.115 1
+ HD1 HGR61 0.115 2
+ CD2 CG2R61 -0.115 3
+ HD2 HGR61 0.115 4
+ CE1 CG2R61 -0.115 5
+ HE1 HGR61 0.115 6
+ CE2 CG2R61 0.000 7
+ CZ CG2R61 0.000 8
+ C1 CG331 -0.270 9
+ H11 HGA3 0.090 10
+ H12 HGA3 0.090 11
+ H13 HGA3 0.090 12
+ C2 CG331 -0.270 13
+ H21 HGA3 0.090 14
+ H22 HGA3 0.090 15
+ H23 HGA3 0.090 16
+ C3 CG331 -0.270 17
+ H31 HGA3 0.090 18
+ H32 HGA3 0.090 19
+ H33 HGA3 0.090 20
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG C3
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 C2
+ CZ C1
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ PSICOS ]
+ [ atoms ]
+ C1 CC322 0.090 0
+ H11 HCA2 0.090 1
+ H12 HCA2 0.090 2
+ O1 OC311 -0.650 3
+ HO1 HCP1 0.420 4
+ C2 CC2O3 0.400 5
+ O2 OC2D3 -0.480 6
+ C3 CC312 0.180 7
+ H3 HCA1 0.090 8
+ O3 OC311 -0.650 9
+ HO3 HCP1 0.420 10
+ C4 CC312 0.140 11
+ H4 HCA1 0.090 12
+ O4 OC311 -0.650 13
+ HO4 HCP1 0.420 14
+ C5 CC312 0.140 15
+ H5 HCA1 0.090 16
+ O5 OC311 -0.650 17
+ HO5 HCP1 0.420 18
+ C6 CC322 0.050 19
+ H61 HCA2 0.090 20
+ H62 HCA2 0.090 21
+ O6 OC311 -0.650 22
+ HO6 HCP1 0.420 23
+ [ bonds ]
+ C1 O1
+ C1 H11
+ O1 HO1
+ C1 H12
+ C1 C2
+ C2 O2
+ C2 C3
+ C3 H3
+ C3 O3
+ O3 HO3
+ C3 C4
+ C4 H4
+ C4 O4
+ O4 HO4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 O6
+ O6 HO6
+ C5 O5
+ O5 HO5
+ [ impropers ]
+ C2 C1 C3 O2
+
+[ PSMT ]
+ [ atoms ]
+ S1 SG3O2 0.220 0
+ N2 NG321 -0.460 1
+ H21 HGP1 0.350 2
+ H22 HGP1 0.350 3
+ O11 OG2P1 -0.280 4
+ O12 OG2P1 -0.280 5
+ O3 OG303 -0.240 6
+ CZ CG2R61 0.340 7
+ CE1 CG2R61 -0.115 8
+ HE1 HGR61 0.115 9
+ CE2 CG2R61 -0.115 10
+ HE2 HGR61 0.115 11
+ CD1 CG2R61 -0.115 12
+ HD1 HGR61 0.115 13
+ CD2 CG2R61 -0.115 14
+ HD2 HGR61 0.115 15
+ CG CG2R61 -0.115 16
+ HG HGR61 0.115 17
+ [ bonds ]
+ S1 N2
+ N2 H21
+ N2 H22
+ S1 O11
+ S1 O12
+ S1 O3
+ O3 CZ
+ CZ CE1
+ CZ CE2
+ CE1 HE1
+ CE2 HE2
+ CE1 CD1
+ CE2 CD2
+ CD1 HD1
+ CD2 HD2
+ CD1 CG
+ CD2 CG
+ CG HG
+
+[ PSNA ]
+ [ atoms ]
+ S SG3O1 0.730 0
+ O1 OG2P1 -0.550 1
+ O2 OG2P1 -0.550 2
+ O3 OG2P1 -0.550 3
+ C1 CG321 -0.260 4
+ H11 HGA2 0.090 5
+ H12 HGA2 0.090 6
+ C2 CG321 -0.180 7
+ H21 HGA2 0.090 8
+ H22 HGA2 0.090 9
+ C3 CG331 -0.270 10
+ H31 HGA3 0.090 11
+ H32 HGA3 0.090 12
+ H33 HGA3 0.090 13
+ [ bonds ]
+ S O1
+ S O2
+ S O3
+ S C1
+ C1 H11
+ C1 H12
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ PSPG ]
+ [ atoms ]
+ C13 CTL2 0.050 0
+ H13A HAL2 0.090 1
+ H13B HAL2 0.090 2
+ OC3 OHL -0.660 3
+ HO3 HOL 0.430 4
+ C12 CTL1 0.140 5
+ H12A HAL1 0.090 6
+ OC2 OHL -0.660 7
+ HO2 HOL 0.430 8
+ C11 CTL2 -0.080 9
+ H11A HAL2 0.090 10
+ H11B HAL2 0.090 11
+ P PL 1.500 12
+ O13 O2L -0.780 13
+ O14 O2L -0.780 14
+ O11 OSLP -0.570 15
+ O12 OSLP -0.570 16
+ C1 CTL2 -0.080 17
+ HA HAL2 0.090 18
+ HB HAL2 0.090 19
+ C2 CTL1 0.170 20
+ HS HAL1 0.090 21
+ O21 OSL -0.490 22
+ C21 CL 0.900 23
+ O22 OBL -0.630 24
+ C22 CTL2 -0.220 25
+ H2R HAL2 0.090 26
+ H2S HAL2 0.090 27
+ C3 CTL2 0.080 28
+ HX HAL2 0.090 29
+ HY HAL2 0.090 30
+ O31 OSL -0.490 31
+ C31 CL 0.900 32
+ O32 OBL -0.630 33
+ C32 CTL2 -0.220 34
+ H2X HAL2 0.090 35
+ H2Y HAL2 0.090 36
+ C23 CTL2 -0.180 37
+ H3R HAL2 0.090 38
+ H3S HAL2 0.090 39
+ C24 CTL2 -0.180 40
+ H4R HAL2 0.090 41
+ H4S HAL2 0.090 42
+ C25 CTL2 -0.180 43
+ H5R HAL2 0.090 44
+ H5S HAL2 0.090 45
+ C26 CTL2 -0.180 46
+ H6R HAL2 0.090 47
+ H6S HAL2 0.090 48
+ C27 CTL2 -0.180 49
+ H7R HAL2 0.090 50
+ H7S HAL2 0.090 51
+ C28 CTL2 -0.180 52
+ H8R HAL2 0.090 53
+ H8S HAL2 0.090 54
+ C29 CEL1 -0.150 55
+ H9R HEL1 0.150 56
+ C210 CEL1 -0.150 57
+ H10R HEL1 0.150 58
+ C211 CTL2 -0.180 59
+ H11R HAL2 0.090 60
+ H11S HAL2 0.090 61
+ C212 CTL2 -0.180 62
+ H12R HAL2 0.090 63
+ H12S HAL2 0.090 64
+ C213 CTL2 -0.180 65
+ H13R HAL2 0.090 66
+ H13S HAL2 0.090 67
+ C214 CTL2 -0.180 68
+ H14R HAL2 0.090 69
+ H14S HAL2 0.090 70
+ C215 CTL2 -0.180 71
+ H15R HAL2 0.090 72
+ H15S HAL2 0.090 73
+ C216 CTL3 -0.270 74
+ H16R HAL3 0.090 75
+ H16S HAL3 0.090 76
+ H16T HAL3 0.090 77
+ C33 CTL2 -0.180 78
+ H3X HAL2 0.090 79
+ H3Y HAL2 0.090 80
+ C34 CTL2 -0.180 81
+ H4X HAL2 0.090 82
+ H4Y HAL2 0.090 83
+ C35 CTL2 -0.180 84
+ H5X HAL2 0.090 85
+ H5Y HAL2 0.090 86
+ C36 CTL2 -0.180 87
+ H6X HAL2 0.090 88
+ H6Y HAL2 0.090 89
+ C37 CTL2 -0.180 90
+ H7X HAL2 0.090 91
+ H7Y HAL2 0.090 92
+ C38 CTL2 -0.180 93
+ H8X HAL2 0.090 94
+ H8Y HAL2 0.090 95
+ C39 CTL2 -0.180 96
+ H9X HAL2 0.090 97
+ H9Y HAL2 0.090 98
+ C310 CTL2 -0.180 99
+ H10X HAL2 0.090 100
+ H10Y HAL2 0.090 101
+ C311 CTL2 -0.180 102
+ H11X HAL2 0.090 103
+ H11Y HAL2 0.090 104
+ C312 CTL2 -0.180 105
+ H12X HAL2 0.090 106
+ H12Y HAL2 0.090 107
+ C313 CTL2 -0.180 108
+ H13X HAL2 0.090 109
+ H13Y HAL2 0.090 110
+ C314 CTL2 -0.180 111
+ H14X HAL2 0.090 112
+ H14Y HAL2 0.090 113
+ C315 CTL2 -0.180 114
+ H15X HAL2 0.090 115
+ H15Y HAL2 0.090 116
+ C316 CTL3 -0.270 117
+ H16X HAL3 0.090 118
+ H16Y HAL3 0.090 119
+ H16Z HAL3 0.090 120
+ [ bonds ]
+ HO3 OC3
+ OC3 C13
+ C13 H13A
+ C13 H13B
+ C13 C12
+ HO2 OC2
+ OC2 C12
+ C12 H12A
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C210 H10R
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C21 O22
+ C29 C210
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ PTID ]
+ [ atoms ]
+ N1 NG2R62 -0.710 0
+ C2 CG2R64 0.500 1
+ H2 HGR62 0.140 2
+ N3 NG2R62 -0.700 3
+ C4 CG2R61 0.110 4
+ H4 HGR62 0.180 5
+ C5 CG2R61 0.450 6
+ N6 NG2R60 -0.640 7
+ C7 CG2R61 0.185 8
+ H7 HGR62 0.105 9
+ C8 CG2R61 0.320 10
+ H8 HGR62 0.090 11
+ N9 NG2R62 -0.650 12
+ C10 CG2R64 0.620 13
+ [ bonds ]
+ N1 C2
+ C2 N3
+ N3 C4
+ C4 C5
+ C5 N6
+ N6 C7
+ C7 C8
+ C8 N9
+ N9 C10
+ C5 C10
+ N1 C10
+ C2 H2
+ C4 H4
+ C7 H7
+ C8 H8
+
+[ PUR7 ]
+ [ atoms ]
+ C5 CG2RC0 0.230 0
+ N7 NG2R51 -0.220 1
+ H7 HGP1 0.260 2
+ C8 CG2R53 0.320 3
+ H8 HGR52 0.120 4
+ N9 NG2R50 -0.570 5
+ N1 NG2R62 -0.780 6
+ C2 CG2R64 0.480 7
+ H2 HGR62 0.130 8
+ N3 NG2R62 -0.580 9
+ C4 CG2RC0 0.210 10
+ C6 CG2R61 0.310 11
+ H6 HGR62 0.090 12
+ [ bonds ]
+ N1 C2
+ C2 N3
+ N3 C4
+ C4 C5
+ C5 C6
+ C6 N1
+ C5 N7
+ N7 C8
+ C8 N9
+ N9 C4
+ C2 H2
+ C6 H6
+ C8 H8
+ N7 H7
+
+[ PUR9 ]
+ [ atoms ]
+ C5 CG2RC0 0.300 0
+ N7 NG2R50 -0.730 1
+ C8 CG2R53 0.370 2
+ H8 HGR52 0.090 3
+ N9 NG2R51 -0.190 4
+ H9 HGP1 0.290 5
+ N1 NG2R62 -0.730 6
+ C2 CG2R64 0.500 7
+ H2 HGR62 0.140 8
+ N3 NG2R62 -0.770 9
+ C4 CG2RC0 0.440 10
+ C6 CG2R61 0.090 11
+ H6 HGR62 0.200 12
+ [ bonds ]
+ N1 C2
+ C2 N3
+ N3 C4
+ C4 C5
+ C5 C6
+ C6 N1
+ C5 N7
+ N7 C8
+ C8 N9
+ N9 C4
+ C2 H2
+ C6 H6
+ C8 H8
+ N9 H9
+
+[ PXYL ]
+ [ atoms ]
+ CG CG2R61 0.000 0
+ CD1 CG2R61 -0.115 1
+ HD1 HGR61 0.115 2
+ CD2 CG2R61 -0.115 3
+ HD2 HGR61 0.115 4
+ CE1 CG2R61 -0.115 5
+ HE1 HGR61 0.115 6
+ CE2 CG2R61 -0.115 7
+ HE2 HGR61 0.115 8
+ CZ CG2R61 0.000 9
+ C1 CG331 -0.270 10
+ H11 HGA3 0.090 11
+ H12 HGA3 0.090 12
+ H13 HGA3 0.090 13
+ C2 CG331 -0.270 14
+ H21 HGA3 0.090 15
+ H22 HGA3 0.090 16
+ H23 HGA3 0.090 17
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG C2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ C1
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ PY01 ]
+ [ atoms ]
+ O1 OG3R60 -0.320 0
+ C2 CG2D1O -0.040 1
+ H21 HGA4 0.200 2
+ C3 CG2D1 -0.150 3
+ H31 HGA4 0.150 4
+ C4 CG321 -0.180 5
+ H41 HGA2 0.090 6
+ H42 HGA2 0.090 7
+ C5 CG2D1 -0.150 8
+ H51 HGA4 0.150 9
+ C6 CG2D1O -0.040 10
+ H61 HGA4 0.200 11
+ [ bonds ]
+ O1 C2
+ C2 H21
+ C2 C3
+ C3 H31
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 C5
+ C5 H51
+ C5 C6
+ C6 H61
+ C6 O1
+
+[ PY02 ]
+ [ atoms ]
+ O1 OG3R60 -0.370 0
+ C2 CG321 0.000 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG2DC2 -0.150 4
+ H31 HGA4 0.150 5
+ C4 CG2DC2 -0.150 6
+ H41 HGA4 0.150 7
+ C5 CG2DC1 -0.150 8
+ H51 HGA4 0.150 9
+ C6 CG2D1O 0.000 10
+ H61 HGA4 0.190 11
+ [ bonds ]
+ O1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H31
+ C3 C4
+ C4 H41
+ C4 C5
+ C5 H51
+ C5 C6
+ C6 H61
+ C6 O1
+
+[ PYR1 ]
+ [ atoms ]
+ N1 NG2R60 -0.600 0
+ C2 CG2R61 0.180 1
+ C3 CG2R61 -0.115 2
+ C4 CG2R61 -0.115 3
+ C5 CG2R61 -0.115 4
+ C6 CG2R61 0.180 5
+ H2 HGR62 0.120 6
+ H3 HGR61 0.115 7
+ H4 HGR61 0.115 8
+ H5 HGR61 0.115 9
+ H6 HGR62 0.120 10
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 N1
+ C2 H2
+ C3 H3
+ C4 H4
+ C5 H5
+ C6 H6
+
+[ PYRD ]
+ [ atoms ]
+ N1 NG2R62 -0.440 0
+ N2 NG2R62 -0.440 1
+ C3 CG2R61 0.310 2
+ H3 HGR62 0.110 3
+ C4 CG2R61 -0.160 4
+ H4 HGR61 0.180 5
+ C5 CG2R61 -0.160 6
+ H5 HGR61 0.180 7
+ C6 CG2R61 0.310 8
+ H6 HGR62 0.110 9
+ [ bonds ]
+ N1 N2
+ N2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 N1
+ C3 H3
+ C4 H4
+ C5 H5
+ C6 H6
+
+[ PYRL ]
+ [ atoms ]
+ C1 CG2R51 -0.040 0
+ H1 HGR52 0.140 1
+ C2 CG2R51 -0.250 2
+ H2 HGR51 0.150 3
+ C3 CG2R51 -0.250 4
+ H3 HGR51 0.150 5
+ C4 CG2R51 -0.040 6
+ H4 HGR52 0.140 7
+ N5 NG2R51 -0.350 8
+ H5 HGP1 0.350 9
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 N5
+ N5 H5
+ N5 C1
+
+[ PYRM ]
+ [ atoms ]
+ N1 NG2R62 -0.730 0
+ C2 CG2R64 0.500 1
+ H2 HGR62 0.140 2
+ N3 NG2R62 -0.730 3
+ C4 CG2R61 0.290 4
+ H4 HGR62 0.120 5
+ C5 CG2R61 -0.115 6
+ H5 HGR61 0.115 7
+ C6 CG2R61 0.290 8
+ H6 HGR62 0.120 9
+ [ bonds ]
+ N1 C2
+ C2 N3
+ N3 C4
+ C4 C5
+ C5 C6
+ C6 N1
+ C2 H2
+ C4 H4
+ C5 H5
+ C6 H6
+
+[ PYRZ ]
+ [ atoms ]
+ C1 CG2R51 -0.030 0
+ H1 HGR52 0.150 1
+ C2 CG2R51 -0.240 2
+ H2 HGR51 0.140 3
+ C3 CG2R52 0.140 4
+ H3 HGR52 0.130 5
+ N4 NG2R50 -0.570 6
+ N5 NG2R51 -0.050 7
+ H5 HGP1 0.330 8
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 N4
+ N4 N5
+ N5 H5
+ N5 C1
+
+[ PYZN ]
+ [ atoms ]
+ N1 NG2R60 -0.560 0
+ C2 CG2R61 0.180 1
+ H2 HGR62 0.100 2
+ C3 CG2R61 0.180 3
+ H3 HGR62 0.100 4
+ N4 NG2R60 -0.560 5
+ C5 CG2R61 0.180 6
+ H5 HGR62 0.100 7
+ C6 CG2R61 0.180 8
+ H6 HGR62 0.100 9
+ [ bonds ]
+ C6 H6
+ C6 C5
+ C5 H5
+ C5 N4
+ N4 C3
+ C3 H3
+ C3 C2
+ C2 H2
+ C2 N1
+ N1 C6
+
+[ PhPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C13 CTL5 -0.350 1
+ H13A HL 0.250 2
+ H13B HL 0.250 3
+ H13C HL 0.250 4
+ C14 CTL5 -0.350 5
+ H14A HL 0.250 6
+ H14B HL 0.250 7
+ H14C HL 0.250 8
+ C15 CTL5 -0.350 9
+ H15A HL 0.250 10
+ H15B HL 0.250 11
+ H15C HL 0.250 12
+ C12 CTL2 -0.100 13
+ H12A HL 0.250 14
+ H12B HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O11 OSLP -0.570 22
+ O12 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL1 -0.090 44
+ H3R HAL1 0.090 45
+ C217 CTL3 -0.270 46
+ H17R HAL3 0.090 47
+ H17S HAL3 0.090 48
+ H17T HAL3 0.090 49
+ C24 CTL2 -0.180 50
+ H4R HAL2 0.090 51
+ H4S HAL2 0.090 52
+ C25 CTL2 -0.180 53
+ H5R HAL2 0.090 54
+ H5S HAL2 0.090 55
+ C26 CTL2 -0.180 56
+ H6R HAL2 0.090 57
+ H6S HAL2 0.090 58
+ C27 CTL1 -0.090 59
+ H7R HAL1 0.090 60
+ C218 CTL3 -0.270 61
+ H18R HAL3 0.090 62
+ H18S HAL3 0.090 63
+ H18T HAL3 0.090 64
+ C28 CTL2 -0.180 65
+ H8R HAL2 0.090 66
+ H8S HAL2 0.090 67
+ C29 CTL2 -0.180 68
+ H9R HAL2 0.090 69
+ H9S HAL2 0.090 70
+ C210 CTL2 -0.180 71
+ H10R HAL2 0.090 72
+ H10S HAL2 0.090 73
+ C211 CTL1 -0.090 74
+ H11R HAL1 0.090 75
+ C219 CTL3 -0.270 76
+ H19R HAL3 0.090 77
+ H19S HAL3 0.090 78
+ H19T HAL3 0.090 79
+ C212 CTL2 -0.180 80
+ H12R HAL2 0.090 81
+ H12S HAL2 0.090 82
+ C213 CTL2 -0.180 83
+ H13R HAL2 0.090 84
+ H13S HAL2 0.090 85
+ C214 CTL2 -0.180 86
+ H14R HAL2 0.090 87
+ H14S HAL2 0.090 88
+ C215 CTL1 -0.090 89
+ H15R HAL1 0.090 90
+ C220 CTL3 -0.270 91
+ H20R HAL3 0.090 92
+ H20S HAL3 0.090 93
+ H20T HAL3 0.090 94
+ C216 CTL3 -0.270 95
+ H16R HAL3 0.090 96
+ H16S HAL3 0.090 97
+ H16T HAL3 0.090 98
+ C33 CTL1 -0.090 99
+ H3X HAL1 0.090 100
+ C317 CTL3 -0.270 101
+ H17X HAL3 0.090 102
+ H17Y HAL3 0.090 103
+ H17Z HAL3 0.090 104
+ C34 CTL2 -0.180 105
+ H4X HAL2 0.090 106
+ H4Y HAL2 0.090 107
+ C35 CTL2 -0.180 108
+ H5X HAL2 0.090 109
+ H5Y HAL2 0.090 110
+ C36 CTL2 -0.180 111
+ H6X HAL2 0.090 112
+ H6Y HAL2 0.090 113
+ C37 CTL1 -0.090 114
+ H7X HAL1 0.090 115
+ C318 CTL3 -0.270 116
+ H18X HAL3 0.090 117
+ H18Y HAL3 0.090 118
+ H18Z HAL3 0.090 119
+ C38 CTL2 -0.180 120
+ H8X HAL2 0.090 121
+ H8Y HAL2 0.090 122
+ C39 CTL2 -0.180 123
+ H9X HAL2 0.090 124
+ H9Y HAL2 0.090 125
+ C310 CTL2 -0.180 126
+ H10X HAL2 0.090 127
+ H10Y HAL2 0.090 128
+ C311 CTL1 -0.090 129
+ H11X HAL1 0.090 130
+ C319 CTL3 -0.270 131
+ H19X HAL3 0.090 132
+ H19Y HAL3 0.090 133
+ H19Z HAL3 0.090 134
+ C312 CTL2 -0.180 135
+ H12X HAL2 0.090 136
+ H12Y HAL2 0.090 137
+ C313 CTL2 -0.180 138
+ H13X HAL2 0.090 139
+ H13Y HAL2 0.090 140
+ C314 CTL2 -0.180 141
+ H14X HAL2 0.090 142
+ H14Y HAL2 0.090 143
+ C315 CTL1 -0.090 144
+ H15X HAL1 0.090 145
+ C320 CTL3 -0.270 146
+ H20X HAL3 0.090 147
+ H20Y HAL3 0.090 148
+ H20Z HAL3 0.090 149
+ C316 CTL3 -0.270 150
+ H16X HAL3 0.090 151
+ H16Y HAL3 0.090 152
+ H16Z HAL3 0.090 153
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 C217
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 C218
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C211 C219
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 C220
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ C217 H17R
+ C217 H17S
+ C217 H17T
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ C219 H19R
+ C219 H19S
+ C219 H19T
+ C220 H20R
+ C220 H20S
+ C220 H20T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 C317
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 C318
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 C319
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 C320
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 H16Z
+ C317 H17X
+ C317 H17Y
+ C317 H17Z
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C319 H19X
+ C319 H19Y
+ C319 H19Z
+ C320 H20X
+ C320 H20Y
+ C320 H20Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ QINL ]
+ [ atoms ]
+ N1 NG2R60 -0.640 0
+ C2 CG2R61 0.160 1
+ H2 HGR62 0.140 2
+ C3 CG2R61 -0.115 3
+ H3 HGR61 0.115 4
+ C4 CG2R61 -0.115 5
+ H4 HGR61 0.115 6
+ C5 CG2R61 0.000 7
+ C6 CG2R61 -0.115 8
+ H6 HGR61 0.115 9
+ C7 CG2R61 -0.115 10
+ H7 HGR61 0.115 11
+ C8 CG2R61 -0.115 12
+ H8 HGR61 0.115 13
+ C9 CG2R61 -0.115 14
+ H9 HGR61 0.115 15
+ C10 CG2R61 0.340 16
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C5 C10
+ N1 C10
+ C2 H2
+ C3 H3
+ C4 H4
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+
+[ QINU ]
+ [ atoms ]
+ N1 NG3P1 0.130 0
+ H1 HGP2 0.190 1
+ C2 CG324 0.030 2
+ H21 HGA2 0.090 3
+ H22 HGA2 0.090 4
+ C6 CG324 0.030 5
+ H61 HGA2 0.090 6
+ H62 HGA2 0.090 7
+ C7 CG324 0.030 8
+ H71 HGA2 0.090 9
+ H72 HGA2 0.090 10
+ C3 CG321 -0.180 11
+ H31 HGA2 0.090 12
+ H32 HGA2 0.090 13
+ C4 CG311 -0.040 14
+ H4 HGA1 0.090 15
+ C5 CG321 -0.180 16
+ H51 HGA2 0.090 17
+ H52 HGA2 0.090 18
+ C8 CG321 -0.180 19
+ H81 HGA2 0.090 20
+ H82 HGA2 0.090 21
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 N1
+ N1 C7
+ C7 C8
+ C8 C4
+ N1 H1
+ C4 H4
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+ C7 H71
+ C7 H72
+ C8 H81
+ C8 H82
+
+[ QINX ]
+ [ atoms ]
+ N1 NG2R60 -0.580 0
+ C2 CG2R61 0.090 1
+ H2 HGR62 0.160 2
+ C3 CG2R61 0.090 3
+ H3 HGR62 0.160 4
+ N4 NG2R60 -0.580 5
+ C5 CG2R61 0.330 6
+ C6 CG2R61 -0.115 7
+ H6 HGR61 0.115 8
+ C7 CG2R61 -0.115 9
+ H7 HGR61 0.115 10
+ C8 CG2R61 -0.115 11
+ H8 HGR61 0.115 12
+ C9 CG2R61 -0.115 13
+ H9 HGR61 0.115 14
+ C10 CG2R61 0.330 15
+ [ bonds ]
+ N1 C2
+ C2 C3
+ C3 N4
+ N4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C5 C10
+ N1 C10
+ C2 H2
+ C3 H3
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+
+[ QINZ ]
+ [ atoms ]
+ N1 NG2R62 -0.810 0
+ C2 CG2R64 0.520 1
+ H2 HGR62 0.140 2
+ N3 NG2R62 -0.750 3
+ C4 CG2R61 0.280 4
+ H4 HGR62 0.130 5
+ C5 CG2R61 0.020 6
+ C6 CG2R61 -0.115 7
+ H6 HGR61 0.115 8
+ C7 CG2R61 -0.115 9
+ H7 HGR61 0.115 10
+ C8 CG2R61 -0.115 11
+ H8 HGR61 0.115 12
+ C9 CG2R61 -0.115 13
+ H9 HGR61 0.115 14
+ C10 CG2R61 0.470 15
+ [ bonds ]
+ N1 C2
+ C2 N3
+ N3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C5 C10
+ N1 C10
+ C2 H2
+ C4 H4
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 H9
+
+[ QMPE ]
+ [ atoms ]
+ N NH3L -0.300 0
+ HN1 HCL 0.330 1
+ HN2 HCL 0.330 2
+ HN3 HCL 0.330 3
+ C12 CTL2 0.130 4
+ H12A HAL2 0.090 5
+ H12B HAL2 0.090 6
+ C11 CTL2 -0.080 7
+ H11A HAL2 0.090 8
+ H11B HAL2 0.090 9
+ P PL 1.500 10
+ O13 O2L -0.780 11
+ O14 O2L -0.780 12
+ O11 OSLP -0.570 13
+ O12 OSLP -0.570 14
+ C1 CTL2 -0.080 15
+ HA HAL2 0.090 16
+ HB HAL2 0.090 17
+ C2 CTL1 0.170 18
+ HS HAL1 0.090 19
+ O21 OSL -0.490 20
+ C21 CL 0.900 21
+ O22 OBL -0.630 22
+ C22 CTL2 -0.220 23
+ H2R HAL2 0.090 24
+ H2S HAL2 0.090 25
+ C3 CTL2 0.080 26
+ HX HAL2 0.090 27
+ HY HAL2 0.090 28
+ O31 OSL -0.490 29
+ C31 CL 0.900 30
+ O32 OBL -0.630 31
+ C32 CTL2 -0.220 32
+ H2X HAL2 0.090 33
+ H2Y HAL2 0.090 34
+ C23 CTL2 -0.180 35
+ H3R HAL2 0.090 36
+ H3S HAL2 0.090 37
+ C24 CTL2 -0.180 38
+ H4R HAL2 0.090 39
+ H4S HAL2 0.090 40
+ C25 CTL2 -0.180 41
+ H5R HAL2 0.090 42
+ H5S HAL2 0.090 43
+ C26 CTL2 -0.180 44
+ H6R HAL2 0.090 45
+ H6S HAL2 0.090 46
+ C27 CTL2 -0.180 47
+ H7R HAL2 0.090 48
+ H7S HAL2 0.090 49
+ C28 CTL2 -0.180 50
+ H8R HAL2 0.090 51
+ H8S HAL2 0.090 52
+ C29 CG3RC1 -0.090 53
+ H9R HGA1 0.090 54
+ C217 CG3C31 -0.180 55
+ H17R HGA2 0.090 56
+ H17S HGA2 0.090 57
+ C210 CG3RC1 -0.090 58
+ H10R HGA1 0.090 59
+ C211 CTL2 -0.180 60
+ H11R HAL2 0.090 61
+ H11S HAL2 0.090 62
+ C212 CTL2 -0.180 63
+ H12R HAL2 0.090 64
+ H12S HAL2 0.090 65
+ C213 CTL2 -0.180 66
+ H13R HAL2 0.090 67
+ H13S HAL2 0.090 68
+ C214 CTL2 -0.180 69
+ H14R HAL2 0.090 70
+ H14S HAL2 0.090 71
+ C215 CTL2 -0.180 72
+ H15R HAL2 0.090 73
+ H15S HAL2 0.090 74
+ C216 CTL3 -0.270 75
+ H16R HAL3 0.090 76
+ H16S HAL3 0.090 77
+ H16T HAL3 0.090 78
+ C33 CTL2 -0.180 79
+ H3X HAL2 0.090 80
+ H3Y HAL2 0.090 81
+ C34 CTL2 -0.180 82
+ H4X HAL2 0.090 83
+ H4Y HAL2 0.090 84
+ C35 CTL2 -0.180 85
+ H5X HAL2 0.090 86
+ H5Y HAL2 0.090 87
+ C36 CTL2 -0.180 88
+ H6X HAL2 0.090 89
+ H6Y HAL2 0.090 90
+ C37 CTL2 -0.180 91
+ H7X HAL2 0.090 92
+ H7Y HAL2 0.090 93
+ C38 CTL2 -0.180 94
+ H8X HAL2 0.090 95
+ H8Y HAL2 0.090 96
+ C39 CTL2 -0.180 97
+ H9X HAL2 0.090 98
+ H9Y HAL2 0.090 99
+ C310 CTL2 -0.180 100
+ H10X HAL2 0.090 101
+ H10Y HAL2 0.090 102
+ C311 CTL2 -0.180 103
+ H11X HAL2 0.090 104
+ H11Y HAL2 0.090 105
+ C312 CTL2 -0.180 106
+ H12X HAL2 0.090 107
+ H12Y HAL2 0.090 108
+ C313 CTL2 -0.180 109
+ H13X HAL2 0.090 110
+ H13Y HAL2 0.090 111
+ C314 CTL2 -0.180 112
+ H14X HAL2 0.090 113
+ H14Y HAL2 0.090 114
+ C315 CTL3 -0.270 115
+ H15X HAL3 0.090 116
+ H15Y HAL3 0.090 117
+ H15Z HAL3 0.090 118
+ [ bonds ]
+ N HN1
+ N HN2
+ N HN3
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C1 O11
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H9R
+ C29 C210
+ C29 C217
+ C210 H10R
+ C210 C211
+ C210 C217
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 H16T
+ C217 H17R
+ C217 H17S
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 H15Z
+ C21 O22
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ R3PH ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C52 0.020 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C51 0.140 7
+ H21' HGA1 0.090 8
+ O2' OG311 -0.650 9
+ H22' HGP1 0.420 10
+ C3' CG3C51 0.010 11
+ H31' HGA1 0.090 12
+ O3' OG303 -0.620 13
+ P PG1 1.500 14
+ O1P OG2P1 -0.820 15
+ O2P OG2P1 -0.820 16
+ O3T OG311 -0.670 17
+ H3T HGP1 0.330 18
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' O2'
+ O2' H22'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3T
+ O3T H3T
+
+[ RIBO ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ C4' CG3C52 0.020 2
+ H11' HGA2 0.090 3
+ H12' HGA2 0.090 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C51 0.140 7
+ H21' HGA1 0.090 8
+ O2' OG311 -0.650 9
+ H22' HGP1 0.420 10
+ C3' CG3C51 0.140 11
+ H31' HGA1 0.090 12
+ O3' OG311 -0.650 13
+ H32' HGP1 0.420 14
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' O2'
+ C2' H21'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O2' H22'
+ O3' H32'
+
+[ RIN ]
+ [ atoms ]
+ C7 CG2R61 -0.115 0
+ C6 CG2R61 -0.115 1
+ C5 CG2R62 -0.010 2
+ C10 CG2R62 0.400 3
+ C9 CG2R61 -0.115 4
+ C8 CG2R61 -0.115 5
+ H4 HGR62 0.230 6
+ H7 HGR61 0.115 7
+ H6 HGR61 0.115 8
+ C4 CG2R62 -0.230 9
+ H9 HGR61 0.115 10
+ H8 HGR61 0.115 11
+ C3 CG2R62 -0.260 12
+ H3 HGR62 0.200 13
+ O1 OG3R60 -0.360 14
+ C2 CG2R63 0.490 15
+ O2 OG2D4 -0.460 16
+ [ bonds ]
+ C7 C6
+ C7 C8
+ C7 H7
+ C6 C5
+ C6 H6
+ C5 C10
+ C5 C4
+ C10 C9
+ C10 O1
+ C9 C8
+ C9 H9
+ C8 H8
+ H4 C4
+ C4 C3
+ C3 H3
+ C3 C2
+ O1 C2
+ C2 O2
+ [ impropers ]
+ C2 C3 O2 O1
+
+[ RM3P ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C51 0.110 4
+ H42' HGA1 0.090 5
+ C2' CG3C52 -0.180 6
+ H21' HGA2 0.090 7
+ H22' HGA2 0.090 8
+ C3' CG3C51 -0.090 9
+ H31' HGA1 0.090 10
+ O3' OG303 -0.400 11
+ P PG2 1.100 12
+ O1P OG2P1 -0.900 13
+ O2P OG2P1 -0.900 14
+ O3P OG2P1 -0.900 15
+ C5' CG331 -0.270 16
+ H51' HGA3 0.090 17
+ H52' HGA3 0.090 18
+ H53' HGA3 0.090 19
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+ C4' C5'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+
+[ RNUA ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ H21' HGA1 0.090 5
+ C2' CG3C51 0.140 6
+ O2' OG311 -0.650 7
+ H22' HGP1 0.420 8
+ C5 CG2RC0 0.280 9
+ N7 NG2R50 -0.710 10
+ C8 CG2R53 0.340 11
+ H8 HGR52 0.120 12
+ N9 NG2R51 -0.050 13
+ N1 NG2R62 -0.740 14
+ C2 CG2R64 0.500 15
+ H2 HGR62 0.130 16
+ N3 NG2R62 -0.750 17
+ C4 CG2RC0 0.430 18
+ C6 CG2R64 0.460 19
+ N6 NG2S3 -0.770 20
+ H61 HGP4 0.380 21
+ H62 HGP4 0.380 22
+ H31' HGA1 0.090 23
+ C3' CG3C51 0.140 24
+ O3' OG311 -0.650 25
+ H32' HGP1 0.420 26
+ C5' CG321 0.050 27
+ H51' HGA2 0.090 28
+ H52' HGA2 0.090 29
+ O5' OG311 -0.650 30
+ H5T HGP1 0.420 31
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' O2'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ O2' H22'
+ O3' H32'
+ C1' N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C8 H8
+ C2 H2
+ N1 C6
+ C2 N3
+ C4 C5
+ N7 C8
+ [ impropers ]
+ C6 C5 N1 N6
+ N6 H62 H61 C6
+
+[ RNUC ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ H21' HGA1 0.090 5
+ C2' CG3C51 0.140 6
+ O2' OG311 -0.650 7
+ H22' HGP1 0.420 8
+ N1 NG2R61 -0.130 9
+ C6 CG2R62 0.050 10
+ H6 HGR62 0.170 11
+ C2 CG2R63 0.520 12
+ O2 OG2D4 -0.490 13
+ N3 NG2R62 -0.660 14
+ C4 CG2R64 0.650 15
+ N4 NG2S3 -0.750 16
+ H41 HGP4 0.370 17
+ H42 HGP4 0.330 18
+ C5 CG2R62 -0.130 19
+ H5 HGR62 0.070 20
+ H31' HGA1 0.090 21
+ C3' CG3C51 0.140 22
+ O3' OG311 -0.650 23
+ H32' HGP1 0.420 24
+ C5' CG321 0.050 25
+ H51' HGA2 0.090 26
+ H52' HGA2 0.090 27
+ O5' OG311 -0.650 28
+ H5T HGP1 0.420 29
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' O2'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ O2' H22'
+ O3' H32'
+ C1' N1
+ N1 C2
+ N1 C6
+ C2 N3
+ C4 N4
+ N4 H41
+ N4 H42
+ C4 C5
+ C5 H5
+ C6 H6
+ C2 O2
+ C5 C6
+ N3 C4
+ [ impropers ]
+ C4 C5 N3 N4
+ C2 N1 N3 O2
+ N4 H42 H41 C4
+
+[ RNUG ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ H21' HGA1 0.090 5
+ C2' CG3C51 0.140 6
+ O2' OG311 -0.650 7
+ H22' HGP1 0.420 8
+ N9 NG2R51 -0.020 9
+ C4 CG2RC0 0.260 10
+ N3 NG2R62 -0.740 11
+ C2 CG2R64 0.750 12
+ N1 NG2R61 -0.340 13
+ H1 HGP1 0.260 14
+ N2 NG2S3 -0.680 15
+ H21 HGP4 0.320 16
+ H22 HGP4 0.350 17
+ C6 CG2R63 0.540 18
+ O6 OG2D4 -0.510 19
+ C5 CG2RC0 0.000 20
+ N7 NG2R50 -0.600 21
+ C8 CG2R53 0.250 22
+ H8 HGR52 0.160 23
+ H31' HGA1 0.090 24
+ C3' CG3C51 0.140 25
+ O3' OG311 -0.650 26
+ H32' HGP1 0.420 27
+ C5' CG321 0.050 28
+ H51' HGA2 0.090 29
+ H52' HGA2 0.090 30
+ O5' OG311 -0.650 31
+ H5T HGP1 0.420 32
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' O2'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ O2' H22'
+ O3' H32'
+ C1' N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N2
+ C2 N1
+ N2 H21
+ N2 H22
+ N1 H1
+ N1 C6
+ C6 C5
+ C5 N7
+ C8 H8
+ C2 N3
+ C4 C5
+ N7 C8
+ C6 O6
+ [ impropers ]
+ C2 N1 N3 N2
+ N2 H22 H21 C2
+ C6 C5 N1 O6
+
+[ RNUS ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ C2' CG3C51 0.140 5
+ H21' HGA1 0.090 6
+ O2' OG311 -0.650 7
+ H22' HGP1 0.420 8
+ H31' HGA1 0.090 9
+ C3' CG3C51 0.140 10
+ O3' OG311 -0.650 11
+ H32' HGP1 0.420 12
+ C5' CG321 0.050 13
+ H51' HGA2 0.090 14
+ H52' HGA2 0.090 15
+ O5' OG311 -0.650 16
+ H5T HGP1 0.420 17
+ CG CG2R51 -0.050 18
+ HG HGR52 0.090 19
+ CD2 CG2R51 0.220 20
+ HD2 HGR52 0.100 21
+ ND1 NG2R51 -0.040 22
+ CE1 CG2R53 0.250 23
+ HE1 HGR52 0.130 24
+ NE2 NG2R50 -0.700 25
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' O2'
+ O2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ O3' H32'
+ C1' ND1
+ ND1 CE1
+ NE2 CD2
+ CG ND1
+ CE1 HE1
+ CD2 HD2
+ CG HG
+ CG CD2
+ CE1 NE2
+
+[ RSRF ]
+ [ atoms ]
+ C1 CG3RC1 0.070 0
+ H11 HGA1 0.090 1
+ C2 CG3RC1 0.030 2
+ H21 HGA1 0.090 3
+ O4 OG3C51 -0.340 4
+ C4 CG3C52 0.020 5
+ H41 HGA2 0.090 6
+ H42 HGA2 0.090 7
+ O6 OG3C51 -0.340 8
+ C6 CG3C52 0.020 9
+ H61 HGA2 0.090 10
+ H62 HGA2 0.090 11
+ C5 CG3C52 -0.180 12
+ H51 HGA2 0.090 13
+ H52 HGA2 0.090 14
+ C3 CG3C51 0.140 15
+ H31 HGA1 0.090 16
+ O3 OG311 -0.650 17
+ H32 HGP1 0.420 18
+ [ bonds ]
+ C1 O4
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 O4
+ C3 O3
+ C1 H11
+ C1 O6
+ C2 H21
+ C2 C5
+ C3 H31
+ C4 H41
+ C4 H42
+ O3 H32
+ C5 C6
+ C6 O6
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+
+[ RTAC ]
+ [ atoms ]
+ C1 CG301 0.000 0
+ C16 CG331 -0.270 1
+ H161 HGA3 0.090 2
+ H162 HGA3 0.090 3
+ H163 HGA3 0.090 4
+ C17 CG331 -0.270 5
+ H171 HGA3 0.090 6
+ H172 HGA3 0.090 7
+ H173 HGA3 0.090 8
+ C2 CG321 -0.180 9
+ H21 HGA2 0.090 10
+ H22 HGA2 0.090 11
+ C3 CG321 -0.180 12
+ H31 HGA2 0.090 13
+ H32 HGA2 0.090 14
+ C4 CG321 -0.180 15
+ H41 HGA2 0.090 16
+ H42 HGA2 0.090 17
+ C5 CG2DC2 0.000 18
+ C6 CG2DC2 0.000 19
+ C18 CG331 -0.270 20
+ H181 HGA3 0.090 21
+ H182 HGA3 0.090 22
+ H183 HGA3 0.090 23
+ C7 CG2DC1 -0.150 24
+ H71 HGA4 0.150 25
+ C8 CG2DC1 -0.150 26
+ H81 HGA4 0.150 27
+ C9 CG2DC2 0.000 28
+ C19 CG331 -0.270 29
+ H191 HGA3 0.090 30
+ H192 HGA3 0.090 31
+ H193 HGA3 0.090 32
+ C10 CG2DC2 -0.150 33
+ H101 HGA4 0.150 34
+ C11 CG2DC1 -0.150 35
+ H111 HGA4 0.150 36
+ C12 CG2DC1 -0.150 37
+ H121 HGA4 0.150 38
+ C13 CG2DC2 0.000 39
+ C20 CG331 -0.270 40
+ H201 HGA3 0.090 41
+ H202 HGA3 0.090 42
+ H203 HGA3 0.090 43
+ C14 CG2DC2 -0.250 44
+ H141 HGA4 0.150 45
+ C15 CG2O3 0.620 46
+ O29 OG2D2 -0.760 47
+ O29B OG2D2 -0.760 48
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C1
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 C13
+ C13 C14
+ C14 C15
+ C15 O29
+ C15 O29B
+ C1 C16
+ C1 C17
+ C5 C18
+ C9 C19
+ C13 C20
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C7 H71
+ C8 H81
+ C10 H101
+ C11 H111
+ C12 H121
+ C14 H141
+ C16 H161
+ C16 H162
+ C16 H163
+ C17 H171
+ C17 H172
+ C17 H173
+ C18 H181
+ C18 H182
+ C18 H183
+ C19 H191
+ C19 H192
+ C19 H193
+ C20 H201
+ C20 H202
+ C20 H203
+ [ impropers ]
+ C15 O29B O29 C14
+
+[ RTAL ]
+ [ atoms ]
+ C1 CG301 0.000 0
+ C2 CG321 -0.180 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG321 -0.180 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ C4 CG321 -0.180 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG2DC2 0.000 10
+ C6 CG2DC2 0.000 11
+ C7 CG2DC1 -0.150 12
+ H71 HGA4 0.150 13
+ C8 CG2DC1 -0.150 14
+ H81 HGA4 0.150 15
+ C9 CG2DC2 0.000 16
+ C10 CG2DC2 -0.150 17
+ H101 HGA4 0.150 18
+ C11 CG2DC1 -0.150 19
+ H111 HGA4 0.150 20
+ C12 CG2DC1 -0.150 21
+ H121 HGA4 0.150 22
+ C13 CG2DC2 0.000 23
+ C14 CG2DC2 -0.040 24
+ H141 HGA4 0.150 25
+ C15 CG2O4 0.270 26
+ O15 OG2D1 -0.510 27
+ H15 HGR52 0.130 28
+ C16 CG331 -0.270 29
+ H161 HGA3 0.090 30
+ H162 HGA3 0.090 31
+ H163 HGA3 0.090 32
+ C17 CG331 -0.270 33
+ H171 HGA3 0.090 34
+ H172 HGA3 0.090 35
+ H173 HGA3 0.090 36
+ C18 CG331 -0.270 37
+ H181 HGA3 0.090 38
+ H182 HGA3 0.090 39
+ H183 HGA3 0.090 40
+ C19 CG331 -0.270 41
+ H191 HGA3 0.090 42
+ H192 HGA3 0.090 43
+ H193 HGA3 0.090 44
+ C20 CG331 -0.270 45
+ H201 HGA3 0.090 46
+ H202 HGA3 0.090 47
+ H203 HGA3 0.090 48
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C1
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 C13
+ C13 C14
+ C14 C15
+ C15 O15
+ C15 H15
+ C1 C16
+ C1 C17
+ C5 C18
+ C9 C19
+ C13 C20
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C7 H71
+ C8 H81
+ C10 H101
+ C11 H111
+ C12 H121
+ C14 H141
+ C16 H161
+ C16 H162
+ C16 H163
+ C17 H171
+ C17 H172
+ C17 H173
+ C18 H181
+ C18 H182
+ C18 H183
+ C19 H191
+ C19 H192
+ C19 H193
+ C20 H201
+ C20 H202
+ C20 H203
+ [ impropers ]
+ C15 C14 O15 H15
+
+[ RTOL ]
+ [ atoms ]
+ C1 CG301 0.000 0
+ C2 CG321 -0.180 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG321 -0.180 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ C4 CG321 -0.180 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG2DC2 0.000 10
+ C6 CG2DC2 0.000 11
+ C7 CG2DC1 -0.150 12
+ H71 HGA4 0.150 13
+ C8 CG2DC1 -0.150 14
+ H81 HGA4 0.150 15
+ C9 CG2DC2 0.000 16
+ C10 CG2DC2 -0.150 17
+ H101 HGA4 0.150 18
+ C11 CG2DC1 -0.150 19
+ H111 HGA4 0.150 20
+ C12 CG2DC1 -0.150 21
+ H121 HGA4 0.150 22
+ C13 CG2DC2 0.000 23
+ C14 CG2DC2 -0.150 24
+ H141 HGA4 0.150 25
+ C15 CG321 0.050 26
+ H151 HGA2 0.090 27
+ H152 HGA2 0.090 28
+ OR OG311 -0.650 29
+ HR HGP1 0.420 30
+ C16 CG331 -0.270 31
+ H161 HGA3 0.090 32
+ H162 HGA3 0.090 33
+ H163 HGA3 0.090 34
+ C17 CG331 -0.270 35
+ H171 HGA3 0.090 36
+ H172 HGA3 0.090 37
+ H173 HGA3 0.090 38
+ C18 CG331 -0.270 39
+ H181 HGA3 0.090 40
+ H182 HGA3 0.090 41
+ H183 HGA3 0.090 42
+ C19 CG331 -0.270 43
+ H191 HGA3 0.090 44
+ H192 HGA3 0.090 45
+ H193 HGA3 0.090 46
+ C20 CG331 -0.270 47
+ H201 HGA3 0.090 48
+ H202 HGA3 0.090 49
+ H203 HGA3 0.090 50
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C1
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C10 C11
+ C11 C12
+ C12 C13
+ C13 C14
+ C14 C15
+ C15 OR
+ C1 C16
+ C1 C17
+ C5 C18
+ C9 C19
+ C13 C20
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C7 H71
+ C8 H81
+ C10 H101
+ C11 H111
+ C12 H121
+ C14 H141
+ C15 H151
+ C15 H152
+ OR HR
+ C16 H161
+ C16 H162
+ C16 H163
+ C17 H171
+ C17 H172
+ C17 H173
+ C18 H181
+ C18 H182
+ C18 H183
+ C19 H191
+ C19 H192
+ C19 H193
+ C20 H201
+ C20 H202
+ C20 H203
+
+[ RUB ]
+ [ atoms ]
+ RUB RUB 1.000 0
+
+[ SAH ]
+ [ atoms ]
+ N NG3P3 -0.300 0
+ HT1 HGP2 0.330 1
+ HT2 HGP2 0.330 2
+ HT3 HGP2 0.330 3
+ CA CG314 0.210 4
+ HA HGA1 0.100 5
+ CB CG321 -0.180 6
+ HB1 HGA2 0.090 7
+ HB2 HGA2 0.090 8
+ CG CG321 -0.130 9
+ HG1 HGA2 0.090 10
+ HG2 HGA2 0.090 11
+ SD SG311 -0.100 12
+ C5' CG321 -0.130 13
+ H5' HGA2 0.090 14
+ H5'' HGA2 0.090 15
+ C CG2O3 0.340 16
+ OT1 OG2D2 -0.670 17
+ OT2 OG2D2 -0.670 18
+ C4' CG3C51 0.160 19
+ H4' HGA1 0.090 20
+ O4' OG3C51 -0.500 21
+ C1' CG3C51 0.160 22
+ H1' HGA1 0.090 23
+ N9 NG2R51 -0.050 24
+ C5 CG2RC0 0.280 25
+ N7 NG2R50 -0.710 26
+ C8 CG2R53 0.340 27
+ H8 HGR52 0.120 28
+ N1 NG2R62 -0.740 29
+ C2 CG2R64 0.500 30
+ H2 HGR62 0.130 31
+ N3 NG2R62 -0.750 32
+ C4 CG2RC0 0.430 33
+ C6 CG2R64 0.460 34
+ N6 NG2S3 -0.770 35
+ H61 HGP4 0.380 36
+ H62 HGP4 0.380 37
+ C2' CG3C51 0.140 38
+ H2'' HGA1 0.090 39
+ O2' OG311 -0.650 40
+ H2' HGP1 0.420 41
+ C3' CG3C51 0.140 42
+ H3' HGA1 0.090 43
+ O3' OG311 -0.650 44
+ H3T HGP1 0.420 45
+ [ bonds ]
+ C5' C4'
+ C4' O4'
+ C4' C3'
+ O4' C1'
+ C1' N9
+ C1' C2'
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C2' C3'
+ C2' O2'
+ O2' H2'
+ C3' O3'
+ C1' H1'
+ C2' H2''
+ C3' H3'
+ C4' H4'
+ C5' H5'
+ C5' H5''
+ C8 H8
+ C2 H2
+ N CA
+ O3' H3T
+ CB CA
+ CG CB
+ SD CG
+ C5' SD
+ C CA
+ CA HA
+ CB HB1
+ CB HB2
+ CG HG1
+ CG HG2
+ HT1 N
+ HT2 N
+ HT3 N
+ OT2 C
+ N1 C6
+ C2 N3
+ C4 C5
+ N7 C8
+ C OT1
+ [ impropers ]
+ N6 C6 H61 H62
+ C6 N1 C5 N6
+ OT1 CA OT2 C
+
+[ SAPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C12 CTL2 -0.100 1
+ H12A HL 0.250 2
+ H12B HL 0.250 3
+ C13 CTL5 -0.350 4
+ H13A HL 0.250 5
+ H13B HL 0.250 6
+ H13C HL 0.250 7
+ C14 CTL5 -0.350 8
+ H14A HL 0.250 9
+ H14B HL 0.250 10
+ H14C HL 0.250 11
+ C15 CTL5 -0.350 12
+ H15A HL 0.250 13
+ H15B HL 0.250 14
+ H15C HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O12 OSLP -0.570 22
+ O11 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CEL1 -0.150 50
+ H5R HEL1 0.150 51
+ C26 CEL1 -0.150 52
+ H6R HEL1 0.150 53
+ C27 CTL2 -0.180 54
+ H7R HAL2 0.090 55
+ H7S HAL2 0.090 56
+ C28 CEL1 -0.150 57
+ H8R HEL1 0.150 58
+ C29 CEL1 -0.150 59
+ H9R HEL1 0.150 60
+ C210 CTL2 -0.180 61
+ H10R HAL2 0.090 62
+ H10S HAL2 0.090 63
+ C211 CEL1 -0.150 64
+ H11R HEL1 0.150 65
+ C212 CEL1 -0.150 66
+ H12R HEL1 0.150 67
+ C213 CTL2 -0.180 68
+ H13R HAL2 0.090 69
+ H13S HAL2 0.090 70
+ C214 CEL1 -0.150 71
+ H14R HEL1 0.150 72
+ C215 CEL1 -0.150 73
+ H15R HEL1 0.150 74
+ C216 CTL2 -0.180 75
+ H16R HAL2 0.090 76
+ H16S HAL2 0.090 77
+ C217 CTL2 -0.180 78
+ H17R HAL2 0.090 79
+ H17S HAL2 0.090 80
+ C218 CTL2 -0.270 81
+ H18R HAL2 0.090 82
+ H18S HAL2 0.090 83
+ C219 CTL2 -0.180 84
+ H19R HAL2 0.090 85
+ H19S HAL2 0.090 86
+ C220 CTL3 -0.180 87
+ H20R HAL3 0.090 88
+ H20S HAL3 0.090 89
+ H20T HAL3 0.090 90
+ C33 CTL2 -0.180 91
+ H3X HAL2 0.090 92
+ H3Y HAL2 0.090 93
+ C34 CTL2 -0.180 94
+ H4X HAL2 0.090 95
+ H4Y HAL2 0.090 96
+ C35 CTL2 -0.180 97
+ H5X HAL2 0.090 98
+ H5Y HAL2 0.090 99
+ C36 CTL2 -0.180 100
+ H6X HAL2 0.090 101
+ H6Y HAL2 0.090 102
+ C37 CTL2 -0.180 103
+ H7X HAL2 0.090 104
+ H7Y HAL2 0.090 105
+ C38 CTL2 -0.180 106
+ H8X HAL2 0.090 107
+ H8Y HAL2 0.090 108
+ C39 CTL2 -0.180 109
+ H9X HAL2 0.090 110
+ H9Y HAL2 0.090 111
+ C310 CTL2 -0.180 112
+ H10X HAL2 0.090 113
+ H10Y HAL2 0.090 114
+ C311 CTL2 -0.180 115
+ H11X HAL2 0.090 116
+ H11Y HAL2 0.090 117
+ C312 CTL2 -0.180 118
+ H12X HAL2 0.090 119
+ H12Y HAL2 0.090 120
+ C313 CTL2 -0.180 121
+ H13X HAL2 0.090 122
+ H13Y HAL2 0.090 123
+ C314 CTL2 -0.180 124
+ H14X HAL2 0.090 125
+ H14Y HAL2 0.090 126
+ C315 CTL2 -0.180 127
+ H15X HAL2 0.090 128
+ H15Y HAL2 0.090 129
+ C316 CTL2 -0.180 130
+ H16X HAL2 0.090 131
+ H16Y HAL2 0.090 132
+ C317 CTL2 -0.180 133
+ H17X HAL2 0.090 134
+ H17Y HAL2 0.090 135
+ C318 CTL3 -0.270 136
+ H18X HAL3 0.090 137
+ H18Y HAL3 0.090 138
+ H18Z HAL3 0.090 139
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C26 H6R
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C29 H9R
+ C29 C210
+ C210 H10R
+ C210 H10S
+ C210 C211
+ C211 H11R
+ C212 H12R
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C215 H15R
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 C219
+ C219 H19R
+ C219 H19S
+ C219 C220
+ C220 H20R
+ C220 H20S
+ C220 H20T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C25 C26
+ C28 C29
+ C211 C212
+ C214 C215
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ SCH1 ]
+ [ atoms ]
+ C1 CG331 -0.050 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ N2 NG2D1 -0.600 4
+ C3 CG2D1 0.230 5
+ H31 HGA4 0.150 6
+ C4 CG331 -0.270 7
+ H41 HGA3 0.090 8
+ H42 HGA3 0.090 9
+ H43 HGA3 0.090 10
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 N2
+ N2 C3
+ C3 H31
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 H43
+ [ impropers ]
+ C3 C4 N2 H31
+
+[ SCH2 ]
+ [ atoms ]
+ C1 CG334 0.180 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ N2 NG2P1 -0.400 4
+ H21 HGP2 0.380 5
+ C3 CG2D1 0.370 6
+ H31 HGR52 0.200 7
+ C4 CG331 -0.270 8
+ H41 HGA3 0.090 9
+ H42 HGA3 0.090 10
+ H43 HGA3 0.090 11
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 N2
+ N2 H21
+ N2 C3
+ C3 H31
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 H43
+ [ impropers ]
+ C3 C4 N2 H31
+
+[ SCH3 ]
+ [ atoms ]
+ C1 CG334 0.180 0
+ H11 HGA3 0.090 1
+ H12 HGA3 0.090 2
+ H13 HGA3 0.090 3
+ N2 NG2P1 -0.400 4
+ H21 HGP2 0.380 5
+ C3 CG2DC1 0.370 6
+ H31 HGR52 0.200 7
+ C4 CG2DC2 -0.150 8
+ H41 HGA4 0.150 9
+ C5 CG2DC3 -0.420 10
+ H51 HGA5 0.210 11
+ H52 HGA5 0.210 12
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 N2
+ N2 H21
+ N2 C3
+ C3 H31
+ C3 C4
+ C4 H41
+ C4 C5
+ C5 H51
+ C5 H52
+ [ impropers ]
+ C3 C4 N2 H31
+
+[ SDPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C12 CTL2 -0.100 1
+ H12A HL 0.250 2
+ H12B HL 0.250 3
+ C13 CTL5 -0.350 4
+ H13A HL 0.250 5
+ H13B HL 0.250 6
+ H13C HL 0.250 7
+ C14 CTL5 -0.350 8
+ H14A HL 0.250 9
+ H14B HL 0.250 10
+ H14C HL 0.250 11
+ C15 CTL5 -0.350 12
+ H15A HL 0.250 13
+ H15B HL 0.250 14
+ H15C HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O12 OSLP -0.570 22
+ O11 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CEL1 -0.150 47
+ H4R HEL1 0.150 48
+ C25 CEL1 -0.150 49
+ H5R HEL1 0.150 50
+ C26 CTL2 -0.180 51
+ H6R HAL2 0.090 52
+ H6S HAL2 0.090 53
+ C27 CEL1 -0.150 54
+ H7R HEL1 0.150 55
+ C28 CEL1 -0.150 56
+ H8R HEL1 0.150 57
+ C29 CTL2 -0.180 58
+ H9R HAL2 0.090 59
+ H9S HAL2 0.090 60
+ C210 CEL1 -0.150 61
+ H10R HEL1 0.150 62
+ C211 CEL1 -0.150 63
+ H11R HEL1 0.150 64
+ C212 CTL2 -0.180 65
+ H12R HAL2 0.090 66
+ H12S HAL2 0.090 67
+ C213 CEL1 -0.150 68
+ H13R HEL1 0.150 69
+ C214 CEL1 -0.150 70
+ H14R HEL1 0.150 71
+ C215 CTL2 -0.180 72
+ H15R HAL2 0.090 73
+ H15S HAL2 0.090 74
+ C216 CEL1 -0.150 75
+ H16R HEL1 0.150 76
+ C217 CEL1 -0.150 77
+ H17R HEL1 0.150 78
+ C218 CTL2 -0.180 79
+ H18R HAL2 0.090 80
+ H18S HAL2 0.090 81
+ C219 CEL1 -0.150 82
+ H19R HEL1 0.150 83
+ C220 CEL1 -0.150 84
+ H20R HEL1 0.150 85
+ C221 CTL2 -0.180 86
+ H21R HAL2 0.090 87
+ H21S HAL2 0.090 88
+ C222 CTL3 -0.270 89
+ H22R HAL3 0.090 90
+ H22S HAL3 0.090 91
+ H22T HAL3 0.090 92
+ C33 CTL2 -0.180 93
+ H3X HAL2 0.090 94
+ H3Y HAL2 0.090 95
+ C34 CTL2 -0.180 96
+ H4X HAL2 0.090 97
+ H4Y HAL2 0.090 98
+ C35 CTL2 -0.180 99
+ H5X HAL2 0.090 100
+ H5Y HAL2 0.090 101
+ C36 CTL2 -0.180 102
+ H6X HAL2 0.090 103
+ H6Y HAL2 0.090 104
+ C37 CTL2 -0.180 105
+ H7X HAL2 0.090 106
+ H7Y HAL2 0.090 107
+ C38 CTL2 -0.180 108
+ H8X HAL2 0.090 109
+ H8Y HAL2 0.090 110
+ C39 CTL2 -0.180 111
+ H9X HAL2 0.090 112
+ H9Y HAL2 0.090 113
+ C310 CTL2 -0.180 114
+ H10X HAL2 0.090 115
+ H10Y HAL2 0.090 116
+ C311 CTL2 -0.180 117
+ H11X HAL2 0.090 118
+ H11Y HAL2 0.090 119
+ C312 CTL2 -0.180 120
+ H12X HAL2 0.090 121
+ H12Y HAL2 0.090 122
+ C313 CTL2 -0.180 123
+ H13X HAL2 0.090 124
+ H13Y HAL2 0.090 125
+ C314 CTL2 -0.180 126
+ H14X HAL2 0.090 127
+ H14Y HAL2 0.090 128
+ C315 CTL2 -0.180 129
+ H15X HAL2 0.090 130
+ H15Y HAL2 0.090 131
+ C316 CTL2 -0.180 132
+ H16X HAL2 0.090 133
+ H16Y HAL2 0.090 134
+ C317 CTL2 -0.180 135
+ H17X HAL2 0.090 136
+ H17Y HAL2 0.090 137
+ C318 CTL3 -0.270 138
+ H18X HAL3 0.090 139
+ H18Y HAL3 0.090 140
+ H18Z HAL3 0.090 141
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C25 H5R
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C28 H8R
+ C28 C29
+ C29 H9R
+ C29 H9S
+ C29 C210
+ C210 H10R
+ C211 H11R
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C214 H14R
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C217 H17R
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 C219
+ C219 H19R
+ C220 H20R
+ C220 C221
+ C221 H21R
+ C221 H21S
+ C221 C222
+ C222 H22R
+ C222 H22S
+ C222 H22T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C24 C25
+ C27 C28
+ C210 C211
+ C213 C214
+ C216 C217
+ C219 C220
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ SDS ]
+ [ atoms ]
+ S SL 1.330 0
+ OS1 OSL -0.280 1
+ OS2 O2L -0.650 2
+ OS3 O2L -0.650 3
+ OS4 O2L -0.650 4
+ C1 CTL2 -0.280 5
+ H11 HAL2 0.090 6
+ H12 HAL2 0.090 7
+ C2 CTL2 -0.180 8
+ H21 HAL2 0.090 9
+ H22 HAL2 0.090 10
+ C3 CTL2 -0.180 11
+ H31 HAL2 0.090 12
+ H32 HAL2 0.090 13
+ C4 CTL2 -0.180 14
+ H41 HAL2 0.090 15
+ H42 HAL2 0.090 16
+ C5 CTL2 -0.180 17
+ H51 HAL2 0.090 18
+ H52 HAL2 0.090 19
+ C6 CTL2 -0.180 20
+ H61 HAL2 0.090 21
+ H62 HAL2 0.090 22
+ C7 CTL2 -0.180 23
+ H71 HAL2 0.090 24
+ H72 HAL2 0.090 25
+ C8 CTL2 -0.180 26
+ H81 HAL2 0.090 27
+ H82 HAL2 0.090 28
+ C9 CTL2 -0.180 29
+ H91 HAL2 0.090 30
+ H92 HAL2 0.090 31
+ C10 CTL2 -0.180 32
+ H101 HAL2 0.090 33
+ H102 HAL2 0.090 34
+ C11 CTL2 -0.180 35
+ H111 HAL2 0.090 36
+ H112 HAL2 0.090 37
+ C12 CTL3 -0.270 38
+ H121 HAL3 0.090 39
+ H122 HAL3 0.090 40
+ H123 HAL3 0.090 41
+ [ bonds ]
+ S OS1
+ S OS2
+ S OS3
+ S OS4
+ OS1 C1
+ C1 H11
+ C1 H12
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 C3
+ C3 H31
+ C3 H32
+ C3 C4
+ C4 H41
+ C4 H42
+ C4 C5
+ C5 H51
+ C5 H52
+ C5 C6
+ C6 H61
+ C6 H62
+ C6 C7
+ C7 H71
+ C7 H72
+ C7 C8
+ C8 H81
+ C8 H82
+ C8 C9
+ C9 H91
+ C9 H92
+ C9 C10
+ C10 H101
+ C10 H102
+ C10 C11
+ C11 H111
+ C11 H112
+ C11 C12
+ C12 H121
+ C12 H122
+ C12 H123
+
+
+
+; monoanionic phosphoserine
+[ SP1 ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.080 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ OG ON2 -0.620 7
+ P P 1.500 8
+ O1P ON3 -0.820 9
+ O2P ON3 -0.820 10
+ OT ON4 -0.680 11
+ HT HN4 0.340 12
+ C C 0.510 13
+ O O -0.510 14
+ [ bonds ]
+ CB CA
+ OG CB
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ OG P
+ P O1P
+ P O2P
+ P OT
+ OT HT
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+
+
+; dianionic phosphoserine
+[ SP2 ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ OG ON2 -0.400 7
+ P P 1.100 8
+ O1P ON3 -0.900 9
+ O2P ON3 -0.900 10
+ OT ON3 -0.900 11
+ C C 0.510 12
+ O O -0.510 13
+ [ bonds ]
+ CB CA
+ OG CB
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ OG P
+ P O1P
+ P O2P
+ P OT
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ SER ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 0.050 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ OG OH1 -0.660 7
+ HG1 H 0.430 8
+ C C 0.510 9
+ O O -0.510 10
+ [ bonds ]
+ CB CA
+ OG CB
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ OG HG1
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ SOD ]
+ [ atoms ]
+ SOD SOD 1.000 0
+
+[ SOPC ]
+ [ atoms ]
+ N NTL -0.600 0
+ C12 CTL2 -0.100 1
+ H12A HL 0.250 2
+ H12B HL 0.250 3
+ C13 CTL5 -0.350 4
+ H13A HL 0.250 5
+ H13B HL 0.250 6
+ H13C HL 0.250 7
+ C14 CTL5 -0.350 8
+ H14A HL 0.250 9
+ H14B HL 0.250 10
+ H14C HL 0.250 11
+ C15 CTL5 -0.350 12
+ H15A HL 0.250 13
+ H15B HL 0.250 14
+ H15C HL 0.250 15
+ C11 CTL2 -0.080 16
+ H11A HAL2 0.090 17
+ H11B HAL2 0.090 18
+ P PL 1.500 19
+ O13 O2L -0.780 20
+ O14 O2L -0.780 21
+ O12 OSLP -0.570 22
+ O11 OSLP -0.570 23
+ C1 CTL2 -0.080 24
+ HA HAL2 0.090 25
+ HB HAL2 0.090 26
+ C2 CTL1 0.170 27
+ HS HAL1 0.090 28
+ O21 OSL -0.490 29
+ C21 CL 0.900 30
+ O22 OBL -0.630 31
+ C22 CTL2 -0.220 32
+ H2R HAL2 0.090 33
+ H2S HAL2 0.090 34
+ C3 CTL2 0.080 35
+ HX HAL2 0.090 36
+ HY HAL2 0.090 37
+ O31 OSL -0.490 38
+ C31 CL 0.900 39
+ O32 OBL -0.630 40
+ C32 CTL2 -0.220 41
+ H2X HAL2 0.090 42
+ H2Y HAL2 0.090 43
+ C23 CTL2 -0.180 44
+ H3R HAL2 0.090 45
+ H3S HAL2 0.090 46
+ C24 CTL2 -0.180 47
+ H4R HAL2 0.090 48
+ H4S HAL2 0.090 49
+ C25 CTL2 -0.180 50
+ H5R HAL2 0.090 51
+ H5S HAL2 0.090 52
+ C26 CTL2 -0.180 53
+ H6R HAL2 0.090 54
+ H6S HAL2 0.090 55
+ C27 CTL2 -0.180 56
+ H7R HAL2 0.090 57
+ H7S HAL2 0.090 58
+ C28 CTL2 -0.180 59
+ H8R HAL2 0.090 60
+ H8S HAL2 0.090 61
+ C29 CEL1 -0.150 62
+ H91 HEL1 0.150 63
+ C210 CEL1 -0.150 64
+ H101 HEL1 0.150 65
+ C211 CTL2 -0.180 66
+ H11R HAL2 0.090 67
+ H11S HAL2 0.090 68
+ C212 CTL2 -0.180 69
+ H12R HAL2 0.090 70
+ H12S HAL2 0.090 71
+ C213 CTL2 -0.180 72
+ H13R HAL2 0.090 73
+ H13S HAL2 0.090 74
+ C214 CTL2 -0.180 75
+ H14R HAL2 0.090 76
+ H14S HAL2 0.090 77
+ C215 CTL2 -0.180 78
+ H15R HAL2 0.090 79
+ H15S HAL2 0.090 80
+ C216 CTL2 -0.180 81
+ H16R HAL2 0.090 82
+ H16S HAL2 0.090 83
+ C217 CTL2 -0.180 84
+ H17R HAL2 0.090 85
+ H17S HAL2 0.090 86
+ C218 CTL3 -0.270 87
+ H18R HAL3 0.090 88
+ H18S HAL3 0.090 89
+ H18T HAL3 0.090 90
+ C33 CTL2 -0.180 91
+ H3X HAL2 0.090 92
+ H3Y HAL2 0.090 93
+ C34 CTL2 -0.180 94
+ H4X HAL2 0.090 95
+ H4Y HAL2 0.090 96
+ C35 CTL2 -0.180 97
+ H5X HAL2 0.090 98
+ H5Y HAL2 0.090 99
+ C36 CTL2 -0.180 100
+ H6X HAL2 0.090 101
+ H6Y HAL2 0.090 102
+ C37 CTL2 -0.180 103
+ H7X HAL2 0.090 104
+ H7Y HAL2 0.090 105
+ C38 CTL2 -0.180 106
+ H8X HAL2 0.090 107
+ H8Y HAL2 0.090 108
+ C39 CTL2 -0.180 109
+ H9X HAL2 0.090 110
+ H9Y HAL2 0.090 111
+ C310 CTL2 -0.180 112
+ H10X HAL2 0.090 113
+ H10Y HAL2 0.090 114
+ C311 CTL2 -0.180 115
+ H11X HAL2 0.090 116
+ H11Y HAL2 0.090 117
+ C312 CTL2 -0.180 118
+ H12X HAL2 0.090 119
+ H12Y HAL2 0.090 120
+ C313 CTL2 -0.180 121
+ H13X HAL2 0.090 122
+ H13Y HAL2 0.090 123
+ C314 CTL2 -0.180 124
+ H14X HAL2 0.090 125
+ H14Y HAL2 0.090 126
+ C315 CTL2 -0.180 127
+ H15X HAL2 0.090 128
+ H15Y HAL2 0.090 129
+ C316 CTL2 -0.180 130
+ H16X HAL2 0.090 131
+ H16Y HAL2 0.090 132
+ C317 CTL2 -0.180 133
+ H17X HAL2 0.090 134
+ H17Y HAL2 0.090 135
+ C318 CTL3 -0.270 136
+ H18X HAL3 0.090 137
+ H18Y HAL3 0.090 138
+ H18Z HAL3 0.090 139
+ [ bonds ]
+ N C13
+ N C14
+ N C15
+ C13 H13A
+ C13 H13B
+ C13 H13C
+ C14 H14A
+ C14 H14B
+ C14 H14C
+ C15 H15A
+ C15 H15B
+ C15 H15C
+ N C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 O12
+ O11 C1
+ O12 P
+ P O11
+ P O13
+ P O14
+ C1 HA
+ C1 HB
+ C1 C2
+ C2 HS
+ C2 C3
+ C2 O21
+ C3 HX
+ C3 HY
+ C3 O31
+ O21 C21
+ C21 C22
+ C22 H2R
+ C22 H2S
+ C22 C23
+ C23 H3R
+ C23 H3S
+ C23 C24
+ C24 H4R
+ C24 H4S
+ C24 C25
+ C25 H5R
+ C25 H5S
+ C25 C26
+ C26 H6R
+ C26 H6S
+ C26 C27
+ C27 H7R
+ C27 H7S
+ C27 C28
+ C28 H8R
+ C28 H8S
+ C28 C29
+ C29 H91
+ C210 H101
+ C210 C211
+ C211 H11R
+ C211 H11S
+ C211 C212
+ C212 H12R
+ C212 H12S
+ C212 C213
+ C213 H13R
+ C213 H13S
+ C213 C214
+ C214 H14R
+ C214 H14S
+ C214 C215
+ C215 H15R
+ C215 H15S
+ C215 C216
+ C216 H16R
+ C216 H16S
+ C216 C217
+ C217 H17R
+ C217 H17S
+ C217 C218
+ C218 H18R
+ C218 H18S
+ C218 H18T
+ O31 C31
+ C31 C32
+ C32 H2X
+ C32 H2Y
+ C32 C33
+ C33 H3X
+ C33 H3Y
+ C33 C34
+ C34 H4X
+ C34 H4Y
+ C34 C35
+ C35 H5X
+ C35 H5Y
+ C35 C36
+ C36 H6X
+ C36 H6Y
+ C36 C37
+ C37 H7X
+ C37 H7Y
+ C37 C38
+ C38 H8X
+ C38 H8Y
+ C38 C39
+ C39 H9X
+ C39 H9Y
+ C39 C310
+ C310 H10X
+ C310 H10Y
+ C310 C311
+ C311 H11X
+ C311 H11Y
+ C311 C312
+ C312 H12X
+ C312 H12Y
+ C312 C313
+ C313 H13X
+ C313 H13Y
+ C313 C314
+ C314 H14X
+ C314 H14Y
+ C314 C315
+ C315 H15X
+ C315 H15Y
+ C315 C316
+ C316 H16X
+ C316 H16Y
+ C316 C317
+ C317 H17X
+ C317 H17Y
+ C317 C318
+ C318 H18X
+ C318 H18Y
+ C318 H18Z
+ C21 O22
+ C29 C210
+ C31 O32
+ [ impropers ]
+ C21 O21 C22 O22
+ C31 O31 C32 O32
+
+[ STYR ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ CG2R61 0.000 10
+ C1 CG2DC1 -0.150 11
+ H1 HGA4 0.150 12
+ C2 CG2DC3 -0.420 13
+ H21 HGA5 0.210 14
+ H22 HGA5 0.210 15
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ C1
+ C1 C2
+ C1 H1
+ C2 H21
+ C2 H22
+
+[ T2FD ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.050 1
+ C4' CG3C52 0.020 2
+ H11' HGA2 0.090 3
+ H12' HGA2 0.090 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C51 0.050 7
+ H21' HGA6 0.110 8
+ F2' FGA1 -0.220 9
+ C3' CG3C51 -0.060 10
+ H31' HGA1 0.090 11
+ O3' OG303 -0.400 12
+ P PG2 1.100 13
+ O1P OG2P1 -0.900 14
+ O2P OG2P1 -0.900 15
+ O3P OG2P1 -0.900 16
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' F2'
+ C2' H21'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+
+[ T2FU ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.050 1
+ C4' CG3C52 0.020 2
+ H11' HGA2 0.090 3
+ H12' HGA2 0.090 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C51 0.050 7
+ H22' HGA6 0.110 8
+ F2' FGA1 -0.220 9
+ C3' CG3C51 -0.060 10
+ H31' HGA1 0.090 11
+ O3' OG303 -0.400 12
+ P PG2 1.100 13
+ O1P OG2P1 -0.900 14
+ O2P OG2P1 -0.900 15
+ O3P OG2P1 -0.900 16
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' F2'
+ C2' H22'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+
+[ T3PH ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C52 0.020 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C52 -0.180 7
+ H21' HGA2 0.090 8
+ H22' HGA2 0.090 9
+ C3' CG3C51 0.010 10
+ H31' HGA1 0.090 11
+ O3' OG303 -0.620 12
+ P PG1 1.500 13
+ O1P OG2P1 -0.820 14
+ O2P OG2P1 -0.820 15
+ O3T OG311 -0.670 16
+ H3T HGP1 0.330 17
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3T
+ O3T H3T
+
+[ T3PM ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C52 0.020 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C52 -0.180 7
+ H21' HGA2 0.090 8
+ H22' HGA2 0.090 9
+ C3' CG3C51 0.010 10
+ H31' HGA1 0.090 11
+ O3' OG303 -0.570 12
+ P PG1 1.500 13
+ O1P OG2P1 -0.780 14
+ O2P OG2P1 -0.780 15
+ O3T OG303 -0.570 16
+ C3T CG331 -0.170 17
+ H3T1 HGA3 0.090 18
+ H3T2 HGA3 0.090 19
+ H3T3 HGA3 0.090 20
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3T
+ O3T C3T
+ C3T H3T1
+ C3T H3T2
+ C3T H3T3
+
+[ T5PH ]
+ [ atoms ]
+ C5' CG321 -0.080 0
+ H5' HGA2 0.090 1
+ H5'' HGA2 0.090 2
+ O5' OG303 -0.620 3
+ P PG1 1.500 4
+ O1P OG2P1 -0.820 5
+ O2P OG2P1 -0.820 6
+ O3P OG311 -0.670 7
+ H5T HGP1 0.330 8
+ O4' OG3C51 -0.400 9
+ C1' CG3C52 0.020 10
+ H1' HGA2 0.090 11
+ H1'' HGA2 0.090 12
+ C4' CG3C51 0.110 13
+ H4'' HGA1 0.090 14
+ C2' CG3C52 -0.180 15
+ H2' HGA2 0.090 16
+ H2'' HGA2 0.090 17
+ C3' CG3C52 -0.180 18
+ H3' HGA2 0.090 19
+ H3'' HGA2 0.090 20
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C1' H1'
+ C1' H1''
+ C2' H2'
+ C2' H2''
+ C3' H3'
+ C3' H3''
+ C4' H4''
+ C5' H5'
+ C5' H5''
+ C5' O5'
+ O5' P
+ P O1P
+ P O2P
+ P O3P
+ O3P H5T
+
+[ TADE ]
+ [ atoms ]
+ C5 CG2RC0 0.280 0
+ N7 NG2R50 -0.710 1
+ C8 CG2R53 0.340 2
+ H8 HGR52 0.120 3
+ N9 NG2R51 -0.050 4
+ N1 NG2R62 -0.740 5
+ C2 CG2R64 0.500 6
+ H2 HGR62 0.130 7
+ N3 NG2R62 -0.750 8
+ C4 CG2RC0 0.430 9
+ C6 CG2R64 0.460 10
+ N6 NG2S3 -0.770 11
+ H61 HGP4 0.380 12
+ H62 HGP4 0.380 13
+ O4' OG3C51 -0.400 14
+ C1' CG3C51 0.110 15
+ H12' HGA1 0.090 16
+ C4' CG3C52 0.020 17
+ H41' HGA2 0.090 18
+ H42' HGA2 0.090 19
+ C2' CG3C52 -0.180 20
+ H21' HGA2 0.090 21
+ H22' HGA2 0.090 22
+ C3' CG3C52 -0.180 23
+ H31' HGA2 0.090 24
+ H32' HGA2 0.090 25
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C3' H32'
+ C4' H41'
+ C4' H42'
+ C1' N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C8 H8
+ C2 H2
+ N1 C6
+ C2 N3
+ C4 C5
+ N7 C8
+ [ impropers ]
+ C6 C5 N1 N6
+ N6 H62 H61 C6
+
+[ TBOH ]
+ [ atoms ]
+ C CG301 0.230 0
+ O OG311 -0.650 1
+ HO HGP1 0.420 2
+ C1 CG331 -0.270 3
+ H11 HGA3 0.090 4
+ H12 HGA3 0.090 5
+ H13 HGA3 0.090 6
+ C2 CG331 -0.270 7
+ H21 HGA3 0.090 8
+ H22 HGA3 0.090 9
+ H23 HGA3 0.090 10
+ C3 CG331 -0.270 11
+ H31 HGA3 0.090 12
+ H32 HGA3 0.090 13
+ H33 HGA3 0.090 14
+ [ bonds ]
+ C1 C
+ C2 C
+ C3 C
+ C O
+ O HO
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ TBRE ]
+ [ atoms ]
+ C1 CG301 -0.120 0
+ BR11 BRGA3 -0.010 1
+ BR12 BRGA3 -0.010 2
+ BR13 BRGA3 -0.010 3
+ C2 CG331 -0.120 4
+ H21 HGA3 0.090 5
+ H22 HGA3 0.090 6
+ H23 HGA3 0.090 7
+ [ bonds ]
+ C1 BR11
+ C1 BR12
+ C1 BR13
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ TC243C ]
+ [ atoms ]
+ H10 HGR62 0.150 0
+ H3 HGR61 0.115 1
+ H2 HGR61 0.115 2
+ H1 HGR61 0.115 3
+ H6 HGR61 0.115 4
+ H9 HGP1 0.350 5
+ C10 CG2R64 0.440 6
+ N11 NG2R62 -0.770 7
+ C4 CG2R62 0.340 8
+ C3 CG2R61 -0.115 9
+ C2 CG2R61 -0.115 10
+ C1 CG2R61 -0.115 11
+ C6 CG2R61 -0.115 12
+ C5 CG2R62 0.190 13
+ C8 CG2R63 0.090 14
+ O8 OG2D4 -0.400 15
+ N9 NG2R61 -0.390 16
+ [ bonds ]
+ C10 H10
+ C10 N11
+ C10 N9
+ N11 C4
+ C4 C3
+ C4 C5
+ C3 H3
+ C3 C2
+ C2 H2
+ C2 C1
+ C1 H1
+ C1 C6
+ C6 H6
+ C6 C5
+ C5 C8
+ C8 O8
+ C8 N9
+ N9 H9
+ [ impropers ]
+ C8 C5 N9 O8
+
+[ TCLE ]
+ [ atoms ]
+ C1 CG301 -0.240 0
+ CL11 CLGA3 0.140 1
+ CL12 CLGA3 0.140 2
+ CL13 CLGA3 0.140 3
+ C2 CG331 -0.450 4
+ H21 HGA3 0.090 5
+ H22 HGA3 0.090 6
+ H23 HGA3 0.090 7
+ [ bonds ]
+ C1 CL11
+ C1 CL12
+ C1 CL13
+ C1 C2
+ C2 H21
+ C2 H22
+ C2 H23
+
+[ TCYT ]
+ [ atoms ]
+ N1 NG2R61 -0.130 0
+ C6 CG2R62 0.050 1
+ H6 HGR62 0.170 2
+ C2 CG2R63 0.520 3
+ O2 OG2D4 -0.490 4
+ N3 NG2R62 -0.660 5
+ C4 CG2R64 0.650 6
+ N4 NG2S3 -0.750 7
+ H41 HGP4 0.370 8
+ H42 HGP4 0.330 9
+ C5 CG2R62 -0.130 10
+ H5 HGR62 0.070 11
+ O4' OG3C51 -0.400 12
+ C1' CG3C51 0.110 13
+ H12' HGA1 0.090 14
+ C4' CG3C52 0.020 15
+ H41' HGA2 0.090 16
+ H42' HGA2 0.090 17
+ C2' CG3C52 -0.180 18
+ H21' HGA2 0.090 19
+ H22' HGA2 0.090 20
+ C3' CG3C52 -0.180 21
+ H31' HGA2 0.090 22
+ H32' HGA2 0.090 23
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C3' H32'
+ C4' H41'
+ C4' H42'
+ C1' N1
+ N1 C2
+ N1 C6
+ C4 N4
+ N4 H41
+ N4 H42
+ C2 N3
+ C4 C5
+ C5 H5
+ C6 H6
+ C2 O2
+ C5 C6
+ N3 C4
+ [ impropers ]
+ C4 C5 N3 N4
+ C2 N1 N3 O2
+ N4 H42 H41 C4
+
+[ TEA ]
+ [ atoms ]
+ N NG3P0 -0.600 0
+ C1 CG324 -0.100 1
+ C2 CG324 -0.100 2
+ C3 CG324 -0.100 3
+ C4 CG324 -0.100 4
+ H11 HGP5 0.250 5
+ H12 HGP5 0.250 6
+ H21 HGP5 0.250 7
+ H22 HGP5 0.250 8
+ H31 HGP5 0.250 9
+ H32 HGP5 0.250 10
+ H41 HGP5 0.250 11
+ H42 HGP5 0.250 12
+ C5 CG331 -0.270 13
+ H51 HGA3 0.090 14
+ H52 HGA3 0.090 15
+ H53 HGA3 0.090 16
+ C6 CG331 -0.270 17
+ H61 HGA3 0.090 18
+ H62 HGA3 0.090 19
+ H63 HGA3 0.090 20
+ C7 CG331 -0.270 21
+ H71 HGA3 0.090 22
+ H72 HGA3 0.090 23
+ H73 HGA3 0.090 24
+ C8 CG331 -0.270 25
+ H81 HGA3 0.090 26
+ H82 HGA3 0.090 27
+ H83 HGA3 0.090 28
+ [ bonds ]
+ N C1
+ N C2
+ N C3
+ N C4
+ C1 H11
+ C1 H12
+ C1 C5
+ C2 H21
+ C2 H22
+ C2 C6
+ C3 H31
+ C3 H32
+ C3 C7
+ C4 H41
+ C4 H42
+ C4 C8
+ C5 H51
+ C5 H52
+ C5 H53
+ C6 H61
+ C6 H62
+ C6 H63
+ C7 H71
+ C7 H72
+ C7 H73
+ C8 H81
+ C8 H82
+ C8 H83
+
+[ TF2M ]
+ [ atoms ]
+ O1 OC305A -0.400 0
+ C1 CC325B 0.110 1
+ H1A HCA25A 0.090 2
+ C2 CC325B -0.180 3
+ H2A HCA25A 0.090 4
+ H2B HCA25A 0.090 5
+ C3 CC325B -0.180 6
+ H3A HCA25A 0.090 7
+ H3B HCA25A 0.090 8
+ C4 CC325B 0.020 9
+ H4A HCA25A 0.090 10
+ H4B HCA25A 0.090 11
+ C5 CC33A -0.270 12
+ H5A HCA3A 0.090 13
+ H5B HCA3A 0.090 14
+ H5C HCA3A 0.090 15
+ [ bonds ]
+ O1 C1
+ C1 H1A
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C3 H3A
+ C3 H3B
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 O1
+ C1 C5
+ C5 H5A
+ C5 H5B
+ C5 H5C
+
+[ TFE ]
+ [ atoms ]
+ O1 OG311 -0.590 0
+ HO1 HGP1 0.410 1
+ H11 HGA2 0.090 2
+ H12 HGA2 0.090 3
+ C1 CG321 0.080 4
+ F21 FGA3 -0.140 5
+ F22 FGA3 -0.140 6
+ F23 FGA3 -0.140 7
+ C2 CG302 0.340 8
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 O1
+ O1 HO1
+ C1 C2
+ C2 F21
+ C2 F22
+ C2 F23
+
+[ TFET ]
+ [ atoms ]
+ H11 HGA3 0.090 0
+ H12 HGA3 0.090 1
+ H13 HGA3 0.090 2
+ C1 CG331 -0.200 3
+ F21 FGA3 -0.150 4
+ F22 FGA3 -0.150 5
+ F23 FGA3 -0.150 6
+ C2 CG302 0.380 7
+ [ bonds ]
+ C1 H11
+ C1 H12
+ C1 H13
+ C1 C2
+ C2 F21
+ C2 F22
+ C2 F23
+
+[ TGUA ]
+ [ atoms ]
+ N9 NG2R51 -0.020 0
+ C4 CG2RC0 0.260 1
+ N3 NG2R62 -0.740 2
+ C2 CG2R64 0.750 3
+ N1 NG2R61 -0.340 4
+ H1 HGP1 0.260 5
+ N2 NG2S3 -0.680 6
+ H21 HGP4 0.320 7
+ H22 HGP4 0.350 8
+ C6 CG2R63 0.540 9
+ O6 OG2D4 -0.510 10
+ C5 CG2RC0 0.000 11
+ N7 NG2R50 -0.600 12
+ C8 CG2R53 0.250 13
+ H8 HGR52 0.160 14
+ O4' OG3C51 -0.400 15
+ C1' CG3C51 0.110 16
+ H12' HGA1 0.090 17
+ C4' CG3C52 0.020 18
+ H41' HGA2 0.090 19
+ H42' HGA2 0.090 20
+ C2' CG3C52 -0.180 21
+ H21' HGA2 0.090 22
+ H22' HGA2 0.090 23
+ C3' CG3C52 -0.180 24
+ H31' HGA2 0.090 25
+ H32' HGA2 0.090 26
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C3' H32'
+ C4' H41'
+ C4' H42'
+ C1' N9
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N2
+ C2 N1
+ N2 H21
+ N2 H22
+ N1 H1
+ N1 C6
+ C6 C5
+ C5 N7
+ C8 H8
+ C2 N3
+ C4 C5
+ N7 C8
+ C6 O6
+ [ impropers ]
+ C2 N1 N3 N2
+ N2 H22 H21 C2
+ C6 C5 N1 O6
+
+[ TH3P ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C52 0.020 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C52 -0.180 7
+ H21' HGA2 0.090 8
+ H22' HGA2 0.090 9
+ C3' CG3C51 -0.090 10
+ H31' HGA1 0.090 11
+ O3' OG303 -0.400 12
+ P PG2 1.100 13
+ O1P OG2P1 -0.900 14
+ O2P OG2P1 -0.900 15
+ O3P OG2P1 -0.900 16
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+
+[ TH5H ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H1' HGA2 0.090 2
+ H1'' HGA2 0.090 3
+ C4' CG3C51 0.110 4
+ H4'' HGA1 0.090 5
+ C2' CG3C52 -0.180 6
+ H2' HGA2 0.090 7
+ H2'' HGA2 0.090 8
+ C3' CG3C52 -0.180 9
+ H3' HGA2 0.090 10
+ H3'' HGA2 0.090 11
+ C5' CG321 0.050 12
+ H5' HGA2 0.090 13
+ H5'' HGA2 0.090 14
+ O5' OG311 -0.650 15
+ H5T HGP1 0.420 16
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C1' H1'
+ C1' H1''
+ C2' H2'
+ C2' H2''
+ C3' H3'
+ C3' H3''
+ C4' H4''
+ C5' H5'
+ C5' H5''
+ C5' O5'
+ O5' H5T
+
+[ TH5P ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H1' HGA2 0.090 2
+ H1'' HGA2 0.090 3
+ C4' CG3C51 0.110 4
+ H4'' HGA1 0.090 5
+ C2' CG3C52 -0.180 6
+ H2' HGA2 0.090 7
+ H2'' HGA2 0.090 8
+ C3' CG3C52 -0.180 9
+ H3' HGA2 0.090 10
+ H3'' HGA2 0.090 11
+ C5' CG321 -0.180 12
+ H5' HGA2 0.090 13
+ H5'' HGA2 0.090 14
+ O5' OG303 -0.400 15
+ P PG2 1.100 16
+ O1P OG2P1 -0.900 17
+ O2P OG2P1 -0.900 18
+ O3P OG2P1 -0.900 19
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C1' H1'
+ C1' H1''
+ C2' H2'
+ C2' H2''
+ C3' H3'
+ C3' H3''
+ C4' H4''
+ C5' H5'
+ C5' H5''
+ C5' O5'
+ O5' P
+ P O1P
+ P O2P
+ P O3P
+
+[ THAO ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ C2' CG3C52 -0.180 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ H31' HGA1 0.090 8
+ C3' CG3C51 0.140 9
+ O3' OG311 -0.650 10
+ H32' HGP1 0.420 11
+ C5' CG321 0.050 12
+ H51' HGA2 0.090 13
+ H52' HGA2 0.090 14
+ O5' OG311 -0.650 15
+ H5T HGP1 0.420 16
+ CG CG2R51 -0.050 17
+ HG HGR52 0.090 18
+ CD2 CG2R51 0.220 19
+ HD2 HGR52 0.100 20
+ ND1 NG2R51 -0.040 21
+ CE1 CG2R53 0.250 22
+ HE1 HGR52 0.130 23
+ NE2 NG2R50 -0.700 24
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5T
+ O3' H32'
+ C1' ND1
+ ND1 CE1
+ NE2 CD2
+ CG ND1
+ CE1 HE1
+ CD2 HD2
+ CG HG
+ CG CD2
+ CE1 NE2
+
+[ THAZ ]
+ [ atoms ]
+ C1 CG2R51 -0.300 0
+ H1 HGR52 0.210 1
+ C2 CG2R51 0.200 2
+ H2 HGR52 0.130 3
+ N3 NG2R50 -0.610 4
+ C4 CG2R53 0.220 5
+ H4 HGR52 0.140 6
+ S5 SG2R50 0.010 7
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 N3
+ N3 C4
+ C4 H4
+ C4 S5
+ S5 C1
+
+[ THF ]
+ [ atoms ]
+ O1 OC305A -0.400 0
+ C1 CC325B 0.020 1
+ H1A HCA25A 0.090 2
+ H1B HCA25A 0.090 3
+ C2 CC325B -0.180 4
+ H2A HCA25A 0.090 5
+ H2B HCA25A 0.090 6
+ C3 CC325B -0.180 7
+ H3A HCA25A 0.090 8
+ H3B HCA25A 0.090 9
+ C4 CC325B 0.020 10
+ H4A HCA25A 0.090 11
+ H4B HCA25A 0.090 12
+ [ bonds ]
+ O1 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C3 H3A
+ C3 H3B
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 O1
+
+[ THF2 ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C52 0.020 1
+ C3' CG3C52 -0.180 2
+ C1' CG3C52 0.020 3
+ H11' HGA2 0.090 4
+ H12' HGA2 0.090 5
+ H31' HGA2 0.090 6
+ H32' HGA2 0.090 7
+ H41' HGA2 0.090 8
+ H42' HGA2 0.090 9
+ C2' CG3C51 0.080 10
+ H21' HGA1 0.090 11
+ O2' OG301 -0.340 12
+ CM CG331 -0.100 13
+ HM1 HGA3 0.090 14
+ HM2 HGA3 0.090 15
+ HM3 HGA3 0.090 16
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' H11'
+ C1' H12'
+ C3' H31'
+ C3' H32'
+ C4' H41'
+ C4' H42'
+ C2' H21'
+ O2' C2'
+ O2' CM
+ CM HM1
+ CM HM2
+ CM HM3
+
+[ THFA ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ C2' CG3C52 -0.180 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ H31' HGA1 0.090 8
+ C3' CG3C51 0.140 9
+ O3' OG311 -0.650 10
+ H32' HGP1 0.420 11
+ C5' CG331 -0.270 12
+ H51' HGA3 0.090 13
+ H52' HGA3 0.090 14
+ H53' HGA3 0.090 15
+ CG CG2R51 -0.050 16
+ HG HGR52 0.090 17
+ CD2 CG2R51 0.220 18
+ HD2 HGR52 0.100 19
+ ND1 NG2R51 -0.040 20
+ CE1 CG2R53 0.250 21
+ HE1 HGR52 0.130 22
+ NE2 NG2R50 -0.700 23
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+ O3' H32'
+ C1' ND1
+ ND1 CE1
+ NE2 CD2
+ CG ND1
+ CE1 HE1
+ CD2 HD2
+ CG HG
+ CG CD2
+ CE1 NE2
+
+[ THFC ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C51 0.110 4
+ H42' HGA1 0.090 5
+ C2' CG3C52 -0.180 6
+ H21' HGA2 0.090 7
+ H22' HGA2 0.090 8
+ H31' HGA1 0.090 9
+ C3' CG3C51 0.140 10
+ O3' OG311 -0.650 11
+ H32' HGP1 0.420 12
+ C5' CG331 -0.270 13
+ H51' HGA3 0.090 14
+ H52' HGA3 0.090 15
+ H53' HGA3 0.090 16
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+ O3' H32'
+
+[ THFI ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C51 0.110 1
+ H12' HGA1 0.090 2
+ C4' CG3C52 0.020 3
+ H41' HGA2 0.090 4
+ H42' HGA2 0.090 5
+ C2' CG3C52 -0.180 6
+ H21' HGA2 0.090 7
+ H22' HGA2 0.090 8
+ C3' CG3C52 -0.180 9
+ H31' HGA2 0.090 10
+ H32' HGA2 0.090 11
+ CG CG2R51 -0.050 12
+ HG HGR52 0.090 13
+ CD2 CG2R51 0.220 14
+ HD2 HGR52 0.100 15
+ ND1 NG2R51 -0.040 16
+ CE1 CG2R53 0.250 17
+ HE1 HGR52 0.130 18
+ NE2 NG2R50 -0.700 19
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' ND1
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C3' H32'
+ C4' H41'
+ C4' H42'
+ ND1 CE1
+ CE1 NE2
+ NE2 CD2
+ CD2 CG
+ CG ND1
+ CE1 HE1
+ CD2 HD2
+ CG HG
+
+[ THFM ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ C2' CG3C52 -0.180 2
+ C3' CG3C52 -0.180 3
+ C4' CG3C51 0.110 4
+ H11' HGA2 0.090 5
+ H12' HGA2 0.090 6
+ H21' HGA2 0.090 7
+ H22' HGA2 0.090 8
+ H31' HGA2 0.090 9
+ H32' HGA2 0.090 10
+ H42' HGA1 0.090 11
+ C5' CG331 -0.270 12
+ H51' HGA3 0.090 13
+ H52' HGA3 0.090 14
+ H53' HGA3 0.090 15
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C3' H32'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+
+[ THFO ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ C2' CG3C52 -0.180 2
+ C4' CG3C52 0.020 3
+ H11' HGA2 0.090 4
+ H12' HGA2 0.090 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ H41' HGA2 0.090 8
+ H42' HGA2 0.090 9
+ C3' CG3C51 0.140 10
+ H31' HGA1 0.090 11
+ O3' OG311 -0.650 12
+ H32' HGP1 0.420 13
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ O3' H32'
+
+[ THIP ]
+ [ atoms ]
+ C1 CG2R51 -0.060 0
+ H1 HGR52 0.180 1
+ C2 CG2R51 -0.240 2
+ H2 HGR51 0.170 3
+ C3 CG2R51 -0.240 4
+ H3 HGR51 0.170 5
+ C4 CG2R51 -0.060 6
+ H4 HGR52 0.180 7
+ S5 SG2R50 -0.100 8
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 S5
+ S5 C1
+
+[ THMI ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C51 0.110 1
+ H12' HGA1 0.090 2
+ C4' CG3C51 0.110 3
+ H42' HGA1 0.090 4
+ C2' CG3C52 -0.180 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ C3' CG3C52 -0.180 8
+ H31' HGA2 0.090 9
+ H32' HGA2 0.090 10
+ C5' CG331 -0.270 11
+ H51' HGA3 0.090 12
+ H52' HGA3 0.090 13
+ H53' HGA3 0.090 14
+ CG CG2R51 -0.050 15
+ HG HGR52 0.090 16
+ CD2 CG2R51 0.220 17
+ HD2 HGR52 0.100 18
+ ND1 NG2R51 -0.040 19
+ CE1 CG2R53 0.250 20
+ HE1 HGR52 0.130 21
+ NE2 NG2R50 -0.700 22
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' ND1
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C3' H32'
+ C4' H42'
+ C4' C5'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+ ND1 CE1
+ NE2 CD2
+ CG ND1
+ CE1 HE1
+ CD2 HD2
+ CG HG
+ CG CD2
+ CE1 NE2
+
+[ THNI ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ C2' CG3C52 -0.180 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ CG CG2R51 -0.050 8
+ HG HGR52 0.090 9
+ CD2 CG2R51 0.220 10
+ HD2 HGR52 0.100 11
+ ND1 NG2R51 -0.040 12
+ CE1 CG2R53 0.250 13
+ HE1 HGR52 0.130 14
+ NE2 NG2R50 -0.700 15
+ H31' HGA1 0.090 16
+ C3' CG3C51 0.140 17
+ N1 NG321 -0.910 18
+ H1 HGPAM2 0.340 19
+ H2 HGPAM2 0.340 20
+ C5' CG321 0.050 21
+ H51' HGA2 0.090 22
+ H52' HGA2 0.090 23
+ O5' OG311 -0.650 24
+ H5' HGP1 0.420 25
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' N1
+ N1 H1
+ N1 H2
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5'
+ C1' ND1
+ ND1 CE1
+ CE1 NE2
+ NE2 CD2
+ CD2 CG
+ CG ND1
+ CE1 HE1
+ CD2 HD2
+ CG HG
+
+[ THNP ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C4' CG3C51 0.110 1
+ H42' HGA1 0.090 2
+ C1' CG3C51 0.110 3
+ H12' HGA1 0.090 4
+ C2' CG3C52 -0.180 5
+ H21' HGA2 0.090 6
+ H22' HGA2 0.090 7
+ CG CG2R51 -0.050 8
+ HG HGR52 0.090 9
+ CD2 CG2R51 0.220 10
+ HD2 HGR52 0.100 11
+ ND1 NG2R51 -0.040 12
+ CE1 CG2R53 0.250 13
+ HE1 HGR52 0.130 14
+ NE2 NG2R50 -0.700 15
+ C5' CG321 0.050 16
+ H51' HGA2 0.090 17
+ H52' HGA2 0.090 18
+ O5' OG311 -0.650 19
+ H5' HGP1 0.420 20
+ H31' HGA1 0.090 21
+ C3' CG3C51 -0.010 22
+ N1 NG2S3 -0.860 23
+ H1 HGP1 0.330 24
+ P1 PG1 1.570 25
+ O3 OG2P1 -0.820 26
+ O4 OG2P1 -0.820 27
+ O5 OG303 -0.560 28
+ C5 CG331 -0.190 29
+ H51 HGA3 0.090 30
+ H52 HGA3 0.090 31
+ H53 HGA3 0.090 32
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C4' C5'
+ C3' N1
+ N1 H1
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ C5' H51'
+ C5' H52'
+ C5' O5'
+ O5' H5'
+ C1' ND1
+ ND1 CE1
+ CE1 NE2
+ NE2 CD2
+ CD2 CG
+ CG ND1
+ CE1 HE1
+ CD2 HD2
+ CG HG
+ P1 N1
+ P1 O5
+ P1 O3
+ P1 O4
+ O5 C5
+ C5 H51
+ C5 H52
+ C5 H53
+
+[ THP ]
+ [ atoms ]
+ O1 OC30A -0.400 0
+ C1 CC326A 0.020 1
+ H1A HCA2A 0.090 2
+ H1B HCA2A 0.090 3
+ C2 CC326A -0.180 4
+ H2A HCA2A 0.090 5
+ H2B HCA2A 0.090 6
+ C3 CC326A -0.180 7
+ H3A HCA2A 0.090 8
+ H3B HCA2A 0.090 9
+ C4 CC326A -0.180 10
+ H4A HCA2A 0.090 11
+ H4B HCA2A 0.090 12
+ C5 CC326A 0.020 13
+ H5A HCA2A 0.090 14
+ H5B HCA2A 0.090 15
+ [ bonds ]
+ O1 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C3 H3A
+ C3 H3B
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5A
+ C5 H5B
+ C5 O1
+
+[ THPS ]
+ [ atoms ]
+ S1 SG311 -0.240 0
+ C2 CG321 -0.060 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG321 -0.180 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ C4 CG321 -0.180 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG321 -0.180 10
+ H51 HGA2 0.090 11
+ H52 HGA2 0.090 12
+ C6 CG321 -0.060 13
+ H61 HGA2 0.090 14
+ H62 HGA2 0.090 15
+ [ bonds ]
+ S1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 S1
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+
+
+
+; monoanionic phosphothreonine
+[ THP1 ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT1 0.010 4
+ HB HA1 0.090 5
+ OG1 ON2 -0.620 6
+ P P 1.500 7
+ O1P ON3 -0.820 8
+ O2P ON3 -0.820 9
+ OT ON4 -0.680 10
+ HT HN4 0.340 11
+ CG2 CT3 -0.270 12
+ HG21 HA3 0.090 13
+ HG22 HA3 0.090 14
+ HG23 HA3 0.090 15
+ C C 0.510 16
+ O O -0.510 17
+ [ bonds ]
+ CB CA
+ OG1 CB
+ CG2 CB
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB
+ OG1 P
+ P O1P
+ P O2P
+ P OT
+ OT HT
+ CG2 HG21
+ CG2 HG22
+ CG2 HG23
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+
+
+; dianionic phosphothreonine
+[ THP2 ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT1 -0.090 4
+ HB HA1 0.090 5
+ OG1 ON2 -0.400 6
+ P P 1.100 7
+ O1P ON3 -0.900 8
+ O2P ON3 -0.900 9
+ OT ON3 -0.900 10
+ CG2 CT3 -0.270 11
+ HG21 HA3 0.090 12
+ HG22 HA3 0.090 13
+ HG23 HA3 0.090 14
+ C C 0.510 15
+ O O -0.510 16
+ [ bonds ]
+ CB CA
+ OG1 CB
+ CG2 CB
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB
+ OG1 P
+ P O1P
+ P O2P
+ P OT
+ CG2 HG21
+ CG2 HG22
+ CG2 HG23
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ THR ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT1 0.140 4
+ HB HA1 0.090 5
+ OG1 OH1 -0.660 6
+ HG1 H 0.430 7
+ CG2 CT3 -0.270 8
+ HG21 HA3 0.090 9
+ HG22 HA3 0.090 10
+ HG23 HA3 0.090 11
+ C C 0.510 12
+ O O -0.510 13
+ [ bonds ]
+ CB CA
+ OG1 CB
+ CG2 CB
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB
+ OG1 HG1
+ CG2 HG21
+ CG2 HG22
+ CG2 HG23
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ TIP3 ]
+ [ atoms ]
+ OH2 OT -0.834 0
+ H1 HT 0.417 1
+ H2 HT 0.417 2
+ [ bonds ]
+ OH2 H1
+ OH2 H2
+ H1 H2
+
+[ TM3P ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C51 0.110 4
+ H42' HGA1 0.090 5
+ C2' CG3C52 -0.180 6
+ H21' HGA2 0.090 7
+ H22' HGA2 0.090 8
+ C3' CG3C51 -0.090 9
+ H31' HGA1 0.090 10
+ O3' OG303 -0.400 11
+ P PG2 1.100 12
+ O1P OG2P1 -0.900 13
+ O2P OG2P1 -0.900 14
+ O3P OG2P1 -0.900 15
+ C5' CG331 -0.270 16
+ H51' HGA3 0.090 17
+ H52' HGA3 0.090 18
+ H53' HGA3 0.090 19
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+ C4' C5'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+
+[ TMAM ]
+ [ atoms ]
+ N1 NG301 -0.630 0
+ C1 CG3AM0 -0.060 1
+ C2 CG3AM0 -0.060 2
+ C3 CG3AM0 -0.060 3
+ H11 HGAAM0 0.090 4
+ H12 HGAAM0 0.090 5
+ H13 HGAAM0 0.090 6
+ H21 HGAAM0 0.090 7
+ H22 HGAAM0 0.090 8
+ H23 HGAAM0 0.090 9
+ H31 HGAAM0 0.090 10
+ H32 HGAAM0 0.090 11
+ H33 HGAAM0 0.090 12
+ [ bonds ]
+ N1 C1
+ N1 C2
+ N1 C3
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ TMAO ]
+ [ atoms ]
+ N NG3P0 -0.830 0
+ C1 CG334 -0.350 1
+ C2 CG334 -0.350 2
+ C3 CG334 -0.350 3
+ O1 OG312 -0.370 4
+ H11 HGP5 0.250 5
+ H12 HGP5 0.250 6
+ H13 HGP5 0.250 7
+ H21 HGP5 0.250 8
+ H22 HGP5 0.250 9
+ H23 HGP5 0.250 10
+ H31 HGP5 0.250 11
+ H32 HGP5 0.250 12
+ H33 HGP5 0.250 13
+ [ bonds ]
+ N C1
+ N C2
+ N C3
+ N O1
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ TMAOP ]
+ [ atoms ]
+ N NG3P0 -0.530 0
+ C1 CG334 -0.350 1
+ C2 CG334 -0.350 2
+ C3 CG334 -0.350 3
+ H11 HGP5 0.250 4
+ H12 HGP5 0.250 5
+ H13 HGP5 0.250 6
+ H21 HGP5 0.250 7
+ H22 HGP5 0.250 8
+ H23 HGP5 0.250 9
+ H31 HGP5 0.250 10
+ H32 HGP5 0.250 11
+ H33 HGP5 0.250 12
+ O OG311 -0.170 13
+ HO HGP1 0.500 14
+ [ bonds ]
+ N C1
+ N C2
+ N C3
+ N O
+ O HO
+ C1 H11
+ C1 H12
+ C1 H13
+ C2 H21
+ C2 H22
+ C2 H23
+ C3 H31
+ C3 H32
+ C3 H33
+
+[ TMCH ]
+ [ atoms ]
+ C1 CG301 0.000 0
+ C2 CG321 -0.180 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG321 -0.180 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ C4 CG321 -0.180 7
+ H41 HGA2 0.090 8
+ H42 HGA2 0.090 9
+ C5 CG2D1 0.000 10
+ C6 CG2D1 0.000 11
+ C7 CG331 -0.270 12
+ H71 HGA3 0.090 13
+ H72 HGA3 0.090 14
+ H73 HGA3 0.090 15
+ C16 CG331 -0.270 16
+ H161 HGA3 0.090 17
+ H162 HGA3 0.090 18
+ H163 HGA3 0.090 19
+ C17 CG331 -0.270 20
+ H171 HGA3 0.090 21
+ H172 HGA3 0.090 22
+ H173 HGA3 0.090 23
+ C18 CG331 -0.270 24
+ H181 HGA3 0.090 25
+ H182 HGA3 0.090 26
+ H183 HGA3 0.090 27
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C1
+ C6 C7
+ C1 C16
+ C1 C17
+ C5 C18
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ C4 H41
+ C4 H42
+ C16 H161
+ C16 H162
+ C16 H163
+ C17 H171
+ C17 H172
+ C17 H173
+ C7 H71
+ C7 H72
+ C7 H73
+ C18 H181
+ C18 H182
+ C18 H183
+
+[ TMFD ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.050 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C51 0.110 4
+ H42' HGA1 0.090 5
+ C2' CG3C51 0.050 6
+ H21' HGA6 0.110 7
+ F2' FGA1 -0.220 8
+ C3' CG3C51 -0.060 9
+ H31' HGA1 0.090 10
+ O3' OG303 -0.400 11
+ P PG2 1.100 12
+ O1P OG2P1 -0.900 13
+ O2P OG2P1 -0.900 14
+ O3P OG2P1 -0.900 15
+ C5' CG331 -0.270 16
+ H51' HGA3 0.090 17
+ H52' HGA3 0.090 18
+ H53' HGA3 0.090 19
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' H11'
+ C1' H12'
+ C2' F2'
+ C2' H21'
+ C3' O3'
+ C3' H31'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+ C4' C5'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+ C4' H42'
+
+[ TMFU ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.050 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C51 0.110 4
+ H42' HGA1 0.090 5
+ C2' CG3C51 0.050 6
+ H22' HGA6 0.110 7
+ F2' FGA1 -0.220 8
+ C3' CG3C51 -0.060 9
+ H31' HGA1 0.090 10
+ O3' OG303 -0.400 11
+ P PG2 1.100 12
+ O1P OG2P1 -0.900 13
+ O2P OG2P1 -0.900 14
+ O3P OG2P1 -0.900 15
+ C5' CG331 -0.270 16
+ H51' HGA3 0.090 17
+ H52' HGA3 0.090 18
+ H53' HGA3 0.090 19
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' H11'
+ C1' H12'
+ C2' H22'
+ C2' F2'
+ C3' O3'
+ C3' H31'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+ C4' C5'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+ C4' H42'
+
+[ TMOR ]
+ [ atoms ]
+ S1 SG311 -0.120 0
+ C2 CG321 -0.120 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ C3 CG324 0.200 4
+ H31 HGA2 0.090 5
+ H32 HGA2 0.090 6
+ N4 NG3P2 -0.400 7
+ H41 HGP2 0.320 8
+ H42 HGP2 0.320 9
+ C5 CG324 0.200 10
+ H51 HGA2 0.090 11
+ H52 HGA2 0.090 12
+ C6 CG321 -0.120 13
+ H61 HGA2 0.090 14
+ H62 HGA2 0.090 15
+ [ bonds ]
+ S1 C2
+ C2 C3
+ C3 N4
+ N4 C5
+ C5 C6
+ C6 S1
+ C2 H21
+ C2 H22
+ C3 H31
+ C3 H32
+ N4 H41
+ N4 H42
+ C5 H51
+ C5 H52
+ C6 H61
+ C6 H62
+
+[ TMPM ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C51 0.110 4
+ H42' HGA1 0.090 5
+ C2' CG3C52 -0.180 6
+ H21' HGA2 0.090 7
+ H22' HGA2 0.090 8
+ C3' CG3C51 0.010 9
+ H31' HGA1 0.090 10
+ O3' OG303 -0.570 11
+ P PG1 1.500 12
+ O1P OG2P1 -0.780 13
+ O2P OG2P1 -0.780 14
+ O3P OG303 -0.570 15
+ C3T CG331 -0.170 16
+ H3T1 HGA3 0.090 17
+ H3T2 HGA3 0.090 18
+ H3T3 HGA3 0.090 19
+ C5' CG331 -0.270 20
+ H51' HGA3 0.090 21
+ H52' HGA3 0.090 22
+ H53' HGA3 0.090 23
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' O3'
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H42'
+ O3' P
+ P O1P
+ P O2P
+ P O3P
+ O3P C3T
+ C3T H3T1
+ C3T H3T2
+ C3T H3T3
+ C4' C5'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+
+[ TOLU ]
+ [ atoms ]
+ CG CG2R61 -0.115 0
+ HG HGR61 0.115 1
+ CD1 CG2R61 -0.115 2
+ HD1 HGR61 0.115 3
+ CD2 CG2R61 -0.115 4
+ HD2 HGR61 0.115 5
+ CE1 CG2R61 -0.115 6
+ HE1 HGR61 0.115 7
+ CE2 CG2R61 -0.115 8
+ HE2 HGR61 0.115 9
+ CZ CG2R61 0.000 10
+ CT CG331 -0.270 11
+ H11 HGA3 0.090 12
+ H12 HGA3 0.090 13
+ H13 HGA3 0.090 14
+ [ bonds ]
+ CD1 CG
+ CD2 CG
+ CE1 CD1
+ CE2 CD2
+ CZ CE1
+ CZ CE2
+ CG HG
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ CZ CT
+ CT H11
+ CT H12
+ CT H13
+
+[ TP3M ]
+ [ atoms ]
+ OH2 OT -0.834 0
+ H1 HT 0.417 1
+ H2 HT 0.417 2
+ [ bonds ]
+ OH2 H1
+ OH2 H2
+
+[ TPHC ]
+ [ atoms ]
+ O4' OG3C51 -0.400 0
+ C1' CG3C52 0.020 1
+ H11' HGA2 0.090 2
+ H12' HGA2 0.090 3
+ C4' CG3C52 0.020 4
+ H41' HGA2 0.090 5
+ H42' HGA2 0.090 6
+ C2' CG3C52 -0.180 7
+ H21' HGA2 0.090 8
+ H22' HGA2 0.090 9
+ C3' CG3C51 -0.010 10
+ H31' HGA1 0.090 11
+ N1 NG2S3 -0.860 12
+ H1 HGP1 0.330 13
+ P1 PG1 1.570 14
+ O3 OG2P1 -0.820 15
+ O4 OG2P1 -0.820 16
+ O2 OG303 -0.560 17
+ C5' CG331 -0.190 18
+ H51' HGA3 0.090 19
+ H52' HGA3 0.090 20
+ H53' HGA3 0.090 21
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C3' N1
+ N1 H1
+ C1' H11'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C4' H41'
+ C4' H42'
+ N1 P1
+ P1 O3
+ P1 O4
+ P1 O2
+ O2 C5'
+ C5' H51'
+ C5' H52'
+ C5' H53'
+
+[ TRIA ]
+ [ atoms ]
+ N1 NG2R62 -0.880 0
+ C2 CG2R64 0.780 1
+ H2 HGR62 0.100 2
+ N3 NG2R62 -0.880 3
+ C4 CG2R64 0.780 4
+ H4 HGR62 0.100 5
+ N5 NG2R62 -0.880 6
+ C6 CG2R64 0.780 7
+ H6 HGR62 0.100 8
+ [ bonds ]
+ C6 H6
+ C6 N5
+ N5 C4
+ C4 H4
+ C4 N3
+ N3 C2
+ C2 H2
+ C2 N1
+ N1 C6
+
+[ TRIB ]
+ [ atoms ]
+ N1 NG2R62 -0.410 0
+ N2 NG2R62 -0.530 1
+ C3 CG2R64 0.720 2
+ H3 HGR62 0.090 3
+ N4 NG2R62 -0.750 4
+ C5 CG2R61 0.360 5
+ H5 HGR62 0.090 6
+ C6 CG2R61 0.360 7
+ H6 HGR62 0.070 8
+ [ bonds ]
+ N1 N2
+ N2 C3
+ C3 N4
+ N4 C5
+ C5 C6
+ C6 N1
+ C3 H3
+ C5 H5
+ C6 H6
+
+[ TRIT ]
+ [ atoms ]
+ S1 SG311 -0.180 0
+ C2 CG321 0.000 1
+ H21 HGA2 0.090 2
+ H22 HGA2 0.090 3
+ S3 SG311 -0.180 4
+ C4 CG321 0.000 5
+ H41 HGA2 0.090 6
+ H42 HGA2 0.090 7
+ S5 SG311 -0.180 8
+ C6 CG321 0.000 9
+ H61 HGA2 0.090 10
+ H62 HGA2 0.090 11
+ [ bonds ]
+ S1 C2
+ C2 S3
+ S3 C4
+ C4 S5
+ S5 C6
+ C6 S1
+ C2 H21
+ C2 H22
+ C4 H41
+ C4 H42
+ C6 H61
+ C6 H62
+
+[ TRP ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CY -0.030 7
+ CD1 CA -0.150 8
+ HD1 HP 0.220 9
+ NE1 NY -0.510 10
+ HE1 H 0.370 11
+ CE2 CPT 0.240 12
+ CD2 CPT 0.110 13
+ CE3 CAI -0.250 14
+ HE3 HP 0.170 15
+ CZ3 CA -0.200 16
+ HZ3 HP 0.140 17
+ CZ2 CAI -0.270 18
+ HZ2 HP 0.160 19
+ CH2 CA -0.140 20
+ HH2 HP 0.140 21
+ C C 0.510 22
+ O O -0.510 23
+ [ bonds ]
+ CB CA
+ CG CB
+ CD2 CG
+ NE1 CD1
+ CZ2 CE2
+ N HN
+ N CA
+ C CA
+ C +N
+ CZ3 CH2
+ CD2 CE3
+ NE1 CE2
+ CA HA
+ CB HB1
+ CB HB2
+ CD1 HD1
+ NE1 HE1
+ CE3 HE3
+ CZ2 HZ2
+ CZ3 HZ3
+ CH2 HH2
+ O C
+ CD1 CG
+ CE2 CD2
+ CZ3 CE3
+ CH2 CZ2
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ TRZ2 ]
+ [ atoms ]
+ C4 CG2R52 0.060 0
+ H4 HGR52 0.160 1
+ C5 CG2R52 0.060 2
+ H5 HGR52 0.160 3
+ N1 NG2R50 -0.550 4
+ N2 NG2R51 0.390 5
+ H2 HGP1 0.270 6
+ N3 NG2R50 -0.550 7
+ [ bonds ]
+ C4 H4
+ C4 C5
+ C4 N3
+ C5 H5
+ C5 N1
+ N1 N2
+ N2 H2
+ N2 N3
+
+[ TRZ3 ]
+ [ atoms ]
+ C1 CG2R51 -0.350 0
+ H1 HGR52 0.200 1
+ C2 CG2R51 0.250 2
+ H2 HGR52 0.110 3
+ N3 NG2R50 -0.410 4
+ N4 NG2R50 -0.370 5
+ N5 NG2R51 0.280 6
+ H5 HGP1 0.290 7
+ [ bonds ]
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 N3
+ N3 N4
+ N4 N5
+ N5 H5
+ N5 C1
+
+[ TRZ4 ]
+ [ atoms ]
+ C1 CG2R53 0.230 0
+ H1 HGR52 0.160 1
+ N2 NG2R50 -0.660 2
+ C3 CG2R53 0.470 3
+ H3 HGR52 0.110 4
+ N4 NG2R50 -0.580 5
+ N5 NG2R51 -0.050 6
+ H5 HGP1 0.320 7
+ [ bonds ]
+ C1 H1
+ C1 N2
+ N2 C3
+ C3 H3
+ C3 N4
+ N4 N5
+ N5 H5
+ N5 C1
+
+[ TTHY ]
+ [ atoms ]
+ N1 NG2R61 -0.340 0
+ C6 CG2R62 0.170 1
+ H6 HGR62 0.170 2
+ C2 CG2R63 0.510 3
+ O2 OG2D4 -0.410 4
+ N3 NG2R61 -0.460 5
+ H3 HGP1 0.360 6
+ C4 CG2R63 0.500 7
+ O4 OG2D4 -0.450 8
+ C5 CG2R62 -0.150 9
+ C5M CG331 -0.110 10
+ H51 HGA3 0.070 11
+ H52 HGA3 0.070 12
+ H53 HGA3 0.070 13
+ O4' OG3C51 -0.400 14
+ C1' CG3C51 0.110 15
+ H12' HGA1 0.090 16
+ C4' CG3C52 0.020 17
+ H41' HGA2 0.090 18
+ H42' HGA2 0.090 19
+ C2' CG3C52 -0.180 20
+ H21' HGA2 0.090 21
+ H22' HGA2 0.090 22
+ C3' CG3C52 -0.180 23
+ H31' HGA2 0.090 24
+ H32' HGA2 0.090 25
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C3' H32'
+ C4' H41'
+ C4' H42'
+ C1' N1
+ N1 C2
+ N1 C6
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 C5
+ C5 C5M
+ C6 H6
+ C5M H51
+ C5M H52
+ C5M H53
+ C2 O2
+ C4 O4
+ C5 C6
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ TURA ]
+ [ atoms ]
+ N1 NG2R61 -0.340 0
+ C6 CG2R62 0.200 1
+ H6 HGR62 0.140 2
+ C2 CG2R63 0.550 3
+ O2 OG2D4 -0.450 4
+ N3 NG2R61 -0.460 5
+ H3 HGP1 0.360 6
+ C4 CG2R63 0.530 7
+ O4 OG2D4 -0.480 8
+ C5 CG2R62 -0.150 9
+ H5 HGR62 0.100 10
+ O4' OG3C51 -0.400 11
+ C1' CG3C51 0.110 12
+ H12' HGA1 0.090 13
+ C4' CG3C52 0.020 14
+ H41' HGA2 0.090 15
+ H42' HGA2 0.090 16
+ C2' CG3C52 -0.180 17
+ H21' HGA2 0.090 18
+ H22' HGA2 0.090 19
+ C3' CG3C52 -0.180 20
+ H31' HGA2 0.090 21
+ H32' HGA2 0.090 22
+ [ bonds ]
+ C1' O4'
+ C1' C2'
+ C2' C3'
+ C3' C4'
+ C4' O4'
+ C1' H12'
+ C2' H21'
+ C2' H22'
+ C3' H31'
+ C3' H32'
+ C4' H41'
+ C4' H42'
+ C1' N1
+ N1 C2
+ N1 C6
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 C5
+ C5 H5
+ C6 H6
+ C2 O2
+ C4 O4
+ C5 C6
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+
+
+; monoanionic phosphotyrosine
+[ TP1 ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CA 0.000 7
+ CD1 CA -0.115 8
+ HD1 HP 0.115 9
+ CE1 CA -0.115 10
+ HE1 HP 0.115 11
+ CZ CA -0.160 12
+ OH ON2B -0.360 13
+ P1 P 1.400 14
+ O2 ON4 -0.760 15
+ H2 HN4 0.400 16
+ O3 ON3 -0.760 17
+ O4 ON4 -0.760 18
+ CD2 CA -0.115 19
+ HD2 HP 0.115 20
+ CE2 CA -0.115 21
+ HE2 HP 0.115 22
+ C C 0.510 23
+ O O -0.510 24
+ [ bonds ]
+ CB CA
+ CG CB
+ CD2 CG
+ CE1 CD1
+ CZ CE2
+ OH CZ
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ OH P1
+ P1 O2
+ P1 O3
+ P1 O4
+ O2 H2
+ O C
+ CD1 CG
+ CE1 CZ
+ CE2 CD2
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+
+
+; dianionic phosphotyrosine
+[ TP2 ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CA 0.000 7
+ CD1 CA -0.115 8
+ HD1 HP 0.115 9
+ CE1 CA -0.210 10
+ HE1 HP 0.210 11
+ CZ CA -0.280 12
+ OH ON2B -0.280 13
+ P1 P 1.440 14
+ O2 ON4 -0.960 15
+ O3 ON3 -0.960 16
+ O4 ON4 -0.960 17
+ CD2 CA -0.115 18
+ HD2 HP 0.115 19
+ CE2 CA -0.210 20
+ HE2 HP 0.210 21
+ C C 0.510 22
+ O O -0.510 23
+ [ bonds ]
+ CB CA
+ CG CB
+ CD2 CG
+ CE1 CD1
+ CZ CE2
+ OH CZ
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ OH P1
+ P1 O2
+ P1 O3
+ P1 O4
+ O C
+ CD1 CG
+ CE1 CZ
+ CE2 CD2
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ TYR ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT2 -0.180 4
+ HB1 HA2 0.090 5
+ HB2 HA2 0.090 6
+ CG CA 0.000 7
+ CD1 CA -0.115 8
+ HD1 HP 0.115 9
+ CE1 CA -0.115 10
+ HE1 HP 0.115 11
+ CZ CA 0.110 12
+ OH OH1 -0.540 13
+ HH H 0.430 14
+ CD2 CA -0.115 15
+ HD2 HP 0.115 16
+ CE2 CA -0.115 17
+ HE2 HP 0.115 18
+ C C 0.510 19
+ O O -0.510 20
+ [ bonds ]
+ CB CA
+ CG CB
+ CD2 CG
+ CE1 CD1
+ CZ CE2
+ OH CZ
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB1
+ CB HB2
+ CD1 HD1
+ CD2 HD2
+ CE1 HE1
+ CE2 HE2
+ OH HH
+ O C
+ CD1 CG
+ CE1 CZ
+ CE2 CD2
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ UDCA ]
+ [ atoms ]
+ C3 CG311 0.140 0
+ O3 OG311 -0.650 1
+ H3' HGP1 0.420 2
+ H3 HGA1 0.090 3
+ C4 CG321 -0.180 4
+ H4A HGA2 0.090 5
+ H4B HGA2 0.090 6
+ C5 CG311 -0.090 7
+ H5 HGA1 0.090 8
+ C6 CG321 -0.180 9
+ H6A HGA2 0.090 10
+ H6B HGA2 0.090 11
+ C7 CG311 0.140 12
+ O7 OG311 -0.650 13
+ H7' HGP1 0.420 14
+ H7 HGA1 0.090 15
+ C8 CG311 -0.090 16
+ H8 HGA1 0.090 17
+ C14 CG3RC1 -0.090 18
+ H14 HGA1 0.090 19
+ C15 CG3C52 -0.180 20
+ H15A HGA2 0.090 21
+ H15B HGA2 0.090 22
+ C16 CG3C52 -0.180 23
+ H16A HGA2 0.090 24
+ H16B HGA2 0.090 25
+ C17 CG3C51 -0.090 26
+ H17 HGA1 0.090 27
+ C13 CG3RC1 0.000 28
+ C18 CG331 -0.270 29
+ H18A HGA3 0.090 30
+ H18B HGA3 0.090 31
+ H18C HGA3 0.090 32
+ C12 CG321 -0.180 33
+ H12A HGA2 0.090 34
+ H12B HGA2 0.090 35
+ C11 CG321 -0.180 36
+ H11A HGA2 0.090 37
+ H11B HGA2 0.090 38
+ C9 CG311 -0.090 39
+ H9 HGA1 0.090 40
+ C10 CG301 0.000 41
+ C19 CG331 -0.270 42
+ H19A HGA3 0.090 43
+ H19B HGA3 0.090 44
+ H19C HGA3 0.090 45
+ C1 CG321 -0.180 46
+ H1A HGA2 0.090 47
+ H1B HGA2 0.090 48
+ C2 CG321 -0.180 49
+ H2A HGA2 0.090 50
+ H2B HGA2 0.090 51
+ C20 CG311 -0.090 52
+ H20 HGA1 0.090 53
+ C21 CG331 -0.270 54
+ H21A HGA3 0.090 55
+ H21B HGA3 0.090 56
+ H21C HGA3 0.090 57
+ C22 CG321 -0.180 58
+ H22A HGA2 0.090 59
+ H22B HGA2 0.090 60
+ C23 CG321 -0.180 61
+ H23A HGA2 0.090 62
+ H23B HGA2 0.090 63
+ CD CG2O3 0.520 64
+ OE1 OG2D2 -0.760 65
+ OE2 OG2D2 -0.760 66
+ [ bonds ]
+ C3 O3
+ C3 H3
+ O3 H3'
+ C3 C4
+ C4 H4A
+ C4 H4B
+ C4 C5
+ C5 H5
+ C5 C10
+ C10 C19
+ C19 H19A
+ C19 H19B
+ C19 H19C
+ C10 C1
+ C1 H1A
+ C1 H1B
+ C1 C2
+ C2 H2A
+ C2 H2B
+ C2 C3
+ C5 C6
+ C6 H6A
+ C6 H6B
+ C6 C7
+ C7 H7
+ C7 O7
+ O7 H7'
+ C7 C8
+ C8 H8
+ C8 C9
+ C9 H9
+ C9 C10
+ C8 C14
+ C14 H14
+ C14 C13
+ C13 C18
+ C18 H18A
+ C18 H18B
+ C18 H18C
+ C13 C12
+ C12 H12A
+ C12 H12B
+ C12 C11
+ C11 H11A
+ C11 H11B
+ C11 C9
+ C14 C15
+ C15 H15A
+ C15 H15B
+ C15 C16
+ C16 H16A
+ C16 H16B
+ C16 C17
+ C17 H17
+ C17 C13
+ C17 C20
+ C20 H20
+ C20 C21
+ C21 H21A
+ C21 H21B
+ C21 H21C
+ C20 C22
+ C22 H22A
+ C22 H22B
+ C22 C23
+ C23 H23A
+ C23 H23B
+ C23 CD
+ CD OE1
+ CD OE2
+ [ impropers ]
+ CD OE2 OE1 C23
+
+[ URA ]
+ [ atoms ]
+ P P 1.500 0
+ O1P ON3 -0.780 1
+ O2P ON3 -0.780 2
+ O5' ON2 -0.570 3
+ C5' CN8B -0.080 4
+ H5' HN8 0.090 5
+ H5'' HN8 0.090 6
+ C4' CN7 0.160 7
+ H4' HN7 0.090 8
+ O4' ON6B -0.500 9
+ C1' CN7B 0.160 10
+ H1' HN7 0.090 11
+ N1 NN2B -0.340 12
+ C6 CN3 0.200 13
+ H6 HN3 0.140 14
+ C2 CN1T 0.550 15
+ O2 ON1 -0.450 16
+ N3 NN2U -0.460 17
+ H3 HN2 0.360 18
+ C4 CN1 0.530 19
+ O4 ON1 -0.480 20
+ C5 CN3 -0.150 21
+ H5 HN3 0.100 22
+ C2' CN7B 0.140 23
+ H2'' HN7 0.090 24
+ O2' ON5 -0.660 25
+ H2' HN5 0.430 26
+ C3' CN7 0.010 27
+ H3' HN7 0.090 28
+ O3' ON2 -0.570 29
+ [ bonds ]
+ P O1P
+ P O2P
+ P O5'
+ O5' C5'
+ C5' C4'
+ C4' O4'
+ C4' C3'
+ O4' C1'
+ C1' N1
+ C1' C2'
+ N1 C2
+ N1 C6
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 C5
+ C2' C3'
+ C3' O3'
+ O3' +P
+ C2' O2'
+ O2' H2'
+ C1' H1'
+ C2' H2''
+ C3' H3'
+ C4' H4'
+ C5' H5'
+ C5' H5''
+ C5 H5
+ C6 H6
+ C2 O2
+ C4 O4
+ C5 C6
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 N3 C5 O4
+
+[ URA24S ]
+ [ atoms ]
+ N1 NG2R61 -0.120 0
+ C2 CG2R63 -0.130 1
+ N3 NG2R61 -0.170 2
+ C4 CG2R63 0.040 3
+ C5 CG2R61 -0.170 4
+ C6 CG2R61 -0.060 5
+ H1 HGP1 0.330 6
+ H3 HGP1 0.320 7
+ H5 HGR62 0.190 8
+ H6 HGR62 0.260 9
+ S4 SG2D1 -0.260 10
+ S2 SG2D1 -0.230 11
+ [ bonds ]
+ N1 H1
+ N1 C2
+ N1 C6
+ C2 S2
+ C2 N3
+ N3 H3
+ N3 C4
+ C4 S4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ [ impropers ]
+ C2 N1 N3 S2
+ C4 C5 N3 S4
+
+[ URA2S ]
+ [ atoms ]
+ C2 CG2R63 -0.040 0
+ C4 CG2R63 0.520 1
+ C5 CG2R62 -0.240 2
+ C6 CG2R62 0.080 3
+ H1 HGP1 0.330 4
+ H3 HGP1 0.370 5
+ H5 HGR62 0.170 6
+ H6 HGR62 0.200 7
+ O4 OG2D4 -0.490 8
+ S2 SG2D1 -0.300 9
+ N1 NG2R61 -0.220 10
+ N3 NG2R61 -0.380 11
+ [ bonds ]
+ C2 S2
+ C2 N1
+ C2 N3
+ C4 C5
+ C4 O4
+ C4 N3
+ C5 C6
+ C5 H5
+ C6 H6
+ C6 N1
+ H1 N1
+ H3 N3
+ [ impropers ]
+ C2 N1 N3 S2
+ C4 C5 N3 O4
+
+[ URA4S ]
+ [ atoms ]
+ C2 CG2R63 0.410 0
+ C4 CG2R63 0.110 1
+ C5 CG2R62 -0.310 2
+ C6 CG2R62 0.040 3
+ H1 HGP1 0.350 4
+ H3 HGP1 0.340 5
+ H5 HGR62 0.200 6
+ H6 HGR62 0.230 7
+ S4 SG2D1 -0.280 8
+ O2 OG2D4 -0.440 9
+ N1 NG2R61 -0.300 10
+ N3 NG2R61 -0.350 11
+ [ bonds ]
+ C2 O2
+ C2 N1
+ C2 N3
+ C4 C5
+ C4 S4
+ C4 N3
+ C5 C6
+ C5 H5
+ C6 H6
+ C6 N1
+ H1 N1
+ H3 N3
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 S4
+
+[ URAC ]
+ [ atoms ]
+ N1 NG2R61 -0.370 0
+ C6 CG2R62 0.110 1
+ H6 HGR62 0.180 2
+ C2 CG2R63 0.440 3
+ O2 OG2D4 -0.450 4
+ N3 NG2R61 -0.530 5
+ H3 HGP1 0.380 6
+ C4 CG2R63 0.400 7
+ O4 OG2D4 -0.460 8
+ C5 CG2R62 -0.200 9
+ H5 HGR62 0.150 10
+ H1 HGP1 0.350 11
+ [ bonds ]
+ N1 C2
+ C2 N3
+ N3 C4
+ C4 C5
+ C6 N1
+ N1 H1
+ N3 H3
+ C5 H5
+ C6 H6
+ C2 O2
+ C4 O4
+ C5 C6
+ [ impropers ]
+ C2 N1 N3 O2
+ C4 C5 N3 O4
+
+[ UREA ]
+ [ atoms ]
+ N1 NG2S2 -0.690 0
+ H11 HGP1 0.340 1
+ H12 HGP1 0.340 2
+ C2 CG2O6 0.600 3
+ O2 OG2D1 -0.580 4
+ N3 NG2S2 -0.690 5
+ H31 HGP1 0.340 6
+ H32 HGP1 0.340 7
+ [ bonds ]
+ C2 O2
+ C2 N1
+ C2 N3
+ N1 H11
+ N1 H12
+ N3 H31
+ N3 H32
+ [ impropers ]
+ C2 N1 N3 O2
+
+[ VAL ]
+ [ atoms ]
+ N NH1 -0.470 0
+ HN H 0.310 1
+ CA CT1 0.070 2
+ HA HB1 0.090 3
+ CB CT1 -0.090 4
+ HB HA1 0.090 5
+ CG1 CT3 -0.270 6
+ HG11 HA3 0.090 7
+ HG12 HA3 0.090 8
+ HG13 HA3 0.090 9
+ CG2 CT3 -0.270 10
+ HG21 HA3 0.090 11
+ HG22 HA3 0.090 12
+ HG23 HA3 0.090 13
+ C C 0.510 14
+ O O -0.510 15
+ [ bonds ]
+ CB CA
+ CG1 CB
+ CG2 CB
+ N HN
+ N CA
+ C CA
+ C +N
+ CA HA
+ CB HB
+ CG1 HG11
+ CG1 HG12
+ CG1 HG13
+ CG2 HG21
+ CG2 HG22
+ CG2 HG23
+ O C
+ [ impropers ]
+ N -C CA HN
+ C CA +N O
+ [ cmap ]
+ -C N CA C +N
+
+[ YT2S ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ C2 CG2R61 -0.115 1
+ C3 CG2R61 -0.115 2
+ C4 CG2R62 0.340 3
+ C5 CG2R62 -0.040 4
+ C6 CG2R61 -0.115 5
+ C8 CG2R63 0.110 6
+ S8 SG2D1 -0.280 7
+ N9 NG2R61 -0.310 8
+ H9 HGP1 0.310 9
+ C10 CG2R63 0.440 10
+ O10 OG2D4 -0.450 11
+ N11 NG2R61 -0.490 12
+ H11 HGP1 0.370 13
+ H1 HGR61 0.115 14
+ H2 HGR61 0.115 15
+ H3 HGR61 0.115 16
+ H6 HGR61 0.115 17
+ [ bonds ]
+ C1 C6
+ C1 H1
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 C5
+ C4 N11
+ C5 C6
+ C6 H6
+ C5 C8
+ C8 S8
+ C8 N9
+ N9 H9
+ N9 C10
+ C10 O10
+ C10 N11
+ N11 H11
+ [ impropers ]
+ C8 C5 N9 S8
+ C10 N9 N11 O10
+
+[ YT4S ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ C2 CG2R61 -0.115 1
+ C3 CG2R61 -0.115 2
+ C4 CG2R62 0.360 3
+ C5 CG2R62 -0.050 4
+ C6 CG2R61 -0.115 5
+ H1 HGR61 0.115 6
+ H2 HGR61 0.115 7
+ H3 HGR61 0.115 8
+ H6 HGR61 0.115 9
+ C8 CG2R63 0.500 10
+ O8 OG2D4 -0.460 11
+ N9 NG2R61 -0.410 12
+ H9 HGP1 0.370 13
+ C10 CG2R63 -0.100 14
+ S10 SG2D1 -0.240 15
+ N11 NG2R61 -0.290 16
+ H11 HGP1 0.320 17
+ [ bonds ]
+ C1 C2
+ C1 H1
+ C1 C6
+ C2 C3
+ C2 H2
+ C3 C4
+ C3 H3
+ C4 C5
+ C4 N11
+ C5 C8
+ C5 C6
+ C6 H6
+ N11 H11
+ N11 C10
+ C10 S10
+ C10 N9
+ N9 H9
+ N9 C8
+ C8 O8
+ [ impropers ]
+ C8 C5 N9 O8
+ C10 N11 N9 S10
+
+[ YTHY ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ C2 CG2R61 -0.115 1
+ C3 CG2R61 -0.115 2
+ C4 CG2R62 0.340 3
+ C5 CG2R62 -0.070 4
+ C6 CG2R61 -0.115 5
+ H6 HGR61 0.115 6
+ C8 CG2R63 0.510 7
+ N9 NG2R61 -0.570 8
+ C10 CG2R63 0.450 9
+ N11 NG2R61 -0.490 10
+ H11 HGP1 0.360 11
+ O10 OG2D4 -0.450 12
+ H9 HGP1 0.390 13
+ O8 OG2D4 -0.470 14
+ H3 HGR61 0.115 15
+ H2 HGR61 0.115 16
+ H1 HGR61 0.115 17
+ [ bonds ]
+ C1 C2
+ C1 H1
+ C2 C3
+ C2 H2
+ C3 C4
+ C3 H3
+ C4 C5
+ C5 C6
+ C5 C8
+ C6 C1
+ C6 H6
+ C8 N9
+ C8 O8
+ N9 C10
+ N9 H9
+ C10 N11
+ C10 O10
+ N11 C4
+ N11 H11
+ [ impropers ]
+ C8 C5 N9 O8
+ C10 N9 N11 O10
+
+[ YTS2 ]
+ [ atoms ]
+ C1 CG2R61 -0.115 0
+ C2 CG2R61 -0.115 1
+ C3 CG2R61 -0.115 2
+ C4 CG2R61 0.490 3
+ C5 CG2R61 0.120 4
+ C6 CG2R61 -0.115 5
+ H1 HGR61 0.115 6
+ H2 HGR61 0.115 7
+ H3 HGR61 0.115 8
+ H6 HGR61 0.115 9
+ C8 CG2R63 0.100 10
+ S8 SG2D1 -0.240 11
+ N9 NG2R61 -0.600 12
+ H9 HGP1 0.420 13
+ C10 CG2R63 0.140 14
+ S10 SG2D1 -0.240 15
+ N11 NG2R61 -0.600 16
+ H11 HGP1 0.410 17
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ H1 C1
+ H2 C2
+ H3 C3
+ H6 C6
+ C5 C8
+ C8 S8
+ C8 N9
+ N9 H9
+ N9 C10
+ C10 S10
+ C10 N11
+ N11 H11
+ N11 C4
+ C6 C1
+ [ impropers ]
+ C8 C5 N9 S8
+ C10 N9 N11 S10
+
+[ ZDOL ]
+ [ atoms ]
+ C1 CG2RC0 0.030 0
+ O1 OG3C51 -0.310 1
+ C2 CG3C52 0.380 2
+ H21 HGA2 0.090 3
+ H22 HGA2 0.090 4
+ O2 OG3C51 -0.310 5
+ C3 CG2RC0 0.030 6
+ C4 CG2R61 -0.320 7
+ H4 HGR61 0.280 8
+ C5 CG2R61 -0.150 9
+ H5 HGR61 0.190 10
+ C6 CG2R61 -0.150 11
+ H6 HGR61 0.190 12
+ C7 CG2R61 -0.320 13
+ H7 HGR61 0.280 14
+ [ bonds ]
+ C1 O1
+ O1 C2
+ C2 H21
+ C2 H22
+ C2 O2
+ O2 C3
+ C3 C1
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 C7
+ C7 H7
+ C7 C1
+
+[ ZFUR ]
+ [ atoms ]
+ O1 OG2R50 -0.280 0
+ C2 CG2R51 0.020 1
+ H2 HGR52 0.180 2
+ C3 CG2R51 -0.400 3
+ H3 HGR51 0.250 4
+ C4 CG2RC0 0.150 5
+ C5 CG2R61 -0.330 6
+ H5 HGR61 0.240 7
+ C6 CG2R61 -0.280 8
+ H6 HGR61 0.230 9
+ C7 CG2R61 -0.210 10
+ H7 HGR61 0.220 11
+ C8 CG2R61 -0.340 12
+ H8 HGR61 0.240 13
+ C9 CG2RC0 0.310 14
+ [ bonds ]
+ O1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 O1
+ C4 C9
+ C2 H2
+ C3 H3
+ C5 H5
+ C6 H6
+ C7 H7
+ C8 H8
+
+[ ZIMI ]
+ [ atoms ]
+ N1 NG2R51 -0.280 0
+ H1 HGP1 0.310 1
+ C2 CG2R53 0.240 2
+ H2 HGR52 0.140 3
+ N3 NG2R50 -0.720 4
+ C4 CG2RC0 0.450 5
+ C5 CG2R61 -0.350 6
+ H5 HGR61 0.230 7
+ C6 CG2R61 -0.190 8
+ H6 HGR61 0.200 9
+ C7 CG2R61 -0.340 10
+ H7 HGR61 0.240 11
+ C8 CG2R61 -0.320 12
+ H8 HGR61 0.220 13
+ C9 CG2RC0 0.170 14
+ [ bonds ]
+ N1 H1
+ C2 H2
+ C5 H5
+ C6 H6
+ C7 H7
+ C8 H8
+ C9 N1
+ N1 C2
+ N3 C4
+ C4 C5
+ C6 C7
+ C8 C9
+ C2 N3
+ C4 C9
+ C5 C6
+ C7 C8
+
+[ ZN2 ]
+ [ atoms ]
+ ZN ZN 2.000 0
+
+[ ZOIC ]
+ [ atoms ]
+ C2 CG2R61 -0.115 0
+ H2 HGR61 0.115 1
+ C3 CG2R61 -0.115 2
+ H3 HGR61 0.115 3
+ C4 CG2R61 -0.115 4
+ H4 HGR61 0.115 5
+ C5 CG2R61 -0.115 6
+ H5 HGR61 0.115 7
+ C6 CG2R61 -0.115 8
+ H6 HGR61 0.115 9
+ C1 CG2R61 0.080 10
+ C7 CG2O2 0.460 11
+ O7 OG2D1 -0.460 12
+ O8 OG311 -0.510 13
+ H8 HGP1 0.430 14
+ [ bonds ]
+ C1 C2
+ C2 H2
+ C2 C3
+ C3 H3
+ C3 C4
+ C4 H4
+ C4 C5
+ C5 H5
+ C5 C6
+ C6 H6
+ C6 C1
+ C1 C7
+ C7 O7
+ C7 O8
+ O8 H8
+ [ impropers ]
+ C7 C1 O7 O8
+
+[ ZTHP ]
+ [ atoms ]
+ S1 SG2R50 -0.160 0
+ C2 CG2R51 -0.090 1
+ H2 HGR52 0.180 2
+ C3 CG2R51 -0.280 3
+ H3 HGR51 0.210 4
+ C4 CG2RC0 0.170 5
+ C5 CG2R61 -0.340 6
+ H5 HGR61 0.240 7
+ C6 CG2R61 -0.290 8
+ H6 HGR61 0.240 9
+ C7 CG2R61 -0.210 10
+ H7 HGR61 0.210 11
+ C8 CG2R61 -0.230 12
+ H8 HGR61 0.240 13
+ C9 CG2RC0 0.110 14
+ [ bonds ]
+ S1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 S1
+ C4 C9
+ C2 H2
+ C3 H3
+ C5 H5
+ C6 H6
+ C7 H7
+ C8 H8
+
+[ ZTHZ ]
+ [ atoms ]
+ S1 SG2R50 -0.250 0
+ C2 CG2R53 0.160 1
+ H2 HGR52 0.180 2
+ N3 NG2R50 -0.690 3
+ C4 CG2RC0 0.640 4
+ C5 CG2R61 -0.460 5
+ H5 HGR61 0.260 6
+ C6 CG2R61 -0.290 7
+ H6 HGR61 0.260 8
+ C7 CG2R61 -0.380 9
+ H7 HGR61 0.260 10
+ C8 CG2R61 -0.240 11
+ H8 HGR61 0.220 12
+ C9 CG2RC0 0.330 13
+ [ bonds ]
+ S1 C2
+ C2 N3
+ N3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 S1
+ C4 C9
+ C2 H2
+ C5 H5
+ C6 H6
+ C7 H7
+ C8 H8
+
+[ deca ]
+ [ atoms ]
+ C1 CC33A -0.270 0
+ H1A HCA3A 0.090 1
+ H1B HCA3A 0.090 2
+ H1C HCA3A 0.090 3
+ C2 CC32A -0.180 4
+ H2A HCA2A 0.090 5
+ H2B HCA2A 0.090 6
+ C3 CC32A -0.180 7
+ H3A HCA2A 0.090 8
+ H3B HCA2A 0.090 9
+ C4 CC32A -0.180 10
+ H4A HCA2A 0.090 11
+ H4B HCA2A 0.090 12
+ C5 CC32A -0.180 13
+ H5A HCA2A 0.090 14
+ H5B HCA2A 0.090 15
+ C6 CC32A -0.180 16
+ H6A HCA2A 0.090 17
+ H6B HCA2A 0.090 18
+ C7 CC32A -0.180 19
+ H7A HCA2A 0.090 20
+ H7B HCA2A 0.090 21
+ C8 CC32A -0.180 22
+ H8A HCA2A 0.090 23
+ H8B HCA2A 0.090 24
+ C9 CC32A -0.180 25
+ H9A HCA2A 0.090 26
+ H9B HCA2A 0.090 27
+ C10 CC33A -0.270 28
+ H10A HCA3A 0.090 29
+ H10B HCA3A 0.090 30
+ H10C HCA3A 0.090 31
+ [ bonds ]
+ C1 C2
+ C2 C3
+ C3 C4
+ C4 C5
+ C5 C6
+ C6 C7
+ C7 C8
+ C8 C9
+ C9 C10
+ C1 H1A
+ C1 H1B
+ C1 H1C
+ C2 H2A
+ C2 H2B
+ C3 H3A
+ C3 H3B
+ C4 H4A
+ C4 H4B
+ C5 H5A
+ C5 H5B
+ C6 H6A
+ C6 H6B
+ C7 H7A
+ C7 H7B
+ C8 H8A
+ C8 H8B
+ C9 H9A
+ C9 H9B
+ C10 H10A
+ C10 H10B
+ C10 H10C
+
+
+
+; =====================================================================
+; DNA
+; Note: these parameters include the 2011 update to P atom types for
+; non-5'-terminal residues that introduce a new atom type for better
+; zeta dihedrals (equivalent to the DEOX patch in CHARMM)
+;-----------------------------------------------------------------------
+[ DA ]
+; H61 H62
+; \ /
+; N6
+; |
+; C6
+; // \
+; N1 C5--N7\\
+; | || C8-H8
+; C2 C4--N9/
+; / \\ / \
+; H2 N3 \
+; \
+; \
+; \
+; O1P H5' H4' O4' \
+; | | \ / \ \
+; -P-O5'-C5'---C4' C1'
+; | | \ / \
+; O2P H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+;
+;
+[ atoms ]
+P P2 1.50 0
+O1P ON3 -0.78 1
+O2P ON3 -0.78 2
+O5' ON2 -0.57 3
+C5' CN8B -0.08 4
+H5' HN8 0.09 5
+H5'' HN8 0.09 6
+C4' CN7 0.16 7
+H4' HN7 0.09 8
+O4' ON6 -0.50 9
+C1' CN7B 0.16 10
+H1' HN7 0.09 11
+N9 NN2 -0.05 12
+C5 CN5 0.28 13
+N7 NN4 -0.71 14
+C8 CN4 0.34 15
+H8 HN3 0.12 16
+N1 NN3A -0.74 17
+C2 CN4 0.50 18
+H2 HN3 0.13 19
+N3 NN3A -0.75 20
+C4 CN5 0.43 21
+C6 CN2 0.46 22
+N6 NN1 -0.77 23
+H61 HN1 0.38 24
+H62 HN1 0.38 25
+C2' CN8 -0.18 26
+H2' HN8 0.09 27
+H2'' HN8 0.09 28
+C3' CN7 0.01 29
+H3' HN7 0.09 30
+O3' ON2 -0.57 31
+[ bonds ]
+-O3' P
+P O1P
+P O2P
+P O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N9
+C1' C2'
+N9 C4
+N9 C8
+C4 N3
+C2 N1
+C6 N6
+N6 H61
+N6 H62
+C6 C5
+C5 N7
+C2' C3'
+C3' O3'
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C8 H8
+C2 H2
+N1 C6
+C2 N3
+C4 C5
+N7 C8
+[ impropers ]
+N6 C6 H61 H62
+C6 N1 C5 N6
+
+[ DA5 ]
+; H61 H62
+; \ /
+; N6
+; |
+; C6
+; // \
+; N1 C5--N7\\
+; | || C8-H8
+; C2 C4--N9/
+; / \\ / \
+; H2 N3 \
+; \
+; \
+; \
+; H5' H4' O4' \
+; | \ / \ \
+; H5T-O5'-C5'---C4' C1'
+; | \ / \
+; H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+;
+;
+[ atoms ]
+H5T HN5 0.43 0
+O5' ON5 -0.66 1
+C5' CN8B 0.05 2
+H5' HN8 0.09 3
+H5'' HN8 0.09 4
+C4' CN7 0.16 5
+H4' HN7 0.09 6
+O4' ON6 -0.50 7
+C1' CN7B 0.16 8
+H1' HN7 0.09 9
+N9 NN2 -0.05 10
+C5 CN5 0.28 11
+N7 NN4 -0.71 12
+C8 CN4 0.34 13
+H8 HN3 0.12 14
+N1 NN3A -0.74 15
+C2 CN4 0.50 16
+H2 HN3 0.13 17
+N3 NN3A -0.75 18
+C4 CN5 0.43 19
+C6 CN2 0.46 20
+N6 NN1 -0.77 21
+H61 HN1 0.38 22
+H62 HN1 0.38 23
+C2' CN8 -0.18 24
+H2' HN8 0.09 25
+H2'' HN8 0.09 26
+C3' CN7 0.01 27
+H3' HN7 0.09 28
+O3' ON2 -0.57 29
+[ bonds ]
+H5T O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N9
+C1' C2'
+N9 C4
+N9 C8
+C4 N3
+C2 N1
+C6 N6
+N6 H61
+N6 H62
+C6 C5
+C5 N7
+C2' C3'
+C3' O3'
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C8 H8
+C2 H2
+N1 C6
+C2 N3
+C4 C5
+N7 C8
+[ impropers ]
+N6 C6 H61 H62
+C6 N1 C5 N6
+
+
+[ DA3 ]
+; H61 H62
+; \ /
+; N6
+; |
+; C6
+; // \
+; N1 C5--N7\\
+; | || C8-H8
+; C2 C4--N9/
+; / \\ / \
+; H2 N3 \
+; \
+; \
+; \
+; O1P H5' H4' O4' \
+; | | \ / \ \
+; -P-O5'-C5'---C4' C1'
+; | | \ / \
+; O2P H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+; H3T
+
+[ atoms ]
+P P2 1.50 0
+O1P ON3 -0.78 1
+O2P ON3 -0.78 2
+O5' ON2 -0.57 3
+C5' CN8B -0.08 4
+H5' HN8 0.09 5
+H5'' HN8 0.09 6
+C4' CN7 0.16 7
+H4' HN7 0.09 8
+O4' ON6 -0.50 9
+C1' CN7B 0.16 10
+H1' HN7 0.09 11
+N9 NN2 -0.05 12
+C5 CN5 0.28 13
+N7 NN4 -0.71 14
+C8 CN4 0.34 15
+H8 HN3 0.12 16
+N1 NN3A -0.74 17
+C2 CN4 0.50 18
+H2 HN3 0.13 19
+N3 NN3A -0.75 20
+C4 CN5 0.43 21
+C6 CN2 0.46 22
+N6 NN1 -0.77 23
+H61 HN1 0.38 24
+H62 HN1 0.38 25
+C2' CN8 -0.18 26
+H2' HN8 0.09 27
+H2'' HN8 0.09 28
+C3' CN7 0.14 29
+H3' HN7 0.09 30
+O3' ON5 -0.66 31
+H3T HN5 0.43 32
+[ bonds ]
+-O3' P
+P O1P
+P O2P
+P O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N9
+C1' C2'
+N9 C4
+N9 C8
+C4 N3
+C2 N1
+C6 N6
+N6 H61
+N6 H62
+C6 C5
+C5 N7
+C2' C3'
+C3' O3'
+O3' H3T
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C8 H8
+C2 H2
+N1 C6
+C2 N3
+C4 C5
+N7 C8
+[ impropers ]
+N6 C6 H61 H62
+C6 N1 C5 N6
+
+;--------------------------------------------------------------------------
+[ DC ]
+;
+; H42 H41
+; \ /
+; N4
+; |
+; C4
+; / \\
+; H5-C5 N3
+; || |
+; H6-C6 C2
+; \ / \\
+; N1 O2
+; \
+; \
+; \
+; O1P H5' H4' O4' \
+; | | \ / \ \
+; -P-O5'-C5'---C4' C1'
+; | | \ / \
+; O2P H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+;
+[ atoms ]
+P P2 1.50 0
+O1P ON3 -0.78 1
+O2P ON3 -0.78 2
+O5' ON2 -0.57 3
+C5' CN8B -0.08 4
+H5' HN8 0.09 5
+H5'' HN8 0.09 6
+C4' CN7 0.16 7
+H4' HN7 0.09 8
+O4' ON6 -0.50 9
+C1' CN7B 0.16 10
+H1' HN7 0.09 11
+N1 NN2 -0.13 12
+C6 CN3 0.05 13
+H6 HN3 0.17 14
+C5 CN3 -0.13 15
+H5 HN3 0.07 16
+C2 CN1 0.52 17
+O2 ON1C -0.49 18
+N3 NN3 -0.66 19
+C4 CN2 0.65 20
+N4 NN1 -0.75 21
+H41 HN1 0.37 22
+H42 HN1 0.33 23
+C2' CN8 -0.18 24
+H2' HN8 0.09 25
+H2'' HN8 0.09 26
+C3' CN7 0.01 27
+H3' HN7 0.09 28
+O3' ON2 -0.57 29
+[ bonds ]
+-O3' P
+P O1P
+P O2P
+P O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N1
+C1' C2'
+N1 C2
+N1 C6
+C2 N3
+C4 N4
+N4 H41
+N4 H42
+C4 C5
+C2' C3'
+C3' O3'
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C5 H5
+C6 H6
+C2 O2
+C5 C6
+N3 C4
+[ impropers ]
+C2 N1 N3 O2
+C4 N3 C5 N4
+N4 C4 H41 H42
+
+[ DC5 ]
+;
+; H42 H41
+; \ /
+; N4
+; |
+; C4
+; / \\
+; H5-C5 N3
+; || |
+; H6-C6 C2
+; \ / \\
+; N1 O2
+; \
+; \
+; \
+; H5' H4' O4' \
+; | \ / \ \
+; H5T-O5'-C5'---C4' C1'
+; | \ / \
+; H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+;
+[ atoms ]
+H5T HN5 0.43 0
+O5' ON5 -0.66 1
+C5' CN8B 0.05 2
+H5' HN8 0.09 3
+H5'' HN8 0.09 4
+C4' CN7 0.16 5
+H4' HN7 0.09 6
+O4' ON6 -0.50 7
+C1' CN7B 0.16 8
+H1' HN7 0.09 9
+N1 NN2 -0.13 10
+C6 CN3 0.05 11
+H6 HN3 0.17 12
+C5 CN3 -0.13 13
+H5 HN3 0.07 14
+C2 CN1 0.52 15
+O2 ON1C -0.49 16
+N3 NN3 -0.66 17
+C4 CN2 0.65 18
+N4 NN1 -0.75 19
+H41 HN1 0.37 20
+H42 HN1 0.33 21
+C2' CN8 -0.18 22
+H2' HN8 0.09 23
+H2'' HN8 0.09 24
+C3' CN7 0.01 25
+H3' HN7 0.09 26
+O3' ON2 -0.57 27
+[ bonds ]
+H5T O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N1
+C1' C2'
+N1 C2
+N1 C6
+C2 N3
+C4 N4
+N4 H41
+N4 H42
+C4 C5
+C2' C3'
+C3' O3'
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C5 H5
+C6 H6
+C2 O2
+C5 C6
+N3 C4
+[ impropers ]
+C2 N1 N3 O2
+C4 N3 C5 N4
+N4 C4 H41 H42
+
+[ DC3 ]
+;
+; H42 H41
+; \ /
+; N4
+; |
+; C4
+; / \\
+; H5-C5 N3
+; || |
+; H6-C6 C2
+; \ / \\
+; N1 O2
+; \
+; \
+; \
+; O1P H5' H4' O4' \
+; | | \ / \ \
+; -P-O5'-C5'---C4' C1'
+; | | \ / \
+; O2P H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+; H3T
+[ atoms ]
+P P2 1.50 0
+O1P ON3 -0.78 1
+O2P ON3 -0.78 2
+O5' ON2 -0.57 3
+C5' CN8B -0.08 4
+H5' HN8 0.09 5
+H5'' HN8 0.09 6
+C4' CN7 0.16 7
+H4' HN7 0.09 8
+O4' ON6 -0.50 9
+C1' CN7B 0.16 10
+H1' HN7 0.09 11
+N1 NN2 -0.13 12
+C6 CN3 0.05 13
+H6 HN3 0.17 14
+C5 CN3 -0.13 15
+H5 HN3 0.07 16
+C2 CN1 0.52 17
+O2 ON1C -0.49 18
+N3 NN3 -0.66 19
+C4 CN2 0.65 20
+N4 NN1 -0.75 21
+H41 HN1 0.37 22
+H42 HN1 0.33 23
+C2' CN8 -0.18 24
+H2' HN8 0.09 25
+H2'' HN8 0.09 26
+C3' CN7 0.14 27
+H3' HN7 0.09 28
+O3' ON5 -0.66 29
+H3T HN5 0.43 30
+[ bonds ]
+-O3' P
+P O1P
+P O2P
+P O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N1
+C1' C2'
+N1 C2
+N1 C6
+C2 N3
+C4 N4
+N4 H41
+N4 H42
+C4 C5
+C2' C3'
+C3' O3'
+O3' H3T
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C5 H5
+C6 H6
+C2 O2
+C5 C6
+N3 C4
+[ impropers ]
+C2 N1 N3 O2
+C4 N3 C5 N4
+N4 C4 H41 H42
+
+; --------------------------------------------------------------------
+[ DG ]
+; O6
+; ||
+; C6
+; / \
+; H1-N1 C5--N7\\
+; | || C8-H8
+; C2 C4--N9/
+; / \\ / \
+; H21-N2 N3 \
+; | \
+; H22 \
+; \
+; O1P H5' H4' O4' \
+; | | \ / \ \
+; -P-O5'-C5'---C4' C1'
+; | | \ / \
+; O2P H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+;
+[ atoms ]
+P P2 1.50 0
+O1P ON3 -0.78 1
+O2P ON3 -0.78 2
+O5' ON2 -0.57 3
+C5' CN8B -0.08 4
+H5' HN8 0.09 5
+H5'' HN8 0.09 6
+C4' CN7 0.16 7
+H4' HN7 0.09 8
+O4' ON6 -0.50 9
+C1' CN7B 0.16 10
+H1' HN7 0.09 11
+N9 NN2B -0.02 12
+C4 CN5 0.26 13
+N2 NN1 -0.68 14
+H21 HN1 0.32 15
+H22 HN1 0.35 16
+N3 NN3G -0.74 17
+C2 CN2 0.75 18
+N1 NN2G -0.34 19
+H1 HN2 0.26 20
+C6 CN1 0.54 21
+O6 ON1 -0.51 22
+C5 CN5G 0.00 23
+N7 NN4 -0.60 24
+C8 CN4 0.25 25
+H8 HN3 0.16 26
+C2' CN8 -0.18 27
+H2' HN8 0.09 28
+H2'' HN8 0.09 29
+C3' CN7 0.01 30
+H3' HN7 0.09 31
+O3' ON2 -0.57 32
+[ bonds ]
+-O3' P
+P O1P
+P O2P
+P O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N9
+C1' C2'
+N9 C4
+N9 C8
+C4 N3
+C2 N2
+C2 N1
+N2 H21
+N2 H22
+N1 H1
+N1 C6
+C6 C5
+C5 N7
+C2' C3'
+C3' O3'
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C8 H8
+C2 N3
+C4 C5
+N7 C8
+C6 O6
+[ impropers ]
+C2 N3 N1 N2
+C6 N1 C5 O6
+N2 H21 C2 H22
+
+[ DG5 ]
+; O6
+; ||
+; C6
+; / \
+; H1-N1 C5--N7\\
+; | || C8-H8
+; C2 C4--N9/
+; / \\ / \
+; H21-N2 N3 \
+; | \
+; H22 \
+; \
+; H5' H4' O4' \
+; | \ / \ \
+; H5T-O5'-C5'---C4' C1'
+; | \ / \
+; H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+;
+[ atoms ]
+H5T HN5 0.43 0
+O5' ON5 -0.66 1
+C5' CN8B 0.05 2
+H5' HN8 0.09 3
+H5'' HN8 0.09 4
+C4' CN7 0.16 5
+H4' HN7 0.09 6
+O4' ON6 -0.50 7
+C1' CN7B 0.16 8
+H1' HN7 0.09 9
+N9 NN2B -0.02 10
+C4 CN5 0.26 11
+N2 NN1 -0.68 12
+H21 HN1 0.32 13
+H22 HN1 0.35 14
+N3 NN3G -0.74 15
+C2 CN2 0.75 16
+N1 NN2G -0.34 17
+H1 HN2 0.26 18
+C6 CN1 0.54 19
+O6 ON1 -0.51 20
+C5 CN5G 0.00 21
+N7 NN4 -0.60 22
+C8 CN4 0.25 23
+H8 HN3 0.16 24
+C2' CN8 -0.18 25
+H2' HN8 0.09 26
+H2'' HN8 0.09 27
+C3' CN7 0.01 28
+H3' HN7 0.09 29
+O3' ON2 -0.57 30
+[ bonds ]
+H5T O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N9
+C1' C2'
+N9 C4
+N9 C8
+C4 N3
+C2 N2
+C2 N1
+N2 H21
+N2 H22
+N1 H1
+N1 C6
+C6 C5
+C5 N7
+C2' C3'
+C3' O3'
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C8 H8
+C2 N3
+C4 C5
+N7 C8
+C6 O6
+[ impropers ]
+C2 N3 N1 N2
+C6 N1 C5 O6
+N2 H21 C2 H22
+
+[ DG3 ]
+; O6
+; ||
+; C6
+; / \
+; H1-N1 C5--N7\\
+; | || C8-H8
+; C2 C4--N9/
+; / \\ / \
+; H21-N2 N3 \
+; | \
+; H22 \
+; \
+; O1P H5' H4' O4' \
+; | | \ / \ \
+; -P-O5'-C5'---C4' C1'
+; | | \ / \
+; O2P H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+; H3T
+[ atoms ]
+P P2 1.50 0
+O1P ON3 -0.78 1
+O2P ON3 -0.78 2
+O5' ON2 -0.57 3
+C5' CN8B -0.08 4
+H5' HN8 0.09 5
+H5'' HN8 0.09 6
+C4' CN7 0.16 7
+H4' HN7 0.09 8
+O4' ON6 -0.50 9
+C1' CN7B 0.16 10
+H1' HN7 0.09 11
+N9 NN2B -0.02 12
+C4 CN5 0.26 13
+N2 NN1 -0.68 14
+H21 HN1 0.32 15
+H22 HN1 0.35 16
+N3 NN3G -0.74 17
+C2 CN2 0.75 18
+N1 NN2G -0.34 19
+H1 HN2 0.26 20
+C6 CN1 0.54 21
+O6 ON1 -0.51 22
+C5 CN5G 0.00 23
+N7 NN4 -0.60 24
+C8 CN4 0.25 25
+H8 HN3 0.16 26
+C2' CN8 -0.18 27
+H2' HN8 0.09 28
+H2'' HN8 0.09 29
+C3' CN7 0.14 30
+H3' HN7 0.09 31
+O3' ON5 -0.66 32
+H3T HN5 0.43 33
+[ bonds ]
+-O3' P
+P O1P
+P O2P
+P O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N9
+C1' C2'
+N9 C4
+N9 C8
+C4 N3
+C2 N2
+C2 N1
+N2 H21
+N2 H22
+N1 H1
+N1 C6
+C6 C5
+C5 N7
+C2' C3'
+C3' O3'
+O3' H3T
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C8 H8
+C2 N3
+C4 C5
+N7 C8
+C6 O6
+[ impropers ]
+C2 N3 N1 N2
+C6 N1 C5 O6
+N2 H21 C2 H22
+
+;----------------------------------------------------------------------
+[ DT ]
+; H51 O4
+; | ||
+; H52-C5M C4 H3
+; | \ / \ /
+; H53 C5 N3
+; || |
+; H6-C6 C2
+; \ / \\
+; N1 O2
+; \
+; \
+; \
+; O1P H5' H4' O4' \
+; | | \ / \ \
+; -P-O5'-C5'---C4' C1'
+; | | \ / \
+; O2P H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+;
+;
+[ atoms ]
+P P2 1.50 0
+O1P ON3 -0.78 1
+O2P ON3 -0.78 2
+O5' ON2 -0.57 3
+C5' CN8B -0.08 4
+H5' HN8 0.09 5
+H5'' HN8 0.09 6
+C4' CN7 0.16 7
+H4' HN7 0.09 8
+O4' ON6 -0.50 9
+C1' CN7B 0.16 10
+H1' HN7 0.09 11
+N1 NN2B -0.34 12
+C6 CN3 0.17 13
+H6 HN3 0.17 14
+C2 CN1T 0.51 15
+O2 ON1 -0.41 16
+N3 NN2U -0.46 17
+H3 HN2 0.36 18
+C4 CN1 0.50 19
+O4 ON1 -0.45 20
+C5 CN3T -0.15 21
+C5M CN9 -0.11 22
+H51 HN9 0.07 23
+H52 HN9 0.07 24
+H53 HN9 0.07 25
+C2' CN8 -0.18 26
+H2' HN8 0.09 27
+H2'' HN8 0.09 28
+C3' CN7 0.01 29
+H3' HN7 0.09 30
+O3' ON2 -0.57 31
+[ bonds ]
+-O3' P
+P O1P
+P O2P
+P O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N1
+C1' C2'
+N1 C2
+N1 C6
+C2 N3
+N3 H3
+N3 C4
+C4 C5
+C5 C5M
+C2' C3'
+C3' O3'
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C6 H6
+C5M H51
+C5M H52
+C5M H53
+C2 O2
+C4 O4
+C5 C6
+[ impropers ]
+C2 N1 N3 O2
+C4 N3 C5 O4
+C5 C4 C6 C5M
+
+[ DT5 ]
+; H51 O4
+; | ||
+; H52-C5M C4 H3
+; | \ / \ /
+; H53 C5 N3
+; || |
+; H6-C6 C2
+; \ / \\
+; N1 O2
+; \
+; \
+; \
+; H5' H4' O4' \
+; | \ / \ \
+; H5T-O5'-C5'---C4' C1'
+; | \ / \
+; H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+;
+;
+[ atoms ]
+H5T HN5 0.43 0
+O5' ON5 -0.66 1
+C5' CN8B 0.05 2
+H5' HN8 0.09 3
+H5'' HN8 0.09 4
+C4' CN7 0.16 5
+H4' HN7 0.09 6
+O4' ON6 -0.50 7
+C1' CN7B 0.16 8
+H1' HN7 0.09 9
+N1 NN2B -0.34 10
+C6 CN3 0.17 11
+H6 HN3 0.17 12
+C2 CN1T 0.51 13
+O2 ON1 -0.41 14
+N3 NN2U -0.46 15
+H3 HN2 0.36 16
+C4 CN1 0.50 17
+O4 ON1 -0.45 18
+C5 CN3T -0.15 19
+C5M CN9 -0.11 20
+H51 HN9 0.07 21
+H52 HN9 0.07 22
+H53 HN9 0.07 23
+C2' CN8 -0.18 24
+H2' HN8 0.09 25
+H2'' HN8 0.09 26
+C3' CN7 0.01 27
+H3' HN7 0.09 28
+O3' ON2 -0.57 29
+[ bonds ]
+H5T O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N1
+C1' C2'
+N1 C2
+N1 C6
+C2 N3
+N3 H3
+N3 C4
+C4 C5
+C5 C5M
+C2' C3'
+C3' O3'
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C6 H6
+C5M H51
+C5M H52
+C5M H53
+C2 O2
+C4 O4
+C5 C6
+[ impropers ]
+C2 N1 N3 O2
+C4 N3 C5 O4
+C5 C4 C6 C5M
+
+[ DT3 ]
+; H51 O4
+; | ||
+; H52-C5M C4 H3
+; | \ / \ /
+; H53 C5 N3
+; || |
+; H6-C6 C2
+; \ / \\
+; N1 O2
+; \
+; \
+; \
+; O1P H5' H4' O4' \
+; | | \ / \ \
+; -P-O5'-C5'---C4' C1'
+; | | \ / \
+; O2P H5'' C3'--C2' H1'
+; / \ / \
+; O3' H3' H2' H2''
+; |
+; H3T
+;
+[ atoms ]
+P P2 1.50 0
+O1P ON3 -0.78 1
+O2P ON3 -0.78 2
+O5' ON2 -0.57 3
+C5' CN8B -0.08 4
+H5' HN8 0.09 5
+H5'' HN8 0.09 6
+C4' CN7 0.16 7
+H4' HN7 0.09 8
+O4' ON6 -0.50 9
+C1' CN7B 0.16 10
+H1' HN7 0.09 11
+N1 NN2B -0.34 12
+C6 CN3 0.17 13
+H6 HN3 0.17 14
+C2 CN1T 0.51 15
+O2 ON1 -0.41 16
+N3 NN2U -0.46 17
+H3 HN2 0.36 18
+C4 CN1 0.50 19
+O4 ON1 -0.45 20
+C5 CN3T -0.15 21
+C5M CN9 -0.11 22
+H51 HN9 0.07 23
+H52 HN9 0.07 24
+H53 HN9 0.07 25
+C2' CN8 -0.18 26
+H2' HN8 0.09 27
+H2'' HN8 0.09 28
+C3' CN7 0.14 29
+H3' HN7 0.09 30
+O3' ON5 -0.66 31
+H3T HN5 0.43 32
+[ bonds ]
+-O3' P
+P O1P
+P O2P
+P O5'
+O5' C5'
+C5' C4'
+C4' O4'
+C4' C3'
+O4' C1'
+C1' N1
+C1' C2'
+N1 C2
+N1 C6
+C2 N3
+N3 H3
+N3 C4
+C4 C5
+C5 C5M
+C2' C3'
+C3' O3'
+O3' H3T
+C1' H1'
+C2' H2'
+C2' H2''
+C3' H3'
+C4' H4'
+C5' H5'
+C5' H5''
+C6 H6
+C5M H51
+C5M H52
+C5M H53
+C2 O2
+C4 O4
+C5 C6
+[ impropers ]
+C2 N1 N3 O2
+C4 N3 C5 O4
+C5 C4 C6 C5M
+
+
+
+; S-adenosyl methionine
+[ SAM ]
+ [ atoms ]
+ N NH3 -0.300 1
+ HT1 HC 0.330 2
+ HT2 HC 0.330 3
+ HT3 HC 0.330 4
+ CA CT1 0.210 5
+ HA HB1 0.100 6
+ CB CT2 -0.180 7
+ HB1 HA2 0.090 8
+ HB2 HA2 0.090 9
+ CG CT2 0.030 10
+ HG1 HA2 0.090 11
+ HG2 HA2 0.090 12
+ SDP SP 0.360 13
+ C5' CN8B 0.030 14
+ H5' HN8 0.090 15
+ H5'' HN8 0.090 16
+ CGP CT3 -0.050 17
+ HGP1 HA3 0.090 18
+ HGP2 HA3 0.090 19
+ HGP3 HA3 0.090 20
+ C CC 0.340 21
+ OT1 OC -0.670 22
+ OT2 OC -0.670 23
+ C4' CN7 0.160 24
+ H4' HN7 0.090 25
+ O4' ON6B -0.500 26
+ C1' CN7B 0.160 27
+ H1' HN7 0.090 28
+ N9 NN2 -0.050 29
+ C5 CN5 0.280 30
+ N7 NN4 -0.710 31
+ C8 CN4 0.340 32
+ H8 HN3 0.120 33
+ N1 NN3A -0.740 34
+ C2 CN4 0.500 35
+ H2 HN3 0.130 36
+ N3 NN3A -0.750 37
+ C4 CN5 0.430 38
+ C6 CN2 0.460 39
+ N6 NN1 -0.770 40
+ H61 HN1 0.380 41
+ H62 HN1 0.380 42
+ C2' CN7B 0.140 43
+ H2'' HN7 0.090 44
+ O2' ON5 -0.660 45
+ H2' HN5 0.430 46
+ C3' CN7 0.140 47
+ H3' HN7 0.090 48
+ O3' ON2 -0.660 49
+ H3T HN5 0.430 50
+ [ bonds ]
+ N HT1
+ N HT2
+ N HT3
+ N CA
+ CA HA
+ CA CB
+ CB HB1
+ CB HB2
+ CB CG
+ CG HG1
+ CG HG2
+ CG SDP
+ SDP CGP
+ CGP HGP1
+ CGP HGP2
+ CGP HGP3
+ CA C
+ C OT1
+ C OT2
+ SDP C5'
+ C5' C4'
+ C4' O4'
+ C4' C3'
+ O4' C1'
+ C1' N9
+ C1' C2'
+ N9 C4
+ N9 C8
+ C4 N3
+ C2 N1
+ C6 N6
+ N6 H61
+ N6 H62
+ C6 C5
+ C5 N7
+ C2' C3'
+ C2' O2'
+ O2' H2'
+ C3' O3'
+ O3' H3T
+ C1' H1'
+ C2' H2''
+ C3' H3'
+ C4' H4'
+ C5' H5'
+ C5' H5''
+ C8 H8
+ C2 H2
+ N1 C6
+ C2 N3
+ C4 C5
+ N7 C8
+ [ impropers ]
+ N6 C6 H61 H62
+ C6 N1 C5 N6
+ C CA OT1 OT2
+
+
+
+[ ACE ] ; terminal residue, provided by Mark Abraham
+ [ atoms ]
+ CH3 CT3 -0.270 1
+ HH31 HA3 0.090 1
+ HH32 HA3 0.090 1
+ HH33 HA3 0.090 1
+ C C 0.510 2
+ O O -0.510 2
+ [ bonds ]
+ C CH3
+ C +N
+ CH3 HH31
+ CH3 HH32
+ CH3 HH33
+ O C
+ [ impropers ]
+ C CH3 +N O
+
+[ NMA ] ; terminal residue, provided by Mark Abraham
+ [ atoms ]
+ N NH1 -0.470 1
+ HN H 0.310 1
+ CH3 CT3 -0.110 1
+ HH31 HA3 0.090 1
+ HH32 HA3 0.090 1
+ HH33 HA3 0.090 1
+ [ bonds ]
+ -C N
+ N HN
+ N CH3
+ CH3 HH31
+ CH3 HH32
+ CH3 HH33
+ [ impropers ]
+ N -C CH3 HN
+ -C CH3 N -O
+
+[ HOH ]
+ [ atoms ]
+ OW OT -0.834 0
+ HW1 HT 0.417 0
+ HW2 HT 0.417 0
+ [ bonds ]
+ OW HW1
+ OW HW2
+ HW1 HW2
+
+
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.vsd b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.vsd
new file mode 100644
index 0000000000000000000000000000000000000000..fb0a593c92756b72d2cae6126786b40132a18437
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/merged.vsd
@@ -0,0 +1,221 @@
+
+
+[ CH3 ]
+ CT3 CE1 MCH3
+ CT3 C MCH3
+ CT3 CA MCH3
+ CT3 CC MCH3
+ CT3 CD MCH3
+ CT3 CPB MCH3
+ CT3 CPH1 MCH3
+ CT3 CS MCH3
+ CT3 CT1 MCH3
+ CT3 CT2 MCH3
+ CT3 CT3 MCH3
+ CT3 NC2 MCH3
+ CT3 NH1 MCH3
+ CT3 NH2 MCH3
+ CT3 NH3 MCH3
+ CT3 OC MCH3
+ CT3 OH1 MCH3
+ CT3 OS MCH3
+ CT3 S MCH3
+ CT3 SM MCH3
+ CTL3 CL MCH3
+ CTL3 OSL MCH3
+ CTL3 CTL1 MCH3
+ CTL3 CTL2 MCH3
+ CTL3 CTL3 MCH3
+ CTL3 OHL MCH3
+ CTL3 CEL1 MCH3
+ CTL5 NTL MCH3
+
+[ NH3 ]
+ NH3 CT1 MNH3
+ NH3 CT2 MNH3
+ NH3 CT3 MNH3
+ NH3L CTL2 MNH3
+
+[ NH2 ]
+ NH2 planar
+ NP planar
+ NC2 planar
+
+
+; Data for generating dummy aromatic rings.
+; Actually we dont need all these bonds and angles,
+; but by specifying them here it is easier to improve
+; the dummy generation code later.
+[ PHE ]
+ CG CD1 0.140
+ CG CD2 0.140
+ CD1 CE1 0.140
+ CD2 CE2 0.140
+ CE1 CZ 0.140
+ CE2 CZ 0.140
+ CD1 HD1 0.108
+ CD2 HD2 0.108
+ CE1 HE1 0.108
+ CE2 HE2 0.108
+ CZ HZ 0.108
+ CG CD1 CE1 120.0
+ CD1 CE1 CZ 120.0
+ CE1 CZ CE2 120.0
+ CZ CE2 CD2 120.0
+ CE2 CD2 CG 120.0
+ CD2 CG CD1 120.0
+ CG CD1 HD1 120.0
+ CG CD2 HD2 120.0
+ HD1 CD1 CE1 120.0
+ CD1 CE1 HE1 120.0
+ HE1 CE1 CZ 120.0
+ CE1 CZ HZ 120.0
+ HZ CZ CE2 120.0
+ CZ CE2 HE2 120.0
+ HE2 CE2 CD2 120.0
+ HD2 CD2 CG 120.0
+
+[ TYR ]
+ CG CD1 0.140
+ CG CD2 0.140
+ CD1 CE1 0.140
+ CD2 CE2 0.140
+ CE1 CZ 0.140
+ CE2 CZ 0.140
+ CD1 HD1 0.108
+ CD2 HD2 0.108
+ CE1 HE1 0.108
+ CE2 HE2 0.108
+ CZ OH 0.1364
+ OH HH 0.0945
+ CG CD1 CE1 120.0
+ CD1 CE1 CZ 120.0
+ CE1 CZ CE2 120.0
+ CZ CE2 CD2 120.0
+ CE2 CD2 CG 120.0
+ CD2 CG CD1 120.0
+ CG CD1 HD1 120.0
+ CG CD2 HD2 120.0
+ HD1 CD1 CE1 120.0
+ CD1 CE1 HE1 120.0
+ HE1 CE1 CZ 120.0
+ CE1 CZ OH 120.0
+ CZ OH HH 113.0
+ OH CZ CE2 120.0
+ CZ CE2 HE2 120.0
+ HE2 CE2 CD2 120.0
+ HD2 CD2 CG 120.0
+
+[ TRP ] ; angles from MD sim, corrected to be perfectly planar
+ CB CG 0.1495
+ CG CD1 0.1352
+ CD1 NE1 0.1381
+ NE1 CE2 0.138
+ CE2 CD2 0.1419
+ CD2 CG 0.1459
+ CE2 CZ2 0.140
+ CZ2 CH2 0.140
+ CH2 CZ3 0.140
+ CZ3 CE3 0.140
+ CE3 CD2 0.1404
+ CD1 HD1 0.108
+ NE1 HE1 0.101
+ CE3 HE3 0.108
+ CZ2 HZ2 0.108
+ CZ3 HZ3 0.108
+ CH2 HH2 0.108
+ CB CG CD1 125.6
+ CB CG CD2 128.7
+ CG CD1 NE1 109.7
+ CD1 NE1 CE2 111.7
+ NE1 CE2 CD2 104.3
+ CE2 CD2 CG 108.5
+ CD2 CG CD1 105.7
+ NE1 CE2 CZ2 135.7
+ CE2 CZ2 CH2 120.0
+ CZ2 CH2 CZ3 120.0
+ CH2 CZ3 CE3 120.0
+ CZ3 CE3 CD2 120.0
+ CE2 CD2 CE3 120.0
+ CD2 CE2 CZ2 120.0
+ CE3 CD2 CG 131.5
+ CG CD1 HD1 124.6
+ HD1 CD1 NE1 125.7
+ CD1 NE1 HE1 122.7
+ HE1 NE1 CE2 125.6
+ CZ3 CE3 HE3 120.0
+ HE3 CE3 CD2 120.0
+ CE2 CZ2 HZ2 120.0
+ HZ2 CZ2 CH2 120.0
+ CH2 CZ3 HZ3 120.0
+ HZ3 CZ3 CE3 120.0
+ CZ2 CH2 HH2 120.0
+ HH2 CH2 CZ3 120.0
+
+[ HISA ] ; angles from MD sim, corrected to be perfectly planar
+ CG ND1 0.1381
+ ND1 CE1 0.1343
+ CE1 NE2 0.1335
+ NE2 CD2 0.1394
+ CD2 CG 0.137
+ ND1 HD1 0.101
+ CE1 HE1 0.108
+ CD2 HD2 0.108
+ CG ND1 CE1 107.4
+ ND1 CE1 NE2 113.1
+ CE1 NE2 CD2 104.5
+ NE2 CD2 CG 109.3
+ CD2 CG ND1 105.7
+ CG ND1 HD1 127.7
+ HD1 ND1 CE1 124.9
+ ND1 CE1 HE1 122.9
+ HE1 CE1 NE2 124.0
+ CG CD2 HD2 129.0
+ HD2 CD2 NE2 121.7
+
+[ HISB ] ; angles from MD sim, corrected to be perfectly planar
+ CG ND1 0.1394
+ ND1 CE1 0.1335
+ CE1 NE2 0.1343
+ NE2 CD2 0.1381
+ CD2 CG 0.137
+ CD2 HD2 0.108
+ CE1 HE1 0.108
+ NE2 HE2 0.101
+ CG ND1 CE1 104.9
+ ND1 CE1 NE2 112.9
+ CE1 NE2 CD2 107.3
+ NE2 CD2 CG 106.4
+ CD2 CG ND1 108.5
+ NE2 CD2 HD2 122.4
+ HD2 CD2 CG 131.2
+ ND1 CE1 HE1 123.8
+ HE1 CE1 NE2 123.3
+ CE1 NE2 HE2 125.9
+ HE2 NE2 CD2 126.8
+
+[ HISH ] ; angles from MD sim, corrected to be perfectly planar
+ CG ND1 0.1381
+ ND1 CE1 0.1343
+ CE1 NE2 0.1343
+ NE2 CD2 0.1381
+ CD2 CG 0.137
+ ND1 HD1 0.101
+ CE1 HE1 0.108
+ CD2 HD2 0.108
+ NE2 HE2 0.101
+ CG ND1 CE1 107.4
+ ND1 CE1 NE2 111.4
+ CE1 NE2 CD2 107.2
+ NE2 CD2 CG 107.4
+ CD2 CG ND1 106.6
+ CG ND1 HD1 127.4
+ HD1 ND1 CE1 125.2
+ ND1 CE1 HE1 124.3
+ HE1 CE1 NE2 124.3
+ CE1 NE2 HE2 126.4
+ HE2 NE2 CD2 126.4
+ NE2 CD2 HD2 120.8
+ HD2 CD2 CG 131.8
+
+
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/nbfix.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/nbfix.itp
new file mode 100644
index 0000000000000000000000000000000000000000..497505c499110315f96493d46efe1d286bee9569
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/nbfix.itp
@@ -0,0 +1,23 @@
+; NBFIX rmin=<charmm_rmin>/2^(1/6), eps=4.184*<charmm_eps>
+;name type1 type2 1 sigma epsilon
+[ nonbond_params ]
+ SOD CLA 1 0.332394311738 0.350933000000
+ POT CLA 1 0.363575766873 0.477963424000
+ SOD OCL 1 0.287760285959 0.313883680000
+ SOD OBL 1 0.278851298778 0.313883680000
+ SOD O2L 1 0.281523994932 0.313883680000
+ SOD OC 1 0.287760285959 0.313883680000
+ SOD OC2D2 1 0.287760285959 0.313883680000
+ SOD OG2D2 1 0.287760285959 0.313883680000
+ CRL1 HAL2 1 0.298451070577 0.134306400000
+ HGA1 HAL2 1 0.238760856462 0.150205600000
+ CRL2 HAL2 1 0.299341969295 0.173636000000
+ HGA2 HAL2 1 0.238760856462 0.132632800000
+ CRL1 HAL1 1 0.298451070577 0.122591200000
+ HGA1 HAL1 1 0.238760856462 0.137653600000
+ CRL2 HAL1 1 0.299341969295 0.158573600000
+ HGA2 HAL1 1 0.238760856462 0.120917600000
+ CRL1 CTL1 1 0.357250385974 0.115060000000
+ HGA1 CTL1 1 0.297560171859 0.128867200000
+ CRL2 CTL1 1 0.358141284692 0.148532000000
+ HGA2 CTL1 1 0.297560171859 0.113386400000
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/spc.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/spc.itp
new file mode 100644
index 0000000000000000000000000000000000000000..41e5afe53eb020ab725aa9b0ba58ef3b431a9c07
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/spc.itp
@@ -0,0 +1,30 @@
+
+[ moleculetype ]
+; molname nrexcl
+SOL 2
+
+[ atoms ]
+; nr type resnr residue atom cgnr charge mass
+ 1 OW 1 SOL OW 1 -0.82
+ 2 HW 1 SOL HW1 1 0.41
+ 3 HW 1 SOL HW2 1 0.41
+
+#ifndef FLEXIBLE
+[ settles ]
+; OW funct doh dhh
+1 1 0.1 0.16330
+
+[ exclusions ]
+1 2 3
+2 1 3
+3 1 2
+#else
+[ bonds ]
+; i j funct length force.c.
+1 2 1 0.1 345000 0.1 345000
+1 3 1 0.1 345000 0.1 345000
+
+[ angles ]
+; i j k funct angle force.c.
+2 1 3 1 109.47 383 109.47 383
+#endif
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/spce.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/spce.itp
new file mode 100644
index 0000000000000000000000000000000000000000..0f0456728ea15f052a3403cd88cce89e2099b7d6
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/spce.itp
@@ -0,0 +1,30 @@
+
+[ moleculetype ]
+; molname nrexcl
+SOL 2
+
+[ atoms ]
+; nr type resnr residue atom cgnr charge mass
+ 1 OW 1 SOL OW 1 -0.8476
+ 2 HW 1 SOL HW1 1 0.4238
+ 3 HW 1 SOL HW2 1 0.4238
+
+#ifndef FLEXIBLE
+[ settles ]
+; OW funct doh dhh
+1 1 0.1 0.16330
+
+[ exclusions ]
+1 2 3
+2 1 3
+3 1 2
+#else
+[ bonds ]
+; i j funct length force.c.
+1 2 1 0.1 345000 0.1 345000
+1 3 1 0.1 345000 0.1 345000
+
+[ angles ]
+; i j k funct angle force.c.
+2 1 3 1 109.47 383 109.47 383
+#endif
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/table-eef1-coul.xvg b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/table-eef1-coul.xvg
new file mode 100644
index 0000000000000000000000000000000000000000..96bcee3f6802d0ff02bf4cc2d089fac0b0834ba4
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/table-eef1-coul.xvg
@@ -0,0 +1,2001 @@
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diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/tip3p.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/tip3p.itp
new file mode 100644
index 0000000000000000000000000000000000000000..579e361e1648173a084e0f06d759d2f596853a90
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/tip3p.itp
@@ -0,0 +1,49 @@
+
+[ moleculetype ]
+; molname nrexcl
+SOL 2
+
+[ atoms ]
+; id at type res nr residu name at name cg nr charge
+#ifdef _FF_CHARMM
+1 OT 1 SOL OW 1 -0.834
+2 HT 1 SOL HW1 1 0.417
+3 HT 1 SOL HW2 1 0.417
+#endif
+
+
+#ifdef FLEXIBLE
+
+#ifdef ORIGINAL_TIP3P
+[ bonds ]
+; i j funct length force.c.
+1 2 1 0.09572 502416.0 0.09572 502416.0
+1 3 1 0.09572 502416.0 0.09572 502416.0
+
+[ angles ]
+; i j k funct angle force.c.
+2 1 3 1 104.52 628.02 104.52 628.02
+
+#else
+;CHARMM TIP3p
+[ bonds ]
+; i j funct length force.c.
+1 2 1 0.09572 376560.0 0.09572 376560.0
+1 3 1 0.09572 376560.0 0.09572 376560.0
+
+[ angles ]
+; i j k funct angle force.c.
+2 1 3 1 104.52 460.24 104.52 460.24
+#endif
+
+
+#else
+[ settles ]
+; i j funct length
+1 1 0.09572 0.15139
+
+[ exclusions ]
+1 2 3
+2 1 3
+3 1 2
+#endif
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/tip4p.itp b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/tip4p.itp
new file mode 100644
index 0000000000000000000000000000000000000000..a99a3d6ad12b94ec8a17774cf9634e1a9dae5c6e
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/tip4p.itp
@@ -0,0 +1,53 @@
+
+;
+; Note the strange order of atoms to make it faster in gromacs.
+;
+[ moleculetype ]
+; molname nrexcl
+SOL 2
+
+[ atoms ]
+; id at type res nr residu name at name cg nr charge
+1 OWT4 1 SOL OW 1 0.0
+2 HWT4 1 SOL HW1 1 0.52
+3 HWT4 1 SOL HW2 1 0.52
+4 MWT4 1 SOL MW 1 -1.04
+
+#ifndef FLEXIBLE
+[ settles ]
+; OW funct doh dhh
+1 1 0.09572 0.15139
+#else
+[ bonds ]
+; i j funct length force.c.
+1 2 1 0.09572 502416.0 0.09572 502416.0
+1 3 1 0.09572 502416.0 0.09572 502416.0
+
+[ angles ]
+; i j k funct angle force.c.
+2 1 3 1 104.52 628.02 104.52 628.02
+#endif
+
+[ exclusions ]
+1 2 3 4
+2 1 3 4
+3 1 2 4
+4 1 2 3
+
+; The position of the virtual site is computed as follows:
+;
+; O
+;
+; D
+;
+; H H
+;
+; const = distance (OD) / [ cos (angle(DOH)) * distance (OH) ]
+; 0.015 nm / [ cos (52.26 deg) * 0.09572 nm ]
+
+; Vsite pos x4 = x1 + a*(x2-x1) + b*(x3-x1)
+
+[ virtual_sites3 ]
+; Vsite from funct a b
+4 1 2 3 1 0.128012065 0.128012065
+
diff --git a/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/watermodels.dat b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/watermodels.dat
new file mode 100644
index 0000000000000000000000000000000000000000..3fc284f45f463a68a66fccf641cb77f4eca2f884
--- /dev/null
+++ b/user-doc/tutorials/others/isdb-1/charmm36-eef1sb.ff/watermodels.dat
@@ -0,0 +1,6 @@
+
+tip3p TIP3P TIP 3-point, recommended, by default uses CHARMM TIP3 with LJ on H
+tip4p TIP4P TIP 4-point
+tip5p TIP5P TIP 5-point
+spc SPC simple point charge
+spce SPC/E extended simple point charge