N#Cc1ccc(S(N)(=O)=O)cc1	0
CC[NH+](CC)CCN(C)C(=O)Nc1ccc(NC(=O)N(C)CC[NH+](CC)CC)cc1	2
CCOC(=O)c1c(C)n(C)c2ccc(OCC[NH+](CC)CC)cc12	1
Fc1cccc(Cl)c1CSc1ccccc1C1=[NH+]CCCN1	1
CC(C)O[C@H]1C[C@@H]2CCCC[N+]2(Cc2ccccc2)O1	1
CN(Cc1cccc(Br)c1)C1CC[NH+](C)CC1	1
Cc1[nH+]ccn1C[C@@H]1CCc2c(c3ccccc3n2C)C1=O	1
COc1cccc(C(=O)N2CCC(C(N)=O)([NH+]3CCCCC3)CC2)c1	1
CC[C@@H](c1nnc(SCCC[NH3+])n1-c1ccc(OC)cc1)[NH+](C)C	2
CC(C)(C)c1[nH+]ccn1C[C@@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1	1
COc1ccc2[nH]c3nc(SCC[NH+](C)C)nnc3c2c1	1
CC(C)C[NH+](CC(C)C)Cn1c(=O)oc2ccccc21	1
CC[C@@]1(OC(=O)c2ccccc2)C[C@@H](C)[N@@H+](C)C[C@@H]1C	1
CCC[NH+]1CCC([NH2+]C23CC4CC(CC(C4)C2)C3)CC1	2
Cc1cc(Cc2c[nH+]c(N)nc2N)c2cccnc2c1N(C)C	1
NC(=O)C1CC[NH+](CC(=O)Nc2ccc(Br)cc2)CC1	1
CN(C/C(Br)=C/c1ccccc1)C1CC[NH+](C)CC1	1
CCN(CC)C(=O)CSc1ccc(Cl)nn1	0
C[NH+]1CCN(/N=C/c2ccc(OCc3ccccc3)cc2)CC1	1
CC(C)CCNC(=O)C1CC[NH+](CCCc2ccccc2)CC1	1
C[C@@H](C[C@@H](C)[NH3+])NC(=O)C(=O)N(C)CCN(C)C1CC[NH+](C)CC1	2
C[NH+](C)CCN1CCCN(C(=O)CC2([NH+]3CCOCC3)CCCC2)CC1	2
Cc1ccc(OC[C@@H](O)C[NH+]2CCC(C[NH+]3CCOCC3)CC2)cc1	2
CC(C)(C)[NH2+]C[C@@H](O)c1cc(Cl)c(N)c(Cl)c1	1
COc1cccc(-c2csc(-c3cccnc3)n2)c1	0
CCn1c(C)[n+](-c2ccccc2)c2ccc(C(=O)N(C)C)cc21	1
CC(C)N(CC[NH+]1CCCCCC1)C(=O)C[C@@H]1C(=O)NCC[N@H+]1C(C)C	2
Cn1c[n+](N=Cc2ccc(Br)cc2)cn1	1
[NH3+]CCCCCC[NH+]1CCN(c2cccc(Cl)c2)CC1	2
CNC(=O)[C@@H]1C[C@@H]([NH3+])CN1C(=O)CC1CC[NH+](Cc2ccccc2)CC1	2
O=C(CC[NH+]1CCCC1)NC[C@@H]1OCCc2ccccc21	1
O=C1C[C@@H](NC2CC[NH+](Cc3ccccc3)CC2)C(=O)N1c1ccccc1	1
CC(C)CC(=O)N1CCN(C2CC[NH+](Cc3ccccc3)CC2)CC1	1
NC(=O)C1CC[NH+](CCCC[NH2+]Cc2ccc(F)c(F)c2)CC1	2
CCC[N@@H+]1CCc2cc(O)cc3c2[C@H]1Cc1ccc(O)c(O)c1-3	1
O=C(Nc1ccc(Cl)cc1)O[C@@H]1C[NH+]2CCC1CC2	1
C[N@H+]1CCC[C@@H]1CNC(=O)C(=O)Nc1cnn(CC[NH+]2CCCCC2)c1	2
CNC(=O)Oc1cc(C[NH+](C)C)c(OC(=O)NC)cc1C[NH+](C)C	2
CC[NH+](CC)CCn1nc2c(c1C)c(=O)c1cc(OC)ccc1n2C	1
O=[N+]([O-])c1ccc(CN2CC[NH+](C[C@@H]3CC=CCC3)CC2)cc1	1
CCOC(=O)c1c(NC(=O)c2cnccn2)sc2c1CCC2	0
Clc1ccc(C=NNC2=Cn3c(nc4ccccc43)N[NH2+]2)cc1	1
Cc1cc(C)c(S(=O)(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1C	1
Cc1cc(C)[n+](-c2ccccc2)c2cc(-c3ccccc3)nn12	1
CN1c2cc(F)ccc2C(c2ccccc2)=[NH+]C[C@@H]1CNC(=O)c1ccoc1	1
Cc1c(C)n(Cc2ccccn2)c2nc[nH+]c(NCCC[NH+](C)C)c12	2
O=C1CCC([NH+]2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1	1
CCN(CC)S(=O)(=O)c1cnccc1N1CC[NH+](C(C)C)CC1	1
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1ccc(N(CCO)CCO)cc1	2
NC(=O)c1cc[n+](COC[n+]2ccccc2/C=N/[O-])cc1	1
COC(=O)[C@@H](Cc1ccc(O)c(O)c1)/[NH+]=C/c1ccc(N(C)C)cc1	1
O[C@@](C#CC[NH+]1CCCCCC1)(c1ccccc1)c1cccnc1	1
COc1ccc(OC[C@H](O)C[NH2+]C(C)C)cc1C(C)(C)C	1
O=C(NCc1cccnc1)C1CC[NH+](Cc2ccc(F)cc2)CC1	1
[NH3+]Cc1cn(C2CC[NH+](Cc3cccnc3N3CCOCC3)CC2)nn1	2
Cc1ccc(N2CC[NH+](CCCN3C(=O)[C@@H]4CCCN4C3=O)CC2)cc1	1
C[C@@H](NS(=O)(=O)c1ccc(F)cc1)c1ccccc1	0
N#Cc1c2c(c(-n3ccnc3)n3c1nc1ccccc13)CCCC2	0
COc1ccc(Cn2c(-c3ccc(Cl)cc3)c[n+]3ccccc23)cc1	1
CC(C)(C)C(=O)OCCC[N+]1(C)CC[N+](C)(C)CC1	2
Nc1nc(N)nc(-c2ccccc2[N+](=O)[O-])n1	0
Cc1cc(OCCC[NH2+]CCN(C)C)ccc1[N+](=O)[O-]	1
O=C(Nc1ccccc1)Nc1cc(C2CC2)[nH]n1	0
COC(=O)c1ccc(C[NH+]2CCc3nnc(CCNC(=O)[C@@H]4CCC[N@@H+](C)C4)n3CC2)cc1	2
CC[NH+](CC)CCCNc1cc(C)[nH+]c2ccc(C)cc12	2
C[NH+](C)CCc1c[nH]c2ccc(C[C@@H]3COC(=O)N3)cc12	1
C(=N/c1nc2ccccc2n1CC[NH+]1CCCCC1)\c1cccs1	1
COc1ccc(NC(=O)c2ccc(-c3ccncc3)cc2)cc1N1CC[NH+](C)CC1	1
Cc1cccc(OC[C@@H](O)C[n+]2cn(C)c3ccccc32)c1	1
COc1ccccc1C1(O)CC[NH+](Cc2ccccc2)CC1	1
CC[NH+]1CCC(NC(=O)CN2CCC(C[NH+]3CCCC3)CC2)CC1	2
CC(=O)NC1=CC(=O)[C@@H](N(C)C(=O)C[C@@H]([NH3+])CCCNC(N)=[NH2+])CN1	2
OC(C[n+]1cccc(Br)c1)C[n+]1cccc(Br)c1	2
Cn1cc(C(=O)N2CCC[C@H]([NH+](C)C)C2)c2ccccc21	1
CNc1nc(N2CCC([NH+](C)C)CC2)nc(N2CCC([NH+](C)C)CC2)[nH+]1	3
COc1ccccc1OCC[N@@H+](C)CCC[C@@]1(C#N)CCOc2ccccc21	1
CC(=O)N1CCC([NH2+]C(c2ccccc2)c2ccccc2)CC1	1
Cc1n(C)c2ccccc2[n+]1CCOCC[n+]1c(C)n(C)c2ccccc21	2
CC(C)[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCCn3cccn3)C2)CC1	2
CC(C)C[NH2+]CC(=O)Nc1ccc(-c2ccc(NC(=O)C[NH2+]CC(C)C)cc2)cc1	2
CC[NH+](CC)CC(=O)NCC1(c2ccccc2)CCOCC1	1
COc1cc(C[NH2+][C@@H]2CCCC[C@@H]2OC)cc(OC)c1OC	1
CCN1C(=O)N(CC[NH+](C)C)C(=O)C12CC[NH+]([C@@H](C)Cc1cccnc1)CC2	2
COC[C@@H](C)[NH+]1CCC(CCC(=O)NCC[NH+](C)C)CC1	2
CC(C)CCn1nnnc1[C@@H](C(C)C)[NH+]1CCC(C(N)=O)CC1	1
COc1cc2c(cc1OC)[C@H]1CC(=O)[C@H](CC(C)C)C[N@H+]1CC2	1
Cn1cc(CC[NH+]2CCN(c3ccccc3Cl)CC2)cn1	1
CC[N+]1(CC)C[C@@H](C)O[C@@](O)(c2ccc(Cl)cc2)C1	1
C[C@@H]1C[NH+](C[C@H](O)CN2CCN(C(=O)C[NH+]3CCCC3)CC2)C[C@@H](C)O1	2
C[NH+](C)CCNc1ccc2c3c(cccc13)C(=O)N(CC[NH+](C)C)C2=O	2
CCCCCCNC(=[NH2+])NC(=[NH2+])Nc1cccc(C(F)(F)F)c1	2
O=C(NCCc1nc(-c2ccccc2)cs1)C12C[NH2+]CC1C[NH2+]C2	2
c1ccc(Cc2ccc(OCC[NH+]3CCCC3)nc2)cc1	1
C[NH2+][C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1C(=O)NCC1CCC([NH3+])CC1	2
CC[N@H+]1CCC[C@@H]1CNC(=O)c1c(OC)ccc(Br)c1OC	1
CC[NH+](CC)CCN1C(=O)Cn2c(C)c(C)c3cccc1c32	1
CN(C(=O)c1ccco1)C1CC(C)(C)[NH+](C)C(C)(C)C1	1
Cn1nccc1[C@H](OCC[NH+](C)C)c1cccs1	1
CC1(C)CC(Nc2c(Cl)cc(Cl)c[n+]2[O-])CC(C)(C)[NH2+]1	1
Cc1ccc2[nH+]c(-c3ccc(O)cc3)c(NC[C@@H]3CCCO3)n2c1	1
CC[NH+]1CCC([NH+]2CCC(C(=O)N[C@@H](CO)C[NH+](C)C)CC2)CC1	3
COc1cc2cc[n+]3c(c2cc1OC)-c1c2cc(OC)c(OC)cc2cc[n+]1CC3	2
C[N+]1(CC#CCOC(=O)CCCC(=O)OCC#CC[N+]2(C)CCCCC2)CCCCC1	2
CCOC(=O)c1ccccc1NC(=O)c1cccc(C)c1	0
COc1ccc(C[NH+]2CCN(c3ccccc3)CC2)cc1C	1
CC[C@@H](CO)[NH2+]C[C@@H](O)Cn1c2c(c3cc(C)ccc31)CCCC2	1
COc1ccc([N+]2=C3CCCCN3C[C@@]2(O)c2ccc(F)cc2)cc1	1
CC[NH+](CC)CC(=O)Nc1ccc2c(c1)Nc1ccccc1CC2	1
Nc1nc(N)c(N)c(Nc2ccc(Br)cc2)n1	0
CC[NH+](CC)CCC[N@H+]1CC[C@@H](Cc2ccc(OC)cc2)C1	2
CCC[NH+]1CCC(CC(=O)N2CCC[N@H+]([C@H]3COC[C@@H]3O)CC2)CC1	2
C[NH+](C)CCO[C@@](C)(c1ccccc1)c1ccccn1	1
CC(C)[NH2+]C[C@@H](O)CC(c1ccccc1)c1ccccc1	1
Cc1cc(/C=C/c2ccccc2OC[C@H](O)C[NH2+]C(C)(C)C)on1	1
CC1(C(=O)N2CCC(Cn3cc(C(C)(C)[NH3+])nn3)CC2)CC[NH2+]CC1	2
CCOC(=O)CN1CC[NH2+]CCN(CC(=O)OCC)CC[NH2+]CC1	2
COc1ccc(C(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2)cc1S(=O)(=O)NCC[NH+](C)C	2
COc1ccc(Cl)cc1-c1nc(N)nc(NN2CCCCC2)[nH+]1	1
O[C@@H](COCc1ccccc1F)C[NH+]1CCC(C[NH+]2CCOCC2)CC1	2
CCn1c[n+](C[C@@H](O)COC2CCCCC2)c2cc(C)c(C)cc21	1
COc1ccc(C[NH2+]Cc2ccc(OC)c(C)c2)cc1	1
CCc1ccc(OCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1	1
CC[NH+](CC)Cc1ccc(CNC(=O)N2CC[NH+](CCOC)CC2)cc1	2
O=C(C[NH+]1CCC(c2c[nH]c3ccccc23)CC1)Nc1ccccn1	1
COc1cc(Br)cc(CNc2cc(C)cc[nH+]2)c1O	1
CCC[NH+]1CCC([NH2+]Cc2ccc3c(c2)OCO3)CC1	2
Oc1ccc(C(=S)N2CCOCC2)cc1O	0
COc1ccc([C@@]2(O)CN3C(=[N+]2Cc2ccccc2)CCc2ccccc23)cc1	1
O=C(c1sc2cc(Cl)ccc2c1Cl)N1CC[NH2+]CC1	1
COc1ccc(OC[C@@H](O)Cn2c(C)nc3ccccc32)cc1	0
CCOC(=O)c1c(-c2ccccc2)oc2ccc(O)c(C[N@H+]3CCCC[C@@H]3C)c12	1
Nc1nc(N)c2c(Oc3ccc(F)cc3)cccc2[nH+]1	1
O=C(c1nc2ccccn2c1C[NH2+]CC1CC[NH+](CCO)CC1)N1CCCC1	2
C[NH+]1CCN(c2ncccc2NC(=O)CCc2cc3n(n2)CCC[NH2+]C3)CC1	2
CC1[N+](=O)[C@@H](c2ccccc2C(F)(F)F)N(O)C1(C)C	1
CC[NH+](CC)CC#CCC(CC#CC[NH+](CC)CC)C(=O)OC	2
CC1(C)CC(NC(=S)NCCC[NH+]2CCOCC2)CC(C)(C)[NH2+]1	2
CC[NH+]1CCN(c2nc(C)nc3c2sc(=S)n3C)CC1	1
CC[NH+](CC)CC(=O)N(C)Cc1cc([C@@H]2CCC[NH2+]C2)nn1C	2
O=C(Nc1ccc(C2=[NH+]CCN2)cc1)Nc1ccc(C2=[NH+]CCN2)cc1	2
C[C@@H](CN1CC[NH+](C)CC1)NC(=O)CC[NH+]1CCN(c2ccccn2)CC1	2
CN1CCC([N@H+]2CCC[C@@H](NC(=O)C[NH+]3CCCCCC3)C2)CC1	2
C[NH+]1CCN(c2ncc(C[NH2+]CC3(O)CC[NH+](C)CC3)cn2)CC1	3
O=c1[nH]c2ccccc2n1CCC[NH+]1CCN(c2ccc(F)cc2)CC1	1
COCCN1CCC[C@](O)(C[NH+]2CCN(c3cc(C)[nH+]c(N)n3)CC2)C1=O	2
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)N1CCC[C@@H](C[NH+]2CCOCC2)C1	2
CC(=O)c1c(C)nn2c3ccccc3n(CC[NH+]3CCCCC3)c12	1
Cc1ccc(NCc2cc(Br)ccc2O)[nH+]c1	1
CC1(C)[NH2+]CC[C@@]12C(=O)N(Cc1ccccc1)c1ccccc12	1
O=C1NC2(CC[NH+](Cc3ccccc3)CC2)Oc2ccccc21	1
CC[N@H+]1CCC[C@H]1CNc1ncnc2c1[nH]c1ccc(OC)cc12	1
CCOC(=O)c1c(C)n(C)c2ccc(O)c(C[NH+]3CCCCC3)c12	1
CCOC(=O)c1ccc(NC2=NC3(CCCCC3)NC(=[NH2+])N2)cc1	1
CCC[N@@H+](CC1CC1)[C@@H]1CC(=O)N(c2ccc(C)cc2)C1=O	1
COc1cc(C(=O)NCC[NH+](C)C)cc(OC)c1OC	1
COCC[N@H+]1CC[C@@H](C[NH+]2CCN(c3ccc(C)cc3)CC2)C1	2
CN1CC[NH+](CCCCNC(=O)c2ccnc(N3CC[NH+](C)CC3)c2)CC1	2
NC(=O)C1CC[NH+](Cc2c(Cl)cccc2Cl)CC1	1
O=c1c2ccccc2nc(C[n+]2ccccc2)n1-c1ccccc1	1
CC[NH+](CC)CCCNc1nc(C)cc(Nc2ccc3[nH+]c(C)cc(N)c3c2)n1	2
CCC(=O)Oc1c(Br)cc(C=O)cc1OC	0
Cc1sc(NC(=O)c2ccccc2)c(C(=O)NCC[NH+](C)C)c1C	1
C[NH+](C)CC/C=C1/c2ccc(F)cc2Sc2ccc(Cl)cc21	1
CC[NH+]1CCN(c2ccc(/N=C/c3ccc([N+](=O)[O-])cc3)cc2)CC1	1
O=c1[nH]c2ccccc2cc1C[N@H+]1CCc2ccccc2C1	1
Cc1ccc(OCC(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2)cc1	1
CCc1ccc(OC[C@H](O)C[N@H+]2[C@@H](C)CCC[C@H]2C)cc1	1
CC[NH+]1CCN(C(=O)C2CC[NH+](Cc3ccc(O)c(OC)c3)CC2)CC1	2
C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1	3
CCCC(=O)Nc1nnc(COc2ccc(C(C)(C)C)cc2)s1	0
NNc1cc(N2CCOCC2)nc(OCCc2ccccn2)[nH+]1	1
CC(C)c1cc(I)ccc1NC(=O)CSc1nc(N)cc(N)[nH+]1	1
CCCc1cc(NCCC(C)C)n2c(nc3ccccc32)c1C#N	0
COc1cccc(CNC(=O)C[NH+]2CCC(C[NH+]3CCOCC3)CC2)c1	2
COc1cc(C[NH2+]Cc2ccccc2)cc(OC)c1OC	1
Cc1nc2nc(C[NH3+])nn2c(C)c1CCC(=O)NCC1CC[NH+](Cc2ccccc2F)CC1	2
Cc1cc(N2CCC(NC(=O)C(=O)NCC[N@H+](C)C3CC3)CC2)nc(C)[nH+]1	2
Cc1cc(C)c(C#N)c(Nc2ccc(Oc3ccccc3)cc2)n1	0
C[C@@H](CC[NH+](C)C)NC(=O)C(=O)N(C)CC[N@H+](C)C1CCN(C)CC1	2
c1ccc(-c2n[nH]cc2C[NH+]2CCN(c3ccccn3)CC2)cc1	1
COc1ccc2[nH]c3c(=O)n(CC[NH+]4CCCC4)cnc3c2c1	1
C=CC[N+]1(C/C=C/C)CC[N+](CC=C)(C/C=C/C)CC1	2
NC(=[NH2+])SCCc1ccc(CCSC(N)=[NH2+])cc1	2
C[C@@H](CCc1ccc(O)cc1)[NH2+]CCc1ccc(O)c(O)c1	1
Cc1cc(OC[C@@H](O)C[NH2+]C(C)(C)C)ccc1Cl	1
CCC[N@H+](c1ccncc1F)n1cc(C)c2cc(OC(=O)NC)ccc21	1
Cc1ccccc1OCC(=O)Nc1c[nH]c(=O)[nH]c1=O	0
Cc1nn(C)c(C)c1CN(CCO)C(=O)[C@@H]1CC2(CC[NH2+]CC2)C[N@H+]1C	2
Cc1nc2ccccn2c(=O)c1CC[NH+]1CCC(C(=O)c2ccc(F)cc2)CC1	1
[NH3+]C1CC[NH+](CCCC(=O)N2CC[NH+](C[C@@H]3CCOC3)CC2)CC1	3
c1ccc(COCC2(c3ccccc3)CC[NH2+]CC2)cc1	1
C[N+]12CCC(CC1)[C@@H]([C@@](O)(c1ccccc1)c1cccs1)C2	1
C[N+]1(CCNC(=O)C(=O)NCC[N+]2(C)CCCCCC2)CCCCCC1	2
CNC(=O)NC(=O)C[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1	2
COc1cccc(CSc2nc(N)cc(N)[nH+]2)c1	1
CC1(C)CC(OC(=O)/C=C/C(=O)OC2CC(C)(C)[NH2+]C(C)(C)C2)CC(C)(C)[NH2+]1	2
COC(=O)[C@@H]1[C@H](c2ccc(I)cc2)C[C@@H]2CC[C@H]1[N@@H+]2C	1
CSCC(=O)N(CCC[NH+](C)C)CC1CC[NH+](C2Cc3ccccc3C2)CC1	2
CC(C)[N@H+]1C[C@H]2C[C@H](CN(C(=O)c3ccccc3)C2)C1	1
C[C@@H]1CCC[N@H+](C2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)C1	1
C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1	3
COc1cccc(N2CC[NH+](C[C@@H]3C[C@H]4C=C[C@@H]3C4)CC2)c1	1
CC[NH+](CC)CCn1c(=N)n(CC(=O)OC)c2ccccc21	1
CC1CC[NH+](CCNS(=O)(=O)c2cccc3cccnc23)CC1	1
COc1cc2[nH+]c(N3CCc4c(ccc5ccccc45)C3)nc(N)c2cc1OC	1
C[NH+]1CCC(CNC(=O)[C@@H](c2ccccc2)[NH+](C)C)(N2CCOCC2)CC1	2
C[NH+]1CCN(c2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1	1
Nc1cc(N)[nH+]c(SCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)n1	1
COC(=O)c1c(NC(=O)C[NH+]2CCCCCC2)sc2c1CC[C@@H](C)C2	1
Cc1[nH+]ccn1CCNC(=O)C(=O)Nc1ccc(OCC[NH+](C)C)cc1	2
COc1ccc(NC(=O)CC[NH+]2CCC(C)CC2)c(OC)c1	1
O=C(NCC[NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccs1	2
Cc1ccc2c(c1)O[C@H]1[C@H](NC(=O)CCN3CC[NH+](C)CC3)C(=O)CC[C@@]21C	1
O=C1CCCN1CC[NH2+]CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1	2
[NH3+]CC1(O)CC[NH+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CC1	3
CCC[N@H+]1CCC[C@H](c2cccc(S(C)(=O)=O)c2)C1	1
Nn1cnc2cc3ccccc3cc2c1=O	0
CCOC(=O)C1=C(C)N=C(SC)N(C)[C@@H]1c1ccccc1	0
Cc1c(C(=O)NCC[NH+](C)C)sc2nc(-c3ccccc3)cn12	1
COc1cc2c(cc1OC)C[N@@H+](CC[C@@H](C)c1ccc(Cl)cc1)CC2	1
[NH3+][C@@H](c1ccccc1)P(=O)([O-])[C@@H]([NH3+])c1ccccc1	1
Cc1ncc(C[n+]2csc(CCO)c2C)c(N)n1	1
CC(=O)NC1=NN(C(C)=O)[C@@H](C)S1	0
C[C@@H]1C[NH+]=C(c2ccc(NC(=O)Nc3ccc(C4=[NH+]C[C@@H](C)N4)cc3)cc2)N1	2
C[N@@H+](Cc1ccccc1)[C@@H]1CC(=O)N(c2ccccc2)C1=O	1
COCC(=O)N(c1ccccc1)C1CC[NH+](CCc2ccccc2)CC1	1
Cc1ccc(N2C(=O)C[C@H]([NH2+]C[C@@H](C)c3ccccc3)C2=O)cc1	1
O=C(c1ccc(OC[C@H](O)C[NH+]2CCCCC2)cc1)N1CCCCC1	1
C[NH+](C)CCCNc1ccc([N+](=O)[O-])c(NCCC[NH+](C)C)c1C#N	2
Brc1ccc([C@@H]2CN3CCSC3=[NH+]2)cc1	1
Cc1cc(C(=O)C[NH+]2CCC(C)CC2)c(C)n1-c1ccc(F)cc1	1
Cc1[nH+]c(N)nc(N)c1-c1ccc(Cl)c(Cl)c1	1
CC1(C)CC(NC(=O)c2scc3c2CCCC3)CC(C)(C)[NH2+]1	1
O=c1[nH]c(=O)c2cc3c(=O)[nH]c(=O)c3cc12	0
C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)[NH+]1CCCC1	1
C[N+](C)(CC[N+](C)(C)CC(=O)c1ccccc1)CC(=O)c1ccccc1	2
CC[NH+](CC)[C@@H](C)CN1c2ccccc2Sc2ccccc21	1
Cc1ccc2[nH]c(=O)c(-[n+]3ccccc3)c(-c3ccccc3)c2c1	1
CN1CCN(c2cc[nH+]c3ccc(NC(=O)Cc4cccc(Cl)c4Cl)cc23)CC1	1
COc1ccc(C(=O)C[C@@H]2CCC[C@H](CC(=O)c3ccc(OC)cc3)[N@@H+]2C)cc1	1
C[NH+]1CCN(c2nnc(-c3ccccc3)c3ccccc23)CC1	1
C[NH+](C)CC[C@H](c1ccccn1)c1ccc(Cl)cn1	1
C[C@@H](NC(=O)CN1C(=O)c2ccccc2S1(=O)=O)c1ccccc1	0
NC(=O)c1ccc(NC(=O)Cc2ccc(Br)cc2)cc1	0
C[N+]1(CCO)CCN(c2nc3ccccc3o2)CC1	1
CC(C)CC[N@H+]1CCOc2ccc(CN3CC[NH+](CCO)CC3)cc2C1	2
C[C@](Cc1ccccc1)(NC(=O)C[NH3+])c1ccccc1	1
COc1ccc2c(c1)CN(C(=O)CC[NH+]1CCC(Cc3ccccc3)CC1)CCS2	1
C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)N1CC[NH+](CCO)CC1	2
NC(=O)C(CC[NH+]1CCCCC1)(c1ccccc1)c1ccccc1	1
CCC[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)N3CCc4ccccc4C3)C2)CC1	2
Cc1c(Cl)cccc1NC(=O)CC[NH+]1CCCC1	1
CCOC(=O)Nc1cc2c(c(N)[nH+]1)N=C(c1ccccc1)[C@H](C)N2	1
O=C1CCCN1CCC[NH+]1CCN(c2ccc(F)cc2)CC1	1
COc1cc2c(cc1OC)CN(c1cc(N)c3cc(OC)c(OC)cc3[nH+]1)CC2	1
CC(C)(C)C(=O)C[N+]12CC[N+](CC(=O)C(C)(C)C)(CC1)CC2	2
Cn1c(-c2cccs2)nc2c1CC[N@H+](C[C@@H](O)C(C)(C)C)C2	1
CC[NH+](CC)Cc1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1	1
CN(C(=O)Cc1cccc2sccc12)[C@@H]1CCCC[C@H]1[NH+]1CCCC1	1
CCOc1cc(C[NH+]2CCN(c3ccccn3)CC2)ccc1O	1
CCn1c[n+](C[C@@H](O)COCc2ccccc2)c2ccccc21	1
C[NH+](C)CCC(=O)Nc1nc(-c2ccc(Cl)cc2)cs1	1
CC(C)C[NH+]1CCN(CC(=O)NC2CC[NH+](C3CC3)CC2)CC1	2
Cc1c(-c2ccccc2)oc2c(C(=O)OCC[NH+]3CCCCC3)cccc2c1=O	1
CN(c1ncnc2ccc(Br)cc12)C1CC[NH+](C)CC1	1
COc1ccccc1CC[NH2+][C@H]1CC(=O)N(c2ccc(C)cc2)C1=O	1
C#C[C@]1(O)CC[C@@H]2[N@H+]3CCc4cc(OC)ccc4[C@@H]3CC[C@]21C	1
CCOC(=O)CSc1nc2c(c(=O)[nH]c(=O)n2C)n1CC	0
C[N@H+]1[C@H]2CC[C@@H]1CC(=NOC(=O)c1ccc(F)cc1)C2	1
C[C@@H](O)C[NH+](Cc1ccccc1Br)C[C@@H](C)O	1
c1ccc2c(c1)nnn2CN1CCCCC1	0
CCc1ccc(C(=O)[C@H](C)C[NH+]2CCCCC2)cc1	1
N#Cc1c(Cl)c(Cl)nc(N2CCC[NH2+]CC2)c1Cl	1
C[NH+]1CCN(c2cc(C(F)(F)F)nc3ccc(F)cc23)CC1	1
COc1ccc(OC)c(Nc2cc(-c3ccccc3)nc(N)n2)c1	0
CCC[C@@H](O)c1ccccc1OCC[NH+](C(C)C)C(C)C	1
Nc1ccc(C[NH+]2CCN(c3ccc4ccccc4n3)CC2)cc1	1
COc1ccc2c(C)cc(N3C[C@@H](C)O[C@H](C)C3)[nH+]c2c1	1
CC[NH+]1CCN(C(=O)CCC2CC[NH+](C[C@@H]3CC=CCC3)CC2)CC1	2
CC1(C[NH2+]Cc2ccccc2OC[C@@H](O)C[NH+]2CCSCC2)COC1	2
[NH3+]CCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1	1
CC[NH+]1CCN(C(=O)c2ccc(NS(=O)(=O)c3c(C)c(C)cc(C)c3C)cc2)CC1	1
CCOC(=O)c1c(NC(=O)C[NH2+]C(C)C)sc2c1CCCC2	1
CCOC(=O)c1oc2ccccc2c1NC(=O)CC[NH+](CC)CC	1
c1ccc(-c2csc3ncnc(N4CC[NH2+]CC4)c23)cc1	1
O=S(=O)(c1cccc2cnccc12)N1CCC[NH2+]CC1	1
Cc1c[nH+]ccc1NCCNC(=O)C[C@@H]1C(=O)NCC[N@@H+]1CC(C)(C)C	2
C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)[NH+]1CCC(C(N)=O)CC1	2
Cc1cc(NC(=O)c2nc3ncccn3n2)no1	0
COc1cc(C)c(CN2CCC([NH+]3CCCCC3)CC2)cc1C	1
CC(=O)Nc1ccc(-c2c[n+]3c4ccccc4ccc3n2C)cc1	1
CCOC1CC[NH+](Cc2cc3n(n2)CCCN(C(=O)[C@@H]2CC[NH2+]2)C3)CC1	2
CCc1ccc(NC(=O)NCC[N@H+]2CCc3ccccc3C2)cc1	1
CCOC(=O)c1cc(C#N)c(C)nc1N1CC[NH2+]CC1	1
CC(NNc1[nH+]ncc2ccccc12)=C1C(=O)CC(C)(C)CC1=O	1
Nc1nc(N)c2c(OCc3ccc(C(F)(F)F)cc3)cccc2[nH+]1	1
Cc1cc(C)c2cc(C(=O)N(C)C3CC[NH+](C)CC3)[nH]c2c1	1
C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](CC(=O)N2CCOCC2)CC1	2
C[NH+]1CCN(C(=O)CCNC(=O)N2CCN(c3cc[nH+]cc3)CC2)CC1	2
COc1ccc(C(=S)N2CC[NH+](C)CC2)cc1Br	1
CCC[N@@H+](CCO)Cc1cc(Br)ccc1OC	1
O=C(Nc1ccc(Cl)cc1)N1CCC[N@@H+](Cc2ccccc2)CC1	1
CC[NH+]1CCN(c2ncnc3sc4c(c23)CCC4)CC1	1
CN(C(=O)NCCN1CCOCC1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1	1
C[NH+]1CCN(c2ccc(NC(=O)c3cccnc3Cl)cc2)CC1	1
C[NH+]1CCN(C[C@H]2C[C@@H](C(=O)N3CCCC3)C[N@@H+](Cc3ccc(O)cc3)C2)CC1	2
CC1(C)CC(Nc2noc(-c3ccccc3)n2)CC(C)(C)[NH2+]1	1
CCc1nc(C)nc(N2CCN(C(=O)c3ccccc3Cl)CC2)c1Cc1ccc(C)cc1	0
Cc1cc(C)c(C[N@H+]2C[C@H](O)[C@@H](N3CC[NH+](C)CC3)C2)c(C)c1CO	2
CC12CN3CC[N@@H+](CC(C3)/C1=N/N=C/c1ccc([N+](=O)[O-])cc1)C2	1
Cc1nnsc1C(=O)NC1CC[NH+](Cc2ccccc2)CC1	1
Cc1ccc(N2C(=O)C[C@H]([NH2+]CCc3ccc(F)cc3)C2=O)cc1	1
COc1ccc(N2C(=O)C[C@H]([NH2+]Cc3ccncc3)C2=O)cc1	1
O=C(C[NH+]1CCCCC1)NN1CC(=O)N(c2ccc(F)cc2)CC1=O	1
[NH3+]C[C@@]1(C(=O)NCCC[NH+]2CCN(c3cc[nH+]cc3)CC2)CCCOC1	3
CC(=O)O[C@@]1(c2ccccc2)C[C@H](C(C)(C)C)C[N@H+](C(C)(C)C)C1	1
O=c1oc2ccccc2c(N2CCCC2)c1C[NH+]1CCCC1	1
O=C1CC[N@@H+](CC(=O)NCc2ccc(C[NH+]3CCCC3)cc2)CCN1	2
CCC(=O)NC(=S)Nc1ccc(N2CC[NH+](C)CC2)cc1	1
C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](CCN2CC[NH2+]CC2)CC1	3
Cc1ccc(NCN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)[nH+]c1	1
C[NH+](C)CCNc1ncnc2ccc(Br)cc12	1
CNC(=[NH+]C)c1cccc(NC(=O)c2ccc(C(=O)Nc3cccc(/C(NC)=[NH+]/C)c3)cc2)c1	2
CCOC(=O)N1CCC([NH2+]Cc2cccc(C(F)(F)F)c2)CC1	1
Oc1ccc(C[C@@H]2[NH2+]CCc3cc(O)c(O)cc32)cc1	1
CC1(C)CC(NCc2cccc([N+](=O)[O-])c2)CC(C)(C)[NH2+]1	1
CCN1CCN(C(=O)[C@@H](C)[NH+]2CCC(C[NH+]3CCOCC3)CC2)CC1	2
CC[NH+](CC)CCNc1ncnc2sc3c(c12)CCCC3	1
COc1nnnn1-c1ccccc1	0
Nc1c(-c2nnnn2-c2ccccc2)c[nH+]c2ccccc12	1
Cc1ccc(S(=O)(=O)N2CC[NH+](C[C@@H]3C[C@H]4C=C[C@@H]3C4)CC2)cc1	1
C[NH+](C)Cc1cc(C[NH+](C)C)c(O)c(-c2ccccc2)n1	2
CC1CCC([NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1	1
N=C(NC(N)=[NH2+])Nc1cc(C(F)(F)F)ccc1Cl	1
C[NH+](C)CC/C=C1/c2ccccc2CS(=O)(=O)c2ccccc21	1
CCOc1cccc(OCC)c2c(C)[n+](C[C@@H]3CCCO3)c(C)c1-2	1
CCOc1cc(C[NH2+]CCC[NH+](C)C)ccc1OCC(=O)NC(C)(C)C	2
O=C(Nc1ccc(Cl)cc1C(=O)c1ccccc1)c1ccco1	0
COc1cc([C@H](C)[NH2+]C2CCC(O)CC2)cc(OC)c1OC	1
COc1cc(C[NH2+]C2CCC(O)CC2)cc(OC)c1O	1
CCC[N@H+]1CC[C@H]2c3c(cccc3C(N)=O)CC[C@H]21	1
C[C@@H](C[NH+](C)C)Sc1nnc(S[C@@H](C)C[NH+](C)C)s1	2
Fc1ccc(COc2ccccc2C[NH2+]CC2CC[NH2+]CC2)cc1	2
CC(C)C[N@H+]1CCN(c2nc(N(C)C)nc3c2CC[NH2+]C3)C[C@@H]1CCO	2
O=C(NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)[C@@H]1C[N@H+]2CCC[C@@H]2CO1	3
COc1cc2c(cc1OC)C(Nc1cc(C)ccc1C)=[NH+]C(C)(C)C2	1
[NH3+]CCn1cc(C(=O)N2CCC([N@H+]3CCC[C@@H](C(=O)NC4CC4)C3)CC2)nn1	2
COc1ccc(CC[NH2+][C@@H]2C[C@@H](C)[N@@H+](C)C[C@H]2C)cc1OC	2
CC(C)Oc1ccc([C@@](O)(CC[N+](C)(C)C)C2CCCCC2)cc1	1
c1ccc(CN(CC2=[NH+]CCN2)c2ccccc2)cc1	1
O=C(CCN1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1	1
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(CC[NH3+])cc1	1
Cc1ccc([C@@]2(O)CN3CCCSC3=[N+]2Cc2ccccc2)cc1	1
c1cc2c(cc1-c1noc(C3CC[NH2+]CC3)n1)OCO2	1
O=C1C[C@H]([NH2+]C2CCCC2)C(=O)N1c1cccc(C(F)(F)F)c1	1
CC(C)c1[nH+]ccn1CCCNC(=O)c1ccc(N2CC[NH+](C(C)C)CC2)nc1	2
O[C@@H](C[NH2+]C[C@H]1CCCO1)Cn1c2ccccc2c2ccccc21	1
CC1(C)NC(=[NH2+])NC(=N)N1c1ccccc1C(F)(F)F	1
CC(C)[C@](O)(C(=O)OC[C@@H]1CC[N@H+]2CCC[C@@H]12)[C@H](C)O	1
CC(=O)c1ccc2c(c1)N(CCC[NH+]1CCC(CCO)CC1)c1ccccc1S2	1
CC[NH+]1CCC([NH2+][C@@H]2CCCc3c2[nH]c2ccc([N+](=O)[O-])cc32)CC1	2
CSc1nn(-c2ccccc2)c(C)[n+]1-c1ccccc1	1
C[NH+](C)CCNc1cc(-c2ccco2)nc2ccccc12	1
O=C(CC[NH+]1CCOCC1)N[C@@H]1CCC[N@@H+](CCc2ccccc2)C1	2
C[C@H]([NH2+][C@H](C)CCc1ccccc1)[C@@H](O)c1ccc(O)cc1	1
CCOC(=O)C[C@@H]1CC2=[N+](CCc3cc(OC)c(OC)cc32)C[C@@H]1CC	1
NC(=O)c1ccn2c1CS[C@H]2c1cccnc1	0
O=C(OC[C@H]1CCC[N@H+]2CCCC[C@H]12)c1cc2ccccc2oc1=O	1
[NH3+]C[C@@H]1CCCN1C(=O)NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1	3
CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)C=C(C)C	2
Cc1ccc(-c2ccc3[nH]cc(CC[NH+](C)C)c3c2)s1	1
CC(C)(C[NH+]1CCCCC1)NS(=O)(=O)c1ccc(Cl)cc1	1
C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)Nc1ccnn1-c1cc[nH+]cc1	3
Cc1c2ccnc(C(=O)NCC[NH+](C)C)c2cc2c3cc(O)ccc3n(C)c12	1
CN1C(=S)SC(C)(C)[C@@H]1[N+](=O)Cc1c(F)cccc1Cl	1
CN(C)Cc1cc(C[NH+](C)C)c(O)c(CCc2ccccc2)n1	1
CCN(CC[NH+](C)C)c1cc(-c2ccccc2)[nH+]c2ccccc12	2
COc1cc(OC)c(C[NH+]2CCCC2)cc1Br	1
C[NH+]1CCN(C(=S)c2ccc(OCc3ccccc3)cc2)CC1	1
O=C(NC(=S)Nc1ccc(C[NH+]2CCCC2)cc1)c1ccco1	1
CN(C)c1cc[nH+]cc1C(=O)Nc1ccc(F)cc1F	1
CC[N@@H+](CCO)Cc1cccn1CC[NH+]1CCOCC1	2
Cc1ccc(C(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2)c(C)c1	1
c1ccc2nc3c(nc2c1)c1ccccc1n3CC[NH+]1CCCCC1	1
C[NH+]1CCN(C(=O)CC2CC[NH+](C[C@@H](O)CN3CCCC3=O)CC2)CC1	2
C[C@H]1C[N@@H+](C)[C@@H](C)C/C1=N/OC(=O)COc1ccc(Cl)cc1	1
CN(Cc1nc(-c2ccccn2)no1)C(=O)[C@@H]1CC2(CC[NH2+]CC2)C[NH2+]1	2
Cc1c(-c2ccccc2)n(C)c(=O)n1C1CC[NH+](Cc2ccccc2)CC1	1
COc1ccc(C[NH2+]C2C3CC4CC(C3)CC2C4)cc1C	1
CCCC1=NN(c2ccc(F)cc2)C(=O)C1=CNCC1CC[NH2+]CC1	1
C[C@@H](C(=O)NCC1(c2ccccc2)CCCC1)[NH+]1CCCC1	1
COc1cc2c(cc1O)C[C@@H]1c3c(cc(O)c(OC)c3-2)CC[N@@H+]1C	1
CN(C)c1ccc(/C=[NH+]/[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	1
CC[NH+](CC)CC(=O)NC1(Cc2ccc(O)cc2)CCCCC1	1
C[C@H]1C[C@H](C)C[NH+](CCC(=O)Nc2ccccc2Cl)C1	1
COc1ccc(S(N)(=O)=O)cc1C(=O)NC[C@H]1CCC[N@H+]1C	1
CCc1nc(C)c(C[N@H+]2CCC[C@H](CCC(=O)N(C)C3CC[NH+](C)CC3)C2)[nH]1	2
COc1nc(N)nc(C(C)C)n1	0
C=CCc1ccccc1OC[C@@H](O)C[NH2+]Cc1ccco1	1
C[NH+](C)CCCN(CCC[NH+](C)C)CC(c1ccccc1)c1ccccc1	2
COc1ccc2n(C)c(-c3cccc(OC(=O)N(C)C)c3)c[n+]2c1	1
CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc([C@@H](O)C[NH2+]C(C)(C)C)c1	1
CCOC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2Br)C1	1
C[C@@H]([NH2+]Cc1cccn1CC[NH+]1CCOCC1)c1ccccc1	2
CCC[C@@H]([NH3+])C(=O)NC1CC[NH+](Cc2ccccc2)CC1	2
C[N@H+](Cc1ccccc1)Cc1cccn1CC[NH+]1CCOCC1	2
CC(=O)c1c(C)[nH]c(C(=O)NCC[N@H+](C)Cc2ccccc2)c1C	1
COc1ccc2cc3[n+](cc2c1OC)CCc1cc(O)c(O)cc1-3	1
O=C(OCC[NH+]1CCCCC1)[C@H]1CC1(c1ccccc1)c1ccccc1	1
O=C(CC[NH+]1Cc2ccccc2C1)c1ccc2c(c1)OCCO2	1
COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2cccc3ccccc23)cc1OC	1
CCn1c(C)[n+](-c2ccccc2)c2ccc(S(=O)(=O)N(C)C)cc21	1
CC(C)[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCc3ccon3)C2)CC1	2
c1ccc(C[N+]23CC[N+](Cc4ccccc4)(CC2)CC3)cc1	2
CCC[N@H+]1CC2(CC[NH+](C)CC2)C[C@@H]1C(=O)NCc1nc(C(N)=O)no1	2
C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C	2
CC[NH+](CC)Cc1cnc2c(C(=O)N3CC[N@@H+](C)[C@@H](CCO)C3)cnn2c1	2
O=C(NC1CC1)c1scc2c1OCCO2	0
C=CCn1c(-c2ccc(OC)cc2)cs/c1=N\N1CC[NH+](C)CC1	1
Cc1ccc2[nH]c3c(c2c1)CN(C(=O)C[NH+]1CCSCC1)CC3	1
CC(=O)c1cc2cccc(OC[C@H](O)C[NH2+]C(C)C)c2o1	1
COc1ccc(-c2nc3cccc(C(N)=O)c3[nH]2)cc1	0
CC[NH+]1CCC2(CC1)Oc1ccccc1[C@H]1CC(c3ccccn3)=NN12	1
[NH3+]CCCCN(CCC[NH3+])C(=O)OCc1ccccc1	2
COC(=O)c1ccc(C[n+]2cc(-c3ccccc3)n3c2CCC3)cc1	1
Cc1cc(O)c2c(=O)c3ccoc3c(OC[C@H](O)C[NH2+]C(C)C)c-2o1	1
[NH3+]CCNC(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)C1	2
CCc1ccc(/C=C2/N=C(c3ccc(NC(C)=O)cc3)OC2=O)cc1	0
COc1ccc([C@@H]2OC[C@@H](C[NH+]3CCCCC3)O2)cc1	1
c1ccc2c(c1)O[C@H](CCC[NH+]1CCCCC1)c1ccccc1S2	1
c1nc(NCN2CCCCC2)c2ncn(C[NH+]3CCCCC3)c2n1	1
CC(=NNC1=[NH+]CCN1)c1ccc(Br)cc1	1
Clc1ccc(COc2ccccc2C[NH2+]Cc2cccnc2)cc1	1
CC(=O)Nc1ccc(N2C(=O)C[C@@H]([N@H+]3CCC[C@H](C)C3)C2=O)cc1	1
CC[NH+](CC)CCn1c(N)[n+](CC(=O)c2ccc(Br)cc2)c2ccccc21	2
CC(C)NC(=O)C1CC[NH+](C2CCN(C(=O)[C@@H]3CCCC[N@H+]3C)CC2)CC1	2
Cc1cc(NC(=O)CC[NH+]2CCN(c3ccc(Cl)cc3)CC2)no1	1
O=C(C[N@H+]1CCC[C@@H](c2nnc3n2CC[NH2+]CC3)C1)N1CCCCC1	2
O=c1c(-[n+]2ccccc2)cc2[nH]c3ccccc3c2n1-c1ccccc1	1
C[NH+](C)CCCN1C[C@@H](COc2ccccc2)O[C@@H]1c1ccccc1	1
Cc1cccc(C[N@@H+]2C[C@@H](Sc3ccc(F)cc3)C[C@H]2C(=O)NCC[NH+](C)C)c1	2
C[NH+]1CCC(CNC(=O)Nc2csc3ccccc23)CC1	1
CC(C)Oc1ccc(Cc2ccc(NC3=[NH+]CCN3)cc2)cc1	1
CC(C)(CO)[NH2+]C[C@@H]1CCC[C@@H](C[NH2+]C(C)(C)CO)C1	2
CCOC(=O)[C@]1(c2ccccc2)CCC[N@@H+](C)CC1	1
CC1(C)CC(Nc2ncnc3sc4c(c23)CCCC4)CC(C)(C)[NH2+]1	1
Cn1c(=O)[nH]c(=O)c2c1nc(N1CC[NH2+]CC1)n2Cc1ccccc1	1
O=C1c2cccc3c2[C@@H](CCC3)CN1[C@H]1C[NH+]2CCC1CC2	1
Cc1cc(N)c(=O)n(-c2ccccc2)n1	0
CNC(=O)[C@@H]1C[C@@H](n2cc(-c3ccc(C[N@H+]4CC[C@@H](O)C4)cc3)nn2)C[NH2+]1	2
CC[N@@H+](CCO)Cc1csc2c(Br)cccc12	1
CC[NH+](CC)C[C@@H](O)Cn1c2ccc(Br)cc2c2cc(Br)ccc21	1
O=S(=O)(CC[NH2+]C1CCCCC1)c1ccc(Cl)cc1	1
NC(=O)C[NH+]1CCC(n2cc(-c3cccc(O)c3)c3c(N)ncnc32)CC1	1
C[NH+](C)CCCN1C(=O)N(CCc2ccccc2)C2(CC[NH+](C)CC2)C1=O	2
Clc1ccc2nc(CSc3nc4ccccn4n3)cn2c1	0
C[N@H+](Cc1ccncc1)CC1CC[NH+](CCc2ccc(F)cc2)CC1	2
Cc1ccc([C@H]2C3=C([NH+]=C4N=CNN42)c2ccccc2O[C@@H]3c2cccs2)cc1	1
[NH3+]C1(CNC(=O)C(=O)NCCC[NH+]2CCN(c3cc[nH+]cc3)CC2)CCC1	3
Fc1ccc([C@H](OCC[NH+]2CCCC2)c2ccc(Br)cc2)cc1	1
[NH3+][C@@H](CCc1ccccc1)c1ccc2c(c1)OCCO2	1
O=c1oc2ncccc2n1CCC[NH+]1CCN(c2ccccc2)CC1	1
C[N@H+](Cc1ccccc1-c1nc(C[NH3+])cc(=O)[nH]1)C[C@@H]1COCCO1	2
Cc1ccccc1NC(=[NH2+])Nc1nc(C(F)(F)F)cc(=O)[nH]1	1
C[C@H]([C@H](O)c1ccc(O)cc1)[NH+]1CCC(Cc2ccccc2)CC1	1
Cn1nc(-c2ccc(CNC(=O)C[NH+]3CCCCC3)cc2)cc1C[NH+](C)C	2
CC(C)n1c(=O)n(C(=O)NC2C[C@@H]3CC[C@H](C2)[N@H+]3C)c2ccccc21	1
CCc1nc(C)nc(N2CCN(C(=O)C3CCCC3)CC2)c1Cc1ccc(Cl)cc1	0
C[N@@H+](Cc1cc(Br)cc(Br)c1N)C1CCCCC1	1
CC[N+]1(Cc2cc(CCC(=O)OC)ccc2OC)CCCCC1	1
C=C(C)C[N@H+](C)Cc1cc(OC)ccc1OC[C@@H](O)C[NH+]1CCC(O)CC1	2
O=C1C[C@@H]([NH2+]C[C@@H](O)c2ccccc2)C(=O)N1c1ccc(Cl)cc1	1
O=C(c1cccc(F)c1)N1CC[NH+](C[C@H]2C[C@@H]3C=C[C@H]2C3)CC1	1
CC1(C)CC(N2C(=O)OC(C)(C)[C@@]2(C)O)CC(C)(C)[NH2+]1	1
COc1cc(C[NH2+]Cc2cc(F)ccc2F)cc(OC)c1OC	1
CC[NH+](CC)CCOC(=O)[C@@H](C[NH2+]Cc1ccccc1)c1ccccc1	2
Cc1cccc(C)c1OC[C@@H](O)C[N@H+]1CCc2ccccc2C1	1
CCOc1ccc(CSC2=[NH+]CCN2)cc1[N+](=O)[O-]	1
O[C@@H](C[NH2+]Cc1ccccc1C(F)(F)F)C(F)(F)F	1
C[NH+](C)CCn1cccc1[C@@H]([NH3+])c1ccc(Br)cc1	2
COc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c(OC)c1	1
N#CC1(NC(=O)C[NH+]2CCC(C[NH+]3CCOCC3)CC2)CCCCC1	2
CC[C@@H]1CCCC[N@H+]1[C@@H]1CC(=O)N(c2ccccc2)C1=O	1
O=C(NCC(=O)N1CCC([NH+]2CCCCC2)CC1)C1CCCCC1	1
O=C(Cn1c(=O)sc2ccc(Cl)cc21)N1CCC(O)CC1	0
O=[N+]([O-])c1ccc(N2CC[NH2+]CC2)cc1NCCC[NH+]1CCOCC1	2
NC(=O)C[C@@H]([NH3+])C(=O)Nc1ccc2ccccc2c1	1
Cn1c(=O)c2c(nc(SCC[NH+]3CCCCC3)n2Cc2ccc(Cl)cc2)n(C)c1=O	1
O=C(Cc1ccccc1)Nc1c2c([nH+]c3c1CCC3)CCCC2	1
C[NH+]1CCN(Cc2ccc(C(=O)N[C@@H]3CC[N@H+](C4CC4)C3)cc2)CC1	2
O[C@@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)COc1ccc(OC(F)(F)F)cc1	2
CC[NH+](CC)c1ccc(-n2cc3c(=O)n(C)c(=O)n(C)c3c2)cc1	1
NC(=O)C[NH+]1CCC(NC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)CC1	2
O=[N+]([O-])c1cccc(CN2CCN(Cc3ccccc3F)CC2)c1	0
O=S(=O)(c1ccccc1)N1C[C@H](O)[C@@H]([NH+]2CCC(C[NH+]3CCOCC3)CC2)C1	2
CC1CC[NH+](CC(=O)NCCn2nc([C@@H]3CC[NH2+]C3)c3cccnc32)CC1	2
Cc1[nH]c2ccc(I)cc2c1CC[NH3+]	1
O=C(CCC1CC[NH+](Cc2ccccc2)CC1)c1ccc2c(c1)NCCCC2	1
O=C(NCC[NH+]1CCCC1)c1n[nH]c(=O)c2ccccc12	1
Cc1ccc(OCc2nc(N)nc(N(C)C)n2)cc1C	0
C[n+]1cccc([C@@H]2CCCCN2C(=O)c2ccccc2)c1	1
CCn1c(C)[n+](C[C@@H](O)COc2ccccc2)c2ccccc21	1
C[NH+]1CCN(C(=O)CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2N2CCOCC2)CC1	2
COc1ccc(-c2c[n+]3cn(Cc4ccccc4)c(C)c3c(=O)[nH]2)cc1	1
C[NH+]1CCN(c2cc(-c3cccnc3)nc3ccccc23)CC1	1
O=C(CCC[NH+]1CCN(c2ccc(F)cc2)CC1)N[C@@H]1c2ccccc2CSc2ccccc21	1
COc1ccccc1C[NH+]1CCC(C(=O)NC(C)(C)C)CC1	1
COc1cc2c(cc1OC)-c1cc(OCC[NH+](C)C)nc(=O)n1CC2	1
COc1cccc(C[NH2+]Cc2ccc3c(c2)OCO3)c1OC	1
CN(Cc1ccccc1)C(=O)[C@@H]1CCCc2nc[nH]c21	0
C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CC[N@H+]2CCC[C@@H]2C1	3
CCOc1ccc(N2C(=O)C[C@@H](Nc3ccc([NH+]4CCCCC4)cc3)C2=O)cc1	1
CC[NH+](CC)CCn1c2ccccc2n2c(C(C)=O)c(-c3ccc(Br)cc3)nc12	1
COc1ccc([C@@H]2Sc3cc(Cl)ccc3N(CC[NH+](C)C)C(=O)[C@@H]2OC(C)=O)cc1	1
C[NH+](CC(O)C[N@H+](C)C1CCCCC1)C1CCCCC1	2
C[NH+](C)CC[C@@](O)(c1ccccc1)[C@@](O)(CC[NH+](C)C)c1ccccc1	2
CCOC(=O)N1CC[NH+](CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1	1
O=[N+]([O-])N=C1NCN(C2CC[NH+](Cc3ccccc3)CC2)CN1	1
Cc1ccc(-c2nc([N+](=O)[O-])n[nH]2)cc1	0
N#Cc1ccc(C(=O)CC2CC[NH+](CC3CC3)CC2)cc1	1
CC1(C)NC(=[NH2+])NC(=N)N1c1ccc(Br)cc1	1
COc1ccc([C@@H]2NC(=[NH2+])NC(=N)N2c2ccc(C)cc2)cc1	1
CC[NH+](CC)CCNC(=O)N(C)C1CC[NH+](C2CCOCC2)CC1	2
C[NH+](C)CCN(Cc1ccc(Cl)s1)c1ccccn1	1
COc1ccc(CCc2nc(C)cc(C[NH+](C)C)c2O)cc1OC	1
C[NH+]1CCN(c2nc(Nc3ccc(O)cc3)nc3ccccc23)CC1	1
C[NH+]1CCN(CCNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2C2CC[NH2+]CC2)CC1	2
NC(=O)C1([NH+]2CCCCC2)CCN(c2nc(CC[NH3+])nc3ccccc23)CC1	2
COc1ccc(C)cc1NC(=O)CC[NH+]1CCCCC1	1
Cn1c([C@](O)(CC[NH+](C)C)c2ccccc2)nc2ccccc21	1
CC1CC[NH+](C[C@@H](O)COCc2ccc(Cl)cc2)CC1	1
C[NH+]1CCN(C[C@@]2(O)CC[N@@H+](Cc3ccc(OCC(=O)N4CCOCC4)cc3)C2)CC1	2
COc1ccc2c(c1)CC[N@@H+]1C[C@H]3CCCN(S(C)(=O)=O)[C@H]3C[C@@H]21	1
C[C@@H](C[N@@H+](C)Cc1ccccc1)OC(=O)c1ccc(Br)cc1	1
NC(=[NH2+])c1ccc(-c2ccc(-c3ccc(C(N)=[NH2+])cc3)o2)cc1	2
CC(=O)c1ccc(N2CCN(C(=O)c3cccnc3)CC2)cc1	0
O=C(Nc1cccc(Cl)c1)C12CC[NH+](CC1)Cc1ccccc12	1
O=C1CCCN1C[C@@H](O)CS(=O)(=O)c1ccccc1	0
NNc1nc(Nc2cccc3ccccc23)nc(NN)[nH+]1	1
CCN(CC)c1ccc(/C=[NH+]/NC(=S)Nc2ccc(C)cc2)cc1	1
CC[NH+](CC)CCN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21	1
Nc1cc(Cl)cc2nc(Cc3nc4ccccc4[nH]3)[nH]c12	0
CC[NH+]1CCN(c2c(Cl)cccc2NC(=O)c2ccc(C#N)cc2F)CC1	1
COc1ccc(C(=O)OC[C@@H]2CCC[N+]3(C)CCCC[C@@H]23)cc1	1
COc1ccc2nc3n(c2c1)SCc1c(C)c(OC)c(C)c[n+]1-3	1
Cc1ccc(-c2c[n+]3ccccc3n2-c2ccc(Br)cc2)cc1	1
CC(=O)Oc1c(C)cc(OC[C@@H](O)C[NH2+]C(C)C)c(C)c1C	1
COc1ccc(N(C[C@@H](O)C[NH+]2CCC(C)CC2)S(=O)(=O)c2ccc(C)cc2)cc1	1
OCC[NH+]1CCN(CC/C=C2/c3ccccc3Sc3ccc(Cl)cc32)CC1	1
O=c1oc2ccccc2c2c1ncn2CC[NH+]1CCCC1	1
CC(C)COc1ccc(C(=O)OCC[N+]2(C)CCOCC2)cc1	1
C[NH+](C)Cc1cc(-c2ccccc2F)nn1CCNC(=O)C[NH+]1CCCC1	2
COC(=O)C1[C@@H](c2c[nH]c3ccccc23)[C@@H](C(=O)OC)O[N+]1=O	1
c1ccc(C[NH+]2CCOCC[NH+](Cc3ccccc3)CCOCC2)cc1	2
CN(C(=O)[C@@H]([NH3+])c1ccccc1)[C@H]1CCCC[C@@H]1[NH+]1CCCC1	2
O[C@H](C[NH2+]C1CC1)Cn1c2ccccc2c2ccccc21	1
COc1cc(C[C@@H](C)[NH3+])c(OC)cc1Br	1
COC[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1	2
CC(=O)OCC[N@@H+](Cc1ccccc1)Cc1ccc2c(c1)OCO2	1
COC(=O)c1ccc2c(c1)N(CC(N)=O)C(=O)CS2	0
c1ccc(-c2nc(-n3ccnc3)nc(-n3ccnc3)n2)cc1	0
C/C(=C/c1ccccc1)C[N@H+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	1
O=C1c2ccccc2C(=O)N1OCC[n+]1ccc2ccccc2c1	1
C[NH+]1CCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1	1
C[NH+](C)Cc1ccc([C@@H]2CC[C@@H](c3ccc(C[NH+](C)C)[nH]3)N2C(=O)C(F)(F)F)[nH]1	2
C[NH+]1CCC(OC(=O)COc2ccc(Cl)cc2Cl)CC1	1
NC(=[NH2+])NCCC[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)C(=O)c1nc2ccccc2s1	2
[NH3+]CCO[C@H]1C[C@@H](O)C12CCN(C(=O)C[N@H+]1CCc3ccccc3C1)CC2	2
NC(=[NH2+])c1cccc(N[C@H](C(=O)Nc2ccc(N3CCCCC3=O)cc2)c2ccccc2)c1	1
CS(=O)(=O)Nc1ccc2c(c1)C(=O)CC1(CC[NH+]([C@H]3CCc4cc(C#N)ccc4C3)CC1)O2	1
CN(C)c1ccc(/C=C/C[N@@H+](CCO)Cc2ccccc2)cc1	1
C[C@@H](O)c1nc2cc([N+](=O)[O-])ccc2n1C	0
C=C1[NH2+]C(=C)C(C(=O)OC)C(c2cc(OC)c(OC)cc2OC)C1C(=O)OC	1
C[NH+](C)CCNC(=O)c1cc(-c2ccccc2)nc2ccccc12	1
Cc1ccc([C@@H](Nc2cc(C)cc[nH+]2)c2c(C)[nH]c3ccccc23)cc1	1
CC[NH+](CC)CCn1c(=O)c2ccccc2n(CC[NH+](CC)CC)c1=O	2
C[C@@H]([NH2+]CC1OCc2ccccc2CO1)c1ccccc1	1
OC1(c2ccc(Br)cc2)CC[NH+]([C@@H]2CCSC2)CC1	1
CC(C)Oc1ccc(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](C)C[C@H]2C)cc1	2
CC(=O)c1cc(C2CCCCC2)ccc1OC[C@@H](O)C[NH2+]C(C)(C)C	1
C[NH+](C)CCSc1nc2ccccc2c(=O)n1-c1ccccc1	1
NC(=[NH2+])c1ccc(NCCNc2ccc(C(N)=[NH2+])cc2)cc1	2
COc1ccc([C@@H]2[NH2+]CC[C@]3(O)CCCC[C@H]23)c(OC)c1	1
c1ccc2c(c1)CC[C@H](C[NH2+]CCCNC1=[NH+]CCCN1)O2	2
CNc1cc(OC)c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)cc1Cl	1
c1ccc2c(c1)OC[C@@H](C[NH2+]Cc1ccc(-n3ccnc3)cc1)O2	1
CC(C)c1ccc2[nH]cc(CC[NH+]3CCCC3)c2c1	1
Cn1ncc(NC(=O)c2ccccc2)c1C(N)=O	0
c1ccc(-c2nn(-c3ccccc3)[n+](-c3ccccc3)n2)cc1	1
Cc1ccccc1[N+]1=C2CCCCN2[C@@](O)(c2ccc(F)cc2)C1	1
CC[N@@H+](CCO)CC1CC[NH+](CCc2ccccc2C)CC1	2
CC(=O)CC(=O)N(CCC[N+](C)(C)C)CCC[N+](C)(C)C	2
O[C@@]1(c2ccc(F)cc2)CN(c2ccccc2)C2=[N+]1CCCCC2	1
C[N+]1(CCS(=O)(=O)C[N+]2(C)CCCCC2)CCCCC1	2
COc1c2c(cc3c1[C@@H](C#CC[NH+]1CCCC1)N(C)CC3)OCO2	1
N#Cc1c(SCC[NH+]2CCCC2)nc2c(c1C(F)(F)F)CCCC2	1
C[NH+](C)CCCNC(=O)c1ccc(C[NH+]2CCCC2)cc1	2
Nc1cc(N)[nH+]c(SCC(=O)N2CCc3ccccc32)n1	1
CC[N@H+]1CC[C@](O)(c2ccc(F)cc2)[C@H](C(=O)c2ccc(F)cc2)C1	1
C[NH+](C)CCn1c(Cn2nnc3ccccc32)nc2ccccc21	1
NC(=O)C1([NH+]2CCCCC2)CCN(C(=O)CN2CC[NH2+]CC2)CC1	2
Cc1ccc(C)c(C2=C(C#N)C(N)=C(C#N)C3=CC[N@H+](C)C[C@H]32)c1	1
CCc1nc(C)ccc1OCC(=O)N(CC)CC1CC[NH+](C2CC[NH+](C)CC2)CC1	2
C[N@H+]1[C@H]2CC[C@@H]1CC(NC(=O)Nc1ccc(Br)cc1)C2	1
C[N@H+]1[C@H]2CC[C@@H]1CC(NC(=O)Nc1ccc(F)cc1F)C2	1
C[NH+](C)C[C@@H]1CSCC[C@@]1(O)c1ccc(C(F)(F)F)cc1	1
COc1ccc(C[N@@H+](C)Cc2ccncc2C)cc1OC[C@@H](O)C[NH+]1CCCCC1	2
O[C@H](c1cc(C(F)(F)F)nc2c(C(F)(F)F)cccc12)[C@H]1CCCC[NH2+]1	1
CC1(C)[C@H]2CC[C@]1(C)c1nc(SCC[NH+]3CCCCC3)nnc12	1
C[N@H+]1CCc2c(sc3c2C(=O)N[C@@H](c2ccccc2[N+](=O)[O-])N3)C1	1
CCOC(=O)C1CC[NH+](CCC(=O)c2ccc(OCC)cc2)CC1	1
OCC[C@@H]1CCCC[N@H+]1Cc1ccc(C(F)(F)F)cc1	1
CC[NH+](CC)CCOC(=O)c1ccc(NC(=O)C[NH+](CC)CC)cc1	2
COC(=O)CC[C@@H]([NH3+])C(=O)NCC1([NH3+])CC[NH+](Cc2ccccc2)CC1	3
CC(=O)c1sc2nsc(SCC[NH+]3CCCCC3)c2c1N	1
CCOC(=O)c1cc(CC)sc1NC(=O)CC[NH2+]C(C)(C)C	1
CC(C)[NH+](CC[C@H](c1ccccc1)c1cc(CO)ccc1O)C(C)C	1
COc1ccc(/C=[NH+]/CC[C@@]2(O)C[C@@H](C)[N@@H+](C)C[C@@H]2C)cc1	2
CN(CC1CC[NH+](C)CC1)C(=O)C(=O)Nc1ccn(-c2cc[nH+]cc2)n1	2
OC1CC[NH+](Cc2ccc(OCCC[NH+]3CCCCC3)cc2)CC1	2
C[NH+]1CCN(C(=O)c2ccc(C#Cc3ccccc3)cc2)CC1	1
Nc1c[nH+]ccc1NCC[NH+]1CCN(c2ccccc2)CC1	2
CC1CC[NH+](C[C@@H](O)CNC(=O)NC[C@@H](C(C)C)[NH+]2CCOCC2)CC1	2
COc1cc2c3c(c4ccc(OC)c(OC)c4c2cc1OC)C[N@@H+]1CCC[C@H]1C3	1
C[C@@H](C(=O)N1CCC(c2ncc3c(n2)CC[NH2+]C3)CC1)[NH+]1CCCCC1	2
O=C1CC[C@@H](CC[NH2+]Cc2ccc(F)cc2)N1CCC[NH+]1CCOCC1	2
C[NH2+]Cc1cn(C[C@@H]2CCCN(C(=O)C[NH+]3CCC(C)CC3)C2)nn1	2
O=C(C[NH2+]Cc1ccco1)Nc1cccc(C(F)(F)F)c1	1
C[NH+]1CCN(C[C@@H]2C[N@@H+](Cc3cccc(N4CCOCC4)c3)C[C@@H]2CO)CC1	2
Cc1ccccc1C[NH+]1CCC([NH+]2CCC(C(=O)NC[C@@H](C)O)CC2)CC1	2
Cc1ccc2c(c1)c1c3n2CC[N@H+](C[C@H](C)O)[C@H]3CCC1	1
CN(C)c1ccc(/C=[NH+]/C[C@H](O)CSc2nc3c(cc2C#N)CCCC3)cc1	1
C[C@@H](CS(=O)(=O)c1ccccc1)[NH+]1CCCCC1	1
CN(C1CC[NH+](C)CC1)S(=O)(=O)c1ccc(F)cc1	1
[NH2+]=C1c2ccccc2CN1CC(=O)c1ccc2c(c1)OCCO2	1
CCOC(=O)c1c(N)sc2c1CC(C)(C)[NH2+]C2(C)C	1
Cc1cc(=O)oc2cc(NC(=O)[C@H](CCCNC(N)=[NH2+])NC(=O)[C@H](C)[NH3+])ccc12	2
Cc1cc(C(=O)NC2C[C@@H]3CC[C@H](C2)[N@H+]3C)n2ccccc12	1
O=C(NCCC[NH+]1CCCCC1)C(=O)NCCC[NH+]1CCCCC1	2
COc1ccc(C[NH+]2CCN(c3ccccc3F)CC2)cc1	1
COc1cc(Cc2c[nH+]c(N)nc2N)ccc1OCc1ccccc1	1
O=C(CN1CC[n+]2c(-c3cccs3)csc21)c1ccccc1	1
CCC[NH+]1CCC(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)CC1	1
CC[C@@H](C)NC(=O)C1CC[NH+](Cc2ccc(OC)cc2)CC1	1
O=C(C[NH+]1CCCCCC1)N1CCN(c2ccccc2)CC1	1
CC[NH+]=C(NCCOCCNC(=[NH+]CC)SC)SC	2
CC(=O)N1CCC([NH+]2CCN(c3cccc(Cl)c3)CC2)CC1	1
CC[N@H+]1CCC[C@@H](NC(=O)c2scc3c2CCCC3)C1	1
N#CC1C(=O)NC(=S)[C@@H](C(N)=O)C12CCCCC2	0
C[NH+](C)C(C)(C)C#CCCCCC#CC(C)(C)[NH+](C)C	2
CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)CCN1Cc2ccccc2C1=O	2
O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCCC3)n2)c1	1
O=C(OC1CC[NH+](CCO)CC1)C(c1ccccc1)c1ccccc1	1
Cn1c(SCC[NH+]2CCCCC2)nnc1-c1ccccc1	1
O=S1(=O)C=C(SCC[NH+]2CCCCC2)c2ccccc21	1
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)C2(CC[NH+](C)CC2)N1	1
C[n+]1ccccc1/C=C1\Sc2ccccc2N1CCO	1
CC[N@H+]1CCC[C@H](CNC(=O)CN2CC[NH+](Cc3ccccc3)CC2)C1	2
CCOC(=O)C1=C(C[NH+](CC)CC)N(C)C(=O)N[C@@H]1c1ccccc1	1
Fc1ccccc1COc1cccc(C[NH2+]CC2CC[NH2+]CC2)c1	2
CC(=O)O[C@@H]1[C@H]([NH+]2CCCCC2)c2c(ccc(/C=C/C(=O)N3CCCCC3)c2O)OC1(C)C	1
O=C1N(Cc2ccc(F)cc2)CCC[C@@]1(O)C[NH+]1CCC([NH+]2CCCC2)CC1	2
c1ccc(C[NH+]2CCC3(CCc4ccccc43)CC2)nc1	1
C[C@]12CCC[C@@]3(CO3)[C@@H]1C[C@@H]1[C@@H](C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)C(=O)O[C@@H]1C2	2
CC(C)C[NH+]1CCn2nc(CNC(=O)C[C@@H]3C[N@@H+](C)CCN3C)cc2C1	2
Cc1cc(C(F)(F)F)n2ncnc2n1	0
CC[NH+](CC)CCn1cnc2cc([N-]S(=O)(=O)c3ccc(F)cc3)ccc21	0
COc1cccc(C[N@H+]2CCC[C@@H](C(=O)N3CC[NH+](C)CC3)C2)c1	2
O=CN1CCC[C@@H]2[C@@H]3CC[C@@H]([C@H]4c5[nH]c6ccccc6c5CC[N@@H+]34)[C@@H]21	1
CC(=O)Oc1cc(C(C)C)c(OCC[NH+](C)C)cc1C	1
O=C(Nc1ccc2c(c1)C(=O)N(CCC1CC[NH+](Cc3ccccc3)CC1)C2=O)c1ccccc1	1
COc1ccc([C@@H]2NC(=[NH2+])Nc3nc4ccccc4n32)c(OC)c1	1
COc1cccc2c1CCC(=O)N2CCC[NH+]1CCN(c2cccc(Cl)c2)CC1	1
O=C1CN2C(=[NH+]c3ccc(Cl)cc3[C@@H]2c2ccccc2)CN1	1
CCOC(=O)Nc1ccc2c(c1)N(C(=O)C[NH3+])c1ccccc1CC2	1
CC[NH+](CC)CCCN1c2ccccc2Sc2ccc(Cl)cc21	1
CC(C)NC(=[NH2+])NC(=N)Nc1ccc(Cl)c(Cl)c1	1
CC1(C)C(c2ccccc2)[N+](=O)[C@@H](c2ccc(F)cc2)N1O	1
CCc1cc(Cl)c(OC)c(C(=O)NC[C@@H]2CCC[N@@H+]2CC)c1O	1
O=C(Nc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1[N+](=O)[O-]	1
O[C@@H](Cc1ccc(Br)cc1)C[NH+]1CCCCC1	1
CCCN(CC[NH+](C)C)C(=O)c1cc(Br)c[nH+]c1NN	2
CC1=CC(=C2C(=O)c3ccccc3C2=O)C=C(C)N1CC[NH+](C)C	1
CC[NH+]1CCN(CC(C)(C)[NH2+]CCC(=O)N2CC[NH+](C)CC2)CC1	3
CCOC(=O)[C@@H]1CCC[N@@H+](Cc2coc3ccc(Cl)cc3c2=O)C1	1
O=C(C[NH2+]C1(CO)CCOCC1)NCc1ccc(C[NH+]2CCCC2)cc1	2
CCC[NH+]1CCC([NH2+]CCc2ccccc2OC)CC1	2
Cc1c[nH+]c2cc(Cl)ccc2c1NCC[NH2+]CCO	2
C[NH+](C)CCNC(=O)c1ccc(OC2CC[NH+](C)CC2)c(Cl)c1	2
CC(=O)Nc1c2sscc-2n(C)c1=O	0
CC(C)NC(=O)[C@H]1C[N@H+]2CC[C@@H]1C[C@@H]2Cn1cc(CN(C)C)nn1	1
Nc1c(NC2CC[NH+](Cc3ccccc3)CC2)c2ccccc2oc1=O	1
CC[NH+]1CCN(c2ncnc3c2cnn3-c2cccc(C)c2)CC1	1
NC(=[NH2+])c1ccc(N2CCN(c3ccc(C(N)=[NH2+])cc3)CC2)cc1	2
COc1ccc([C@@H]([NH3+])CC(=O)[O-])cc1	0
CC1CC[NH+](C2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)CC1	1
O=c1[nH]ncc(N2CC[NH+](Cc3ccccc3)CC2)c1Cl	1
CN1C(=O)C[C@H]([NH+]2CCC(c3nc4ccccc4[nH]3)CC2)C1=O	1
Cc1ccc(CCS(=O)(=O)c2ccc(C(C)C)cc2)c[n+]1C	1
CC(C)[NH2+]C[C@@H](O)c1ccc(NS(C)(=O)=O)cc1	1
C[N+](C)(CCN1C(=O)C2=C(SCCS2)C1=O)Cc1ccccc1	1
Cc1ccccc1N1CC[NH+](CCc2nnc3n2CCCC3)CC1	1
CCC(=O)c1ccc2c(c1)N(C[C@H](C)[NH+](C)C)c1ccccc1S2	1
C[N@H+]1CCC[C@H](OC(=O)[C@@](O)(c2ccccc2)C2CCCCC2)C1	1
NC(=[NH2+])N1CCN(C(=O)c2ccc(Cl)cc2)CC1	1
Cn1ncc2c(-n3ncc(C#N)c3N)ncnc21	0
CCCOc1ccc(N2C(=O)C[C@@H]([NH2+]CC3CC[NH+](Cc4ccc(F)cc4)CC3)C2=O)cc1	2
Cc1ccc([N+](C)(C)CCOCCOCC[N+](C)(C)c2ccc(C)cc2)cc1	2
CCOC(=O)c1c(C[NH+]2CCCC2)oc2ccc(O)cc12	1
C[C@@H]1O[C@@](O)(c2ccc(Cl)cc2)C[N+]12CCCCC2	1
COC(=O)CS(=O)(=O)c1nccn1C	0
CC[NH+](CC)CCNc1ncnc2c1cnn2-c1ccccc1	1
CN(CC[NH+](C)C)C(=O)c1cccc(OC2CC[NH+](C3CCC3)CC2)c1	2
Cc1ccc2ccc([C@H](Nc3cccc(C)[nH+]3)c3ccccn3)c(O)c2n1	1
C[N@H+]1C[C@H](c2ccccc2)[C@H]2CN(C(=O)CN3CC[NH+](CCO)CC3)CC[C@H]21	2
C(=[NH+]NC1=NCCCCC1)c1ccc(N2CCOCC2)cc1	1
OCC[NH+](CCO)C[C@@H](O)Cn1c2ccc(Cl)cc2c2cc(Cl)ccc21	1
CC1(C)CC(NC(=O)c2cncc(Br)c2)CC(C)(C)[NH2+]1	1
[NH3+]CC12CC(CN1C(=O)C[C@@]1(C(=O)N3CC4CC3(C[NH3+])C4)CC[NH2+]C1)C2	3
Cc1ccc(S(=O)(=O)N(CCC(=O)N2CC[NH2+]CC2)CC[NH+](C)C)cc1	2
CC(C)(C)c1cccc(-c2nc3ccc(C(N)=[NH2+])cc3[nH]2)c1O	1
O=C(C[C@@H](c1ccccc1O)[NH+]1CCCCC1)N1CCCCC1	1
COc1cc2nc(=S)n(CC[NH+](C)C)c(N)c2cc1OC	1
C[NH+](C)CCC[C@@H]1c2ccccc2Sc2ccc(Cl)cc2[C@H]1O	1
C[NH+](C)CCNc1c2c(c(C#N)c3nc4ccccc4n13)CCC2	1
O=C([C@@H]1CCC[N@@H+](Cc2ccco2)C1)N1CCCCCC1	1
NC(=[NH2+])c1ccc2cc(C(=O)Nc3ccc(C[NH3+])cc3)ccc2c1	2
[NH3+][C@@H](Cc1ccccc1)C(=O)N1CCN(c2ccccc2F)CC1	1
CCC[NH+](CCC)C[C@]1(C)C[N@@H+](C)[C@H](C)C[C@]1(OC(C)=O)c1ccccc1	2
CC1(C)[C@@H]2CC[C@@]1(C)C[N@@H+](C[C@H](O)Cn1c3ccccc3c3ccccc31)C2	1
COc1ccc(OC)c2c(C)cc(N3CCC[N@@H+](C)CC3)nc12	1
C[N@@H+](CCC(=O)N1CC[NH2+]CC1)CC(=O)Nc1ccc(Br)cn1	2
CCOc1ccc(/C=[NH+]/CC2(c3ccccc3)CCCC2)cc1OC	1
CCCC(=O)c1cnc2c([C@H](O)C[NH+](C)C)cccc2c1Nc1ccccc1C	1
CCOC(=O)c1ccc(NC(=O)COc2ccc(OC)cc2)cc1	0
COC(=O)c1ccc(C[N+](C)(C)CN2CCCC2=O)cc1	1
C[NH+](C)CCCN(CCC[NH+](C)C)Cc1cccc(C(F)(F)F)c1	2
CC(C)Nc1[nH+]cnc2c1c(-c1ccccc1)cn2-c1ccccc1	1
C=C1[NH+]=C(SC)N[C@@H](c2ccccc2)C1C(=O)OCC	1
CN(C)c1ccc(/C=[NH+]/NC(=S)N[C@@H]2C[NH+]3CCC2CC3)cc1	2
CC[NH+]1CCC(NC(=O)C[N@H+]2CCC[C@@H]2c2ccccc2)CC1	2
COc1cccc(C(=O)NCc2ccc(C)cc2)c1	0
CC[n+]1ccc(/C=C/c2ccc(OC)cc2OC)cc1	1
CN(/C=C/c1sc2ccc3ccccc3c2[n+]1C)c1ccccc1	1
C[N@H+]1[C@H]2CC[C@@H]1CC(NC(=O)CSc1ccccc1)C2	1
NC(=O)C1CC[NH+](C[C@@H](O)COc2ccc(F)cc2)CC1	1
CCC(=O)OC(C[N+]1(C)CCCCC1)C[N+]1(C)CCCCC1	2
CN(C)C(=O)C(CC[NH+]1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1	1
CCOC(=O)c1cnc2ccc(F)cc2c1NCC[NH+](C)C	1
COc1cc2c(cc1OC)[C@@H](Cc1ccc(O)cc1)[N+](C)(C)CC2	1
CC(=O)CC(C)(C)NC(=O)CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1	2
C[NH+]1CCN(c2ncc(CN3CCC([N@@H+](C)CCCO)CC3)cn2)CC1	2
COc1ccc(N2C[C@@](O)(Cc3ccc(C)cc3)[n+]3ccccc32)cc1	1
COc1ccc(-c2cn3c([n+]2-c2ccc(Cl)cc2)CCCCC3)cc1	1
COC(=O)c1ccc(Nc2cc(C)[nH+]c3ccc(C)cc23)cc1	1
[NH3+]CCNC(=O)c1ccc2c(c1)C(=O)c1cc(C(=O)NCC[NH3+])ccc1C2=O	2
CC[n+]1cc(-c2ccccc2)nc(N2CCOCC2)n1	1
Clc1ccccc1C[NH+]1CCN(c2ccccn2)CC1	1
[NH3+]CCCc1nc2ccc(-c3ccc4nc(CCC[NH3+])[nH]c4c3)cc2[nH]1	2
CC(C)NC(=O)NC[C@H]1C[C@@H]2CCN1C[C@@H]2C[N@@H+](C)CCc1ccccn1	1
Cc1ccc(C(C)C)c(OC(=O)N(C)C)c1C[NH+](C)C	1
Cc1cccc(OCC(=O)Nc2nc3ccccc3n2C)c1C	0
CCOC(=O)C1CC[NH+](CC[C@@H](O)C(F)(F)F)CC1	1
CN1CCN(Cc2ccc3[nH]cc(CC[NH3+])c3c2)S1(=O)=O	1
CC[NH+]1CCN(CCNC(=O)[C@@H](c2ccccc2)N2CC[NH+](C)CC2)CC1	2
CO[C@H]1[C@@H](O)[C@H]([NH3+])[C@@H](O[C@H]2CCC[C@H]([C@H](C)[NH3+])O2)[C@H](O)[C@@H]1N(C)C(=O)C[NH3+]	3
C[NH+]1CCN(CC(=O)NCC2([NH+]3CCSCC3)CCCCC2)CC1	2
CCOC(=O)C1([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@@H](C(N)=O)C2)CC[NH2+]CC1	3
CC1(C)Oc2ccc3ccc(=O)oc3c2[C@@H]([NH+]2CCCCC2)[C@@H]1O	1
COc1ccc(N2CC[NH+](Cc3cccc(C)c3)CC2)cc1	1
CC[NH+]1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1	1
C1=NC2=[NH+]C3=C(CCc4ccccc43)[C@@H](c3cccs3)N2N1	1
CC[NH+]1CCN(c2cc(C)nc(-c3ccccc3O)n2)CC1	1
CC(C)(C)[NH2+]CC(=O)Nc1cc(Cl)cc(Cl)c1	1
COc1ccc(OC)c([C@@H]2c3cc(OC)c(OC)cc3CC[N@@H+]2C)c1	1
O=C(NC1CC[NH+](Cc2ccccc2)CC1)C1CCC1	1
C[C@@H](Oc1c(Cl)cccc1Cl)C1=[NH+]CCN1	1
CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)[C@@H]1COc2c(cccc2OC)C1	2
COc1ccc(Nc2nc(N)nc(C[NH+]3C[C@H](C)C[C@@H](C)C3)n2)cc1	1
CCOc1ccccc1NC(=O)C[C@@H]1[NH2+][C@H]2CCCC[C@H]2NC1=O	1
CC[NH+](CC)CC(=O)Nc1ccc(Br)cc1	1
O=C1c2ccccc2C(=O)N1[C@H]1CCC[N@H+]2CCCC[C@@H]12	1
O=C(CCCC(=O)N[C@H]1CC[N@H+](C2CC2)C1)N[C@H]1CC[NH+](C2CC2)C1	2
Cc1c(-c2ccc(Cl)cc2)n2c([n+]1-c1ccccc1)SCCC2	1
CCc1[nH]c(=O)n(C(=O)C(C)C)c1C(=O)c1ccc(-n2cc[nH+]c2C)cc1	1
CC(C)(C)c1cs[n+](-c2c(Cl)cc(Cl)cc2Cl)n1	1
O=C(OCC[NH+]1CCCCC1)C(O)(c1ccccc1)c1ccccc1	1
COc1ccc(Nc2cc(C)[nH+]c(N3CCOCC3)n2)cc1	1
CCCc1n(C)c2ccccc2[n+]1C[C@@H](O)COc1cccc(C)c1	1
O[C@@H](C[NH2+]C1Cc2ccccc2C1)COc1ccc(F)cc1	1
CC[NH+](CC)CC[C@@H]1SCC(=O)N1Cc1ccccc1[N+](=O)[O-]	1
C[NH+](C)Cc1cccc(NC(=O)C(=O)N2CCC[N@H+](C3CC3)CC2)c1	2
COc1cc(C[NH2+]CC(C)(C)N2CC[NH+](C)CC2)cc2c1OCCO2	2
COC1(C(=O)NCC(=O)N2CC[NH+](Cc3ccccc3)CC2)CC[NH2+]CC1	2
COC(=O)Cc1c(C)c2ccc([O-])c(C[NH+]3CCCCC3)c2oc1=O	0
CC(C)(C)[NH2+]CC(=O)Nc1c2c(nc3c1CCC3)CCC2	1
O=C(CN1CCCC1)Nc1c2c([nH+]c3c1CCC3)CCC2	1
CC[NH+]1CCN(CCCNC(=O)CCC[NH+]2CCC([NH3+])CC2)CC1	3
CC[C@@H](Sc1nc2ccccc2[nH]1)C(=O)Nc1nnc(C)s1	0
C[N+](C)(C)CCNC(=O)c1cc[n+](Cc2ccccc2)c(/C=N/[O-])c1	1
CC[C@H]1C[N@H+]2CC[C@@H]1C[C@@H]2[C@H](O)c1ccnc2ccc(OC)cc12	1
C[N@@H+](CCOC(=O)c1cccs1)Cc1ccccc1	1
Cc1[nH+]ccn1C[C@@H](O)COc1ccc([N+](=O)[O-])cc1	1
c1ccc(N2CC[NH+](CCNc3ncnc4c3CCCC4)CC2)cc1	1
COc1cc2c(cc1OC)C[N@@H+](Cc1ccccc1N)CC2	1
C[NH+](C)CCCOC(=O)[C@@H]1Cc2ccccc2N(CCC[NH+](C)C)c2ccccc21	2
Cc1cc(NC2CCCCC2)nc(N2CCOCC2)[nH+]1	1
Cc1cc(N2CCN(C)CC2)nc(N2CCOCC2)[nH+]1	1
Cc1nnc(CNC(NC[C@@H]2C[NH+]3CCN2CC3)=[NH+]C2CCCCC2)n1C	2
CCC[N@H+]1CCc2c(sc3c2c(NCC[NH+](C)C)nc2nnnn23)C1	2
Cc1ccc(NC(=O)CC[NH+]2CCC(C(N)=O)CC2)cc1	1
C[N+]1(CCOC[C@@H]2CCC[N+]3(C)CCCC[C@H]23)CCCCC1	2
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(C[NH+](CC)CC)c1	1
CSc1cccc(NC2CC[NH+](CCc3ccccc3)CC2)c1	1
CC1(C)CC(CCNC(=O)c2ccco2)CC(C)(C)[NH2+]1	1
COc1ccc(-c2cc(-c3ccccc3)nc(NN)[nH+]2)cc1OC	1
COCC(=O)N(CC[NH+](C)C)C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1	2
Cc1ccc(-c2nc(C#N)c(N3CC[NH+](C)CC3)o2)cc1	1
Cc1nn2c3ccccc3n(C)c2c1C(=O)OCC[NH+](C)C	1
CC(=O)C(=O)N(CC[NH+]1CCCCC1)C[C@@H]1CCC[N@H+](C2CCCC2)C1	2
CC(C)(C)c1cn2c3ccccc3nc2n1CC[NH+]1CCCC1	1
C=CC[n+]1ccc(COC(=O)Nc2cccc(C(F)(F)F)c2)cc1	1
C[N+](C)(C)CCC[n+]1ccc(CCc2c[nH]c3ccccc23)cc1	2
NC(=[NH2+])c1ccc(/N=N/Nc2ccc(C(N)=[NH2+])cc2)cc1	2
C[C@@H]([NH2+]Cc1ccccc1)[C@@H]1COc2ccccc2O1	1
COc1ccccc1N1CC[NH+](CCCN2C(=O)[C@@H]3CCCCN3C2=O)CC1	1
CC[C@H](c1ccccc1)c1noc(CC[NH+](CC)CC)n1	1
c1ccc(-n2ncc3c2ncn2nnnc32)cc1	0
Cc1ccc(-c2n[nH]cc2C[NH2+]CCC[N@H+]2CCC[C@@H](O)C2)cc1C	2
COc1ccc2c(c1)c(C(=O)OCC[NH+](C)C)c(C)n2C	1
C=CCn1c(SCC[NH+]2CCCCC2)nc2c1c(=O)[nH]c(=O)n2C	1
CCC[NH+]1CCC([N@@H+](C)C[C@@H](O)c2ccccc2)CC1	2
CC(=NNC1=[NH+]CCN1Cc1ccccc1)c1ccccc1	1
CC[NH+](CC)C[C@@H](O)CNC1=NS(=O)(=O)c2ccccc21	1
O=C(Cn1nc(-c2ccccc2)ccc1=O)NCC[NH+]1CCCC1	1
Nc1c2c([nH+]c3ccn(Cc4ccccc4)c(=O)c13)CCCC2	1
[NH3+]CCn1cc(C(=O)N[C@@H]2c3ccccc3C3(CC[NH2+]CC3)[C@H]2O)nn1	2
Cc1ccc(N2C(=O)C[C@H]([NH+]3CCCCC3)C2=O)cc1	1
C=CCc1ccccc1OC[C@@H](O)C[NH+]1CCCCC1	1
CN1CC[NH+](CCCOc2ccccc2CN2CC[C@@H]([NH3+])[C@H](O)C2)CC1	2
CN1C[C@H](CC[NH+](C)C)Oc2ncccc2C1=S	1
c1ccc(C[NH+]2CCC(N=Nc3ccc4nncn4n3)CC2)cc1	1
COC(=O)c1ccc(C[n+]2ccc3ccccc3c2)cc1	1
CC(=O)Nc1cc(C(F)(F)F)ccc1N1CC[NH+](C)CC1	1
COc1cc(C)c(C#N)c(OC)n1	0
COc1ccc(CSc2nnnn2-c2cccc3ccccc23)cc1	0
O=C([C@@H]1CCC[NH2+]1)N1CCN(C(c2ccccc2)c2ccccc2)CC1	1
Cc1cncc2cccc(S(=O)(=O)N3CCC[NH2+]C[C@@H]3C)c12	1
CC1(C)C=C(C(=O)NC[C@H](O)C[NH2+]Cc2cccs2)C(C)(C)[NH2+]1	2
CC[C@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1ccccc1c2CC[NH2+]C(C)C	1
CO[C@@H](C[NH+]1CCN(c2cc[nH+]cc2)CC1)c1ccccc1	2
O=C(C[C@@H]1COCC[NH2+]1)N1CC[NH+](CCCOc2ccc(F)cc2)CC1	2
Nc1cc(N)[nH+]c(SCc2ccc(C(=O)N3CCOCC3)cc2)n1	1
CN1c2ccccc2C(=O)N(CC[NH+](C)C)c2ccccc21	1
COc1ccc(CN2CCN(C(=O)C[NH3+])CC2)c(OC)c1OC	1
COc1ccc(C[N@H+]2CCOc3ccc([C@](C)(O)C[NH+](C)C)cc3C2)cc1C	2
CN1CCc2c1nc1ccccc1c2NC(=O)C[NH+]1CCCC1	1
Cc1[nH+]ccn1C[C@@H](O)COc1ccccc1Br	1
Cc1ccc(NC(=O)CC[N@H+]2C[C@@H](C)C[C@@H](C)C2)cc1	1
C[C@@H](CN1C(=O)c2cccnc2Nc2ccccc21)[NH+](C)C	1
C[C@@H](Cc1ccc2c(c1)OCO2)[NH2+]C[C@H](O)c1ccc(O)c(O)c1	1
C[NH+]1CCN(c2ncnc3ccc(Br)cc23)CC1	1
COc1ccc(CC[NH2+]C2CC[NH+](C)CC2)cc1OC	2
C[C@@H](COc1ccccc1)[NH2+][C@@H](CO)[C@H](O)c1ccccc1	1
C[NH+]1CCN(C(=O)c2ccc3[nH]c(-c4cc5ccccc5[nH]c4=O)cc3c2)CC1	1
c1cc(CNCc2ccncc2)ccn1	0
C=CC[C@H]([NH3+])c1ccccc1-c1noc2ccccc12	1
O=S1(=O)CC[C@@H]([NH2+]CCN2CCC([NH2+][C@@H]3CCS(=O)(=O)C3)CC2)C1	2
COc1ccc(C(=O)c2coc3ccc(O)c(C[NH+](C)C)c23)cc1	1
C[NH+]1CCC(C[NH+]2CCN(c3cc(C4CC([NH3+])C4)nc(N)n3)CC2)CC1	3
CC(C)c1c(C[N@@H+](C)[C@@H](C)Cc2ccccc2)n(C)n(-c2ccccc2)c1=O	1
O=c1c2ccccc2ncn1C[C@H](O)C[NH2+]C1CCCCC1	1
CCC[NH+]1CCC([NH2+][C@@H]2CCCc3nc(N(C)C)ncc32)CC1	2
O=C(CC[N@H+]1CCc2ccccc2C1)Nc1ccc2c(c1)OCO2	1
COc1ccc(C2=N[n+]3c(n(C)c4ccccc43)SC2)cc1	1
C[NH+](C)CCN(CC[NH+](C)C)C(=O)NCC1(N2CCOCC2)CC1	2
COC(=O)c1ccc(NSc2ccccc2[N+](=O)[O-])cc1	0
O=C(Nc1cccc(C2=[NH+]CCN2)c1)c1ccc(C(=O)Nc2cccc(C3=[NH+]CCN3)c2)cc1	2
Cn1nc(C(=O)NCC23CCC[NH+]2CCC3)c2ccccc21	1
CCOc1cc(C[NH2+]CCCN2CCOCC2)cc(Cl)c1OCc1ccccc1	1
C[C@@H](NC(=O)C(=O)NCC[NH+](C)C)[C@H](c1cccs1)N1CC[NH+](C)CC1	2
Cc1ccc(C[N+](=O)c2ccc(N(C)C)cc2)c2nsnc12	1
CCOC(=O)[C@@H]1CC2(CC[NH+](Cc3ccccc3)CC2)[N@H+]2CCC[C@H]12	2
C[NH+](C)CCN1C[C@@H](C(=O)NCC[N@H+]2CCc3sccc3C2)CC1=O	2
CCOC(=O)[C@@]1(O)CC(C)=NN1C(=O)c1cccnc1	0
CCOC(=O)N1CCC([NH2+]C2c3ccccc3-c3ccccc32)CC1	1
COC(=O)C1=C(C)NC(C)=C(C(=O)OCc2ccc(C[NH+]3CCCCC3)o2)[C@H]1c1ccccc1F	1
CCOC(=O)c1sc2ncnc(N3CC[NH+](C)CC3)c2c1C	1
CCn1c(C)[n+](CCOC(C)=O)c2cc(Cl)c(Cl)cc21	1
COc1cc2c(cc1OC)[C@H](c1ccccc1)C[N@@H+](C)CC2	1
COc1cccc(-c2[nH+]c3ccc(Cl)cn3c2NC(C)(C)C)c1	1
CSc1cccc(NC(=O)CCSc2ccc(Cl)cc2)c1	0
C[N@H+]1CC[C@@H](COC(=O)C(O)(c2ccccc2)c2ccccc2)C1	1
O=C1C[C@H]([NH+]2CCCCC2)C(=O)N1Cc1ccccc1	1
C[NH+](C)CCNC(=O)c1ccc2c(c1)NC(=O)c1ccccc1S2	1
FC(F)(F)c1cccc(N2CC[NH+](CCc3nnc4n3C[C@@H]3CCC[C@H]43)CC2)c1	1
CCOC(=O)N1CCC([N@@H+](CC)Cc2ccccc2)CC1	1
NS(=O)(=O)c1ccc(-c2ccc(C=O)o2)cc1	0
CC[NH+]1CCC(NC(=O)C[N@H+]2CC[C@@H](N3CC[NH+](C(C)C)CC3)C2)CC1	3
Cc1ccc(NC2=[NH+]C(=N)NC3(CCCCC3)N2)c(C)c1	1
O=C(NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)[C@@H]1C[N@@H+]2CCCN1CC2	3
C[C@@H](C[N@@H+](C)Cc1ccccc1)OC(=O)c1ccc(Cl)cc1Cl	1
CC(C)Oc1ccc(C[N+](C)(C)C)cc1C[N+](C)(C)C	2
Cc1[nH]c2c(C)cccc2c1CC(=O)N(CC[NH+](C)C)C1CC[NH+](C)CC1	2
CCn1c(=O)n(CC)c2cc(S(N)(=O)=O)ccc21	0
CC(C)CCNC1=NS(=O)N=C1Nc1cc(Cl)cc(Cl)c1	0
Cn1c(-c2ccc(I)cc2)c[n+]2ccccc12	1
CCC[N+]1(CC#CC2(O)CCCCC2)CCOCC1	1
CC[N@@H+](CCO)Cc1cc2cc(Br)ccc2s1	1
CCOC(=O)c1c(C)nc2c([C@@H]3CCC[N@H+]3C)cccn12	1
COc1ccc(C[NH+]2CCN(c3ccccc3)CC2)c(OC)c1	1
CN(C)C(=O)COc1ccc2c(c1)C[C@@H]([NH2+]C[C@H](O)c1ccc(O)c(CCO)c1)CC2	1
CC[NH+](CC)CC(=O)N1CCCc2c1c(=O)oc1ccc(O)cc21	1
CC[NH+](CC)CCOC(=O)CC[NH+]1CC2CCC(CC2)C1	2
c1ccc2c(c1)[nH]c1nc(SCC[NH+]3CCCCC3)nnc12	1
COc1ccc(OCC(=O)O[C@@H](C)C[NH+]2CCCCC2)cc1	1
C[C@@H](O)CC[NH+]1CCC(Cc2ccc(F)cc2)CC1	1
COc1cc(C[NH2+]Cc2cc(OC)cc(OC)c2)cc(OC)c1	1
O[C@@H](CN(c1ccccc1)c1ccccc1)C[NH+]1CCCCC1	1
O=C(NCCC[NH+]1CCOCC1)c1cccc(C[NH+]2CCCC2)c1	2
CC[NH+](CC)CC(=O)Nc1cccc(C(F)(F)F)c1	1
CC[n+]1c(-c2c(C)oc3cc(OC(C)=O)ccc3c2=O)csc1C	1
CC(C)C[N@H+]1CCn2nc(CNC(=O)C3CC[NH+](CC(N)=O)CC3)cc2C1	2
C=CC[NH+](CC=C)Cc1cc(O)c(C[NH+](CC=C)CC=C)cc1O	2
C[NH+](C)CCC[C@@](C#N)(CC[NH+](C)C)c1ccccc1	2
CC[N@H+]1CCC[C@@H]1CNC(=O)c1n[nH]c(=O)c2ccccc12	1
CC[NH+]1CCN(CC(=O)N2CCC[C@@H]([N@@H+](C)CCc3ccccn3)C2)CC1	2
S=C(NC1CC1)N1CCC[N@@H+](Cc2cccc3ccccc23)CC1	1
CCc1cn(Cc2ccccc2)c[n+]1Cc1ccccc1	1
CCc1cccc2cc([C@@H](O)C[NH2+]C(C)(C)C)oc12	1
CC[NH+]1CCN(C(=O)CC2CC[NH+](CCCS(N)(=O)=O)CC2)CC1	2
Cc1cc(NC(=O)NN2CCOCC2)no1	0
O=c1[nH]c2ccc(CC[NH+]3CCN(c4cccc(C(F)(F)F)c4)CC3)cc2s1	1
O=C(N/N=C/c1ccco1)C1CC[NH+](Cc2ccc(Cl)cc2)CC1	1
Cc1cc(Nc2cccc(C(F)(F)F)c2)nc(N2CCOCC2)[nH+]1	1
Cc1cccnc1-n1ccnc1[S@](=O)Cc1ccccc1N(C)C	0
O[C@@H](C[NH2+]C[C@@H]1COc2ccccc2O1)c1ccccc1	1
COC(=O)CS(=O)(=O)c1ccc(C(=O)OC)cc1[N+](=O)[O-]	0
O=c1[nH]c2ccccc2n1C1CC[NH+](CCOc2ccccc2)CC1	1
O=C(C[C@@H]1[NH2+]CCCNC1=O)Nc1cc(Cl)ccc1Cl	1
CC[N+](C)(C)Cc1ccc(OCC(C)C)c(C[N+](C)(C)CC)c1	2
C[C@@H](Nc1nc(N2CC[NH2+]CC2)nc2ccccc12)c1ccccc1	1
C[N@H+]1CC2(CC[NH2+]CC2)C[C@@H]1C(=O)NCc1nc(-c2ccccc2)n[nH]1	2
N=C(NC(N)=[NH2+])Nc1cc(Cl)c(Cl)cc1Cl	1
CC1CC[NH+](CC(=O)N2CCN(C(=O)C[NH+]3CCC(C)CC3)CC2)CC1	2
C[NH2+][C@@H](C)Cc1ccc(OCCC[NH+]2CCCCC2)cc1	2
CCn1c[n+](C[C@@H](O)COc2ccc(C(C)=O)cc2)c2ccccc21	1
N=C1NC(=[NH2+])NC2(CCCCC2)N1c1cccc(Cl)c1	1
CCOC(=O)Cc1c(C)nc2c(C#N)c(C)nn2c1C	0
CC(C)[NH2+]C[C@@H](O)COc1cccc(OC[C@H](O)C[NH2+]C(C)C)c1	2
COc1ccc(C(=O)OCC[N@@H+](C)Cc2ccccc2)cc1	1
CC(C)COC(=O)N[C@H]1C[NH2+][C@H](C(=O)N2CCN(c3cc[nH+]cc3)CC2)C1	2
CN(C)C(=O)C[NH+]1CCC(NC(=O)NCC2([NH+](C)C)CCCC2)CC1	2
O=c1[nH]c2ccc(S(=O)(=O)NCC[NH+]3CCCCC3)cc2c2ccccc12	1
O[C@@H](C[NH2+][C@@H]1CN2CCC1CC2)COc1cccc2ccccc12	1
Cc1nc2ccccc2c(=O)n1-c1ncccc1[C@@H]1CCC[N@@H+]1C	1
COc1ccccc1/C=C/C[N@H+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	1
NC(=O)C1([NH+]2CCCCC2)CCN([C@@H]2OC(=O)c3ccccc32)CC1	1
COc1cc(C[NH2+]Cc2ccc(OC)c3ccccc23)cc(OC)c1	1
CC(C)(C)Nc1nc(NC(C)(C)C)[nH+]c(N2CCCCC2)n1	1
CN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H]1c2ccccc2C[C@H]1[NH+]1CCCC1	1
CC[NH+](CC)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	1
CC[N@@H+](C)CCNC(=O)NCc1ccc(C(=O)N2CC[NH+](C)CC2)cc1	2
Cc1cccc(N2CC[NH+](CCC(=O)NC[C@@H]3C[N@H+](C)CCN3C)CC2)c1	2
O=C(C[n+]1ccc(-c2cc[n+](CC(=O)C3CC3)cc2)cc1)C1CC1	2
C(=N/c1ccc(C2=[NH+]CCN2)cc1)\c1ccc(/C=N/c2ccc(C3=[NH+]CCN3)cc2)cc1	2
CO[C@@]12C[C@H](COC(=O)c3cncc(Br)c3)C[N@@H+](C)[C@H]1Cc1cn(C)c3cccc2c13	1
C=CCn1c(=[NH2+])n(CC[NH+]2CCCCC2)c2ccccc21	2
O=C(CC[NH+]1CCCCC1)NCNC(=O)CC[NH+]1CCCCC1	2
C=C(C)CN(CC)C(=O)C1CC[NH+](C[C@@H]2CC=CCC2)CC1	1
CCOC(=O)c1c(C)[nH]c(C)c1-c1ccccc1OC	0
COC(=O)c1cc(C(=O)OC)c(-c2ccccc2)c(-n2ccc[n+]2C)c1	1
O[C@H](COc1ccc(Cl)cc1Cl)C[NH+]1CCC(Cc2ccccc2)CC1	1
[NH3+]CC[NH2+]CCOCCOc1ccc(I)cc1	2
CC(=O)N1C[C@@H]2c3ccccc3CC[N@H+]2[C@H]1c1ccccc1	1
CC(C)C[N@@H+]1CCC[C@H](c2ccnc(SCC[NH+]3CCCC3)n2)C1	2
COCCCNC(=O)C[NH+]1CCC(C[NH+]2CCCCCC2)CC1	2
Cc1csc([N-]S(=O)(=O)c2cccc(Cl)c2C)n1	-1
CCN(CC)C(=O)C[N+](C)(C)CC[N+](C)(C)CC(=O)N(CC)CC	2
CCC[NH+](CCC)C[C@@H](C)OC(=O)N1CC[NH+](C)CC1	2
CC(=O)N[C@H]1CCCN(C(=O)C[N@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)C1	2
Cc1[nH+]c2cc(NCc3nc4ccccc4n3C)ccc2n1C	1
COc1c(C)c[nH+]c(CN2CCC(C(N)=O)([NH+]3CCCCC3)CC2)c1C	2
Cc1c[nH+]ccc1NCCNC(=O)[C@H]1C[NH2+]C[C@H](C(=O)N2CCOCC2)C1	2
COC(=O)c1ccc(Nc2c3c([nH+]c4ccccc24)CCC3)cc1	1
CC(C)c1ccc(C(=O)Nc2ccc(C[NH+]3CCCC3)cc2)cc1	1
Cc1cc(C)cc(NC(=O)CC[NH+]2CCC(C)CC2)c1	1
CCOC(=O)CCCc1c(-[n+]2ccccc2)[nH]c2ccccc12	1
CC[NH+](CC)CCNC(=O)C1CC[NH+](C2CCN(Cc3cccc(C)n3)CC2)CC1	2
C=C1[NH2+]C(=C)C(C(=O)OCC)C(c2cccc(OC)c2)C1C(=O)OCC	1
CCOC(=O)C1CC[NH+]([C@@H](C)CCc2ccc(O)cc2)CC1	1
NC(=O)C1([NH+]2CCCCC2)CCN(C(=O)c2ccco2)CC1	1
C[C@]12C[NH2+]C[C@](C)(CN(Cc3ccccc3Br)C1)C2	1
CC(C)[NH+]1CCC([NH2+][C@@H]2CC[C@@H]2NC(=O)c2c[nH]nc2-n2cnnn2)CC1	2
O=C(C[N@H+]1CCc2ccccc2C1)N1C[C@@H](C[NH+]2CCC(O)CC2)[C@@H](CO)C1	2
COc1cc2c3c(c1O)-c1c(cccc1OC)C[C@@H]3[N@@H+](C)CC2	1
CC[NH+](CC)Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1	1
CCc1c(Oc2cc(C)cc(C)c2)n(CC2CC=CC2)c(=O)[nH]c1=O	0
Cc1cc(N2CC[NH2+]CC2)n2c(nc3ccccc32)c1C#N	1
CC(=O)Nc1ccccc1OC[C@@H](O)C[NH+]1CCC(C(N)=O)CC1	1
CC[NH+]1CCC(NC(=O)C[N@H+]2CCCC[C@@H]2CNC(=O)CC[NH3+])CC1	3
COc1cccc(O[C@H](C)CNC(=[NH2+])Cc2cccc(C)c2)c1	1
CC[NH+](CC)CCC[C@@H](C)[NH2+]C[C@@H](O)COc1c(C)ccc(C)c1C	2
NC(=[NH2+])NCCC[C@@H](C=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([NH3+])c1ccccc1	2
C[NH+](C)CCc1cc2c(c3c1ccc1ccccc13)OCO2	1
CN(c1ncnc2sc3c(c12)CCCC3)C1CC[NH+](C)CC1	1
CC(C)C[NH2+]Cc1cc2cc(S(N)(=O)=O)oc2s1	1
C=CC[N+](C)(C)CCSc1nc(C)cc(COC)c1C#N	1
N#C/C(=C/c1c[nH]c2ccccc12)C(=O)NCc1ccccc1	0
CC[NH+]1CCC(NC(=O)C[NH+]2CCC(CC(=O)N3CCCC3)CC2)CC1	2
CCOC(=O)[C@@]1(c2ccccc2)CCC=C[C@@H]1[NH+](C)C	1
COCc1ccc(C(=O)N2CCCCC2)cc1	0
CN(C(=O)Cc1cccc2occc12)[C@@H]1CC[C@]2(CCCO2)C[C@H]1[NH+]1CCCC1	1
Cc1cc(=O)[nH]c(CNC(=O)[C@@]23C[NH2+]C[C@@H]2C[N@H+](C2CCCC2)C3)n1	2
C[NH+](C)CCCN1c2ccccc2C=Cc2ccccc21	1
CCC[NH+]1CCC(N2C[C@@H]([NH2+]Cc3ccccc3)C[C@H]2C(=O)NCC)CC1	2
CC1(C)CC(NC(=O)c2cccc([N+](=O)[O-])c2)CC(C)(C)[NH2+]1	1
C[C@H](Cc1ccccc1)[NH2+]CCn1cnc2c1c(=O)n(C)c(=O)n2C	1
CCc1nc(NCC[NH+](CC)CC)c(C#N)c2c1COC(C)(C)C2	1
CCCc1cc(=O)oc2cc(OCC(=O)c3ccc(F)cc3)ccc12	0
CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)CCC(=O)OC	2
[O-][n+]1cc(C[n+]2ccccc2)[n+]([O-])cc1C[n+]1ccccc1	2
NC(=[NH2+])Nc1ccc(C(=O)Nc2cnccn2)cc1	1
C[NH+](C)C[C@@H](O)COc1ccc(C[NH+]2CCN(c3cccc(Cl)c3)CC2)cc1	2
C=CC[C@H]1C[N@H+](C)CC[C@@]1(OC(=O)CC)c1ccccc1	1
CCOC(=O)C1CC[NH+](Cc2ccc(OC)c(C)c2C)CC1	1
COc1ccc([C@H](O)c2c(C[NH+]3CCCCC3)c3ccccc3n2C)cc1	1
C=C1[NH2+]C(=C)C(C(=O)OC)C(c2ccc(C)cc2)C1C(=O)OC	1
C[NH2+][C@H](c1cccc(O)c1)C(C)(C)C(=O)NCc1cccc2ccccc12	1
CCc1ccc([C@@H]2[NH2+]CCc3cc4c(cc32)OCCO4)cc1	1
Cc1sc(NC(=O)c2ccco2)c([C@H](c2ccccn2)[NH+]2CCCCC2)c1C	1
COc1ccc(C/[NH+]=C/c2ccc(OC3CSC3)cc2)cc1	1
CC[NH+](CC)CC(=O)N1c2ccccc2Sc2ccc(Cl)cc21	1
COc1ccc(-c2[nH+]c3ccccn3c2NCCc2ccccc2)cc1	1
Cc1nn(CC[NH+](C)C)c(C)c1S(=O)(=O)N1CCC[N@@H+](CCO)CC1	2
Cc1ccccc1C[NH+]1CCN(C(=O)C[NH2+]C2(CO)CCOCC2)CC1	2
C[NH+]1CCN(C(=O)CC[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)CC1	3
O=S(=O)(c1ccccc1)N(C1CC[NH2+]CC1)C1CC1	1
O=C(NCc1ccco1)c1ccccc1C(=O)c1ccccc1	0
C[C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1	2
C[NH+](C)CCCNC(=S)C(=S)NCCC[NH+](C)C	2
CCC1CCC([NH+]2CCN(c3ccc(Cl)cc3)CC2)CC1	1
COc1ccc(-c2[nH+]c3cccc(C)n3c2NCCC(C)C)cc1	1
CCC[NH+](CCC)C1Cc2cc(OC)c(OC)cc2C1	1
COC(=O)c1cc(-c2ccccc2OC)[nH]n1	0
C[C@@H](C[N+]1(C)CCCCC1)OC(=O)CCCCC(=O)O[C@@H](C)C[N+]1(C)CCCCC1	2
O=c1c2cc3c(=O)n(CC[NH+]4CCCCC4)c(=O)c3cc2c(=O)n1CC[NH+]1CCCCC1	2
CC1=C[C@@H](C)[C@H](COC(=O)C[NH+]2CCCCC2)[C@@H](C)C1	1
COc1ccc(/C=N/NC(N)=S)cc1O	0
C[NH+]1CCN(CCOc2ccccc2C[N@H+]2CC[C@](C)(O)[C@@H](O)C2)CC1	2
C[N+](C)(C)CCCC(=O)c1ccc(C(=O)CCC[N+](C)(C)C)cc1	2
CN(CCN(C)/[NH+]=C/c1ccc(N(C)C)cc1)/[NH+]=C/c1ccc(N(C)C)cc1	2
COc1ccc(CCNC(=O)C[NH+]2CCC(C)CC2)cc1OC	1
COc1cc(-c2[nH+]c3cc(C)ccn3c2N)ccc1O	1
CC(=O)Nc1ncc(C[NH+]2CCC(c3ccccc3)CC2)s1	1
CC(C)(C)c1ccc(CC[C@H]2OC[C@H](C[NH+]3CCCC3)O2)cc1	1
Cc1cc(C)[n+]2nc(SCc3ccccc3)sc2n1	1
C[C@H](O)C[N@@H+](Cc1c(Cl)cccc1Cl)C[C@@H](C)O	1
CC1OC(C)OC(C)O1	0
CC[NH+](CC)Cc1cnc2c(C(=O)NCCN3CCOCC3)cnn2c1	1
C[NH+](C)CCNc1nc(-c2ccccc2)nc2ccccc12	1
Cn1ncc(Cl)c1C(=O)Nc1ccc(C[NH+]2CCCCC2)cc1	1
COc1ccc([C@@]2(O)CN3CCCCCC3=[N+]2c2ccccc2)c(F)c1	1
CN(C1CCCCC1)S(=O)(=O)c1ccccc1	0
O=C(c1ccco1)N1CC[NH+](CCc2ccccc2)CC1	1
C[NH+]1CCN(c2ccc(CNC(=O)c3ccco3)cc2)CC1	1
Cn1c[n+](CCC[n+]2cn(C)c3ccccc32)c2ccccc21	2
O=C(C[NH+]1CCCCC1)NC[C@@H]1COc2ccccc2O1	1
COc1ccccc1NC(=O)c1c(N)sc2c1CC[N@@H+](C)C2	1
NC(=O)[C@@H]1CCC[N@@H+](Cc2cccn2CC[NH+]2CCOCC2)C1	2
CCCCCCNC(=[NH2+])NC(=[NH2+])Nc1ccc(Cl)cc1	2
CCOc1ccc(C(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1	0
C[C@@H](C#N)CCC[NH+](Cc1ccccc1)[C@@H]1C[C@@H](C)[N@@H+](C)C[C@H]1C	2
c1ccc2c(C[NH+]3CCC(N4CCOCC4)CC3)c[nH]c2c1	1
O[C@H](C[NH2+]Cc1ccc2c(c1)OCO2)CSc1cccs1	1
Cc1[nH]c2c(C)cccc2c(=O)c1C[NH+]1C[C@H](C)O[C@@H](C)C1	1
COc1ccc(NC2CC[NH+](CCc3ccccc3)CC2)c(OC)c1	1
CN(C(=O)c1ccn[nH]1)C1CC(C)(C)[NH+](C)C(C)(C)C1	1
Cc1ccc(C(=O)COc2ccc(NC(=O)c3ccccc3)cc2)cc1	0
O=S(=O)(N[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccco1)c1ccccc1	1
C[NH+](C)Cc1ccc(CNC(=O)N2CCC(C[NH+]3CCOCC3)CC2)cc1	2
COC(=O)[C@@H](Cc1ccc(O)cc1)NC(C)=O	0
CCOC(=O)C1(c2ccccc2)CC[NH+](CCc2ccc(N)cc2)CC1	1
COc1cc2[nH]c3c(=O)n(CC[NH+](C)C)cnc3c2cc1OC	1
O=C(C[NH+]1CCC(O)CC1)N[C@@H]1CCC[N@H+](C2Cc3ccccc3C2)C1	2
CC[N@H+]1C[C@H]2[C@@H](c3cc(OC)c4c(c3)OCO4)[NH2+][C@](CO)(CCO)[C@H]2C1	2
CC[NH+](CC)CCOC(c1ccccc1)c1ccccc1	1
NC(=O)C1CCN(c2nccc(C(F)(F)F)n2)CC1	0
C[NH+](C)CCNC(=O)c1cccc(CNC(=O)NC2CC[NH+](C)CC2)c1	2
CC[NH+](CC)CC(=O)Nc1c(C)cccc1C(=O)OC	1
Nc1ccccc1NC1CC[NH+](Cc2ccccc2)CC1	1
COC(=O)c1c(NC(=O)[C@@H]2C[C@@H]2c2ccccc2)sc(C)c1C	0
CC1CC[NH+](C2CCN(Cc3ccc4c(c3)OCO4)CC2)CC1	1
O=C1C[C@H]([NH+]2CCC(C3CC[NH+]([C@H]4CC(=O)NC4=O)CC3)CC2)C(=O)N1	2
CN(C)c1cccc2c(S(=O)(=O)NCCN3CC[NH2+]CCNCC[NH2+]CC3)cccc12	2
CCOc1cc(C(=O)Nc2cc(C)on2)cc(OCC)c1OCC	0
Cc1[nH]c2ccc(OC(F)(F)Cl)cc2c1CC[NH3+]	1
Clc1ccc(-c2nnc(SCc3ccccc3)o2)c(Cl)c1	0
O=S(=O)(NCc1ccccn1)c1ccccc1	0
CC[NH+]1CCN(c2oc(COc3ccccc3)nc2C#N)CC1	1
CCOC(=O)[C@@H]1CCCCN1C(=O)C[NH+]1CCC(C[NH+]2CCCC2)CC1	2
O=S(=O)(NC[C@@H]1CCCO1)c1ccccc1	0
COc1ccc(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1	1
Cc1cc(N2CCOCC2)nc(NCc2ccccc2)[nH+]1	1
Cn1c(=O)[nH]c(=O)c2c1ncn2CC[NH+](Cc1ccccc1)Cc1ccccc1	1
CC[NH+]1CCN(CC(=O)N(CC[NH+](C)C)Cc2cccc(C#N)c2)CC1	2
Cc1ccccc1C[NH+]1CCC(C(=O)NCCC[NH+]2CCN(C)CC2)CC1	2
COCC[N@@H+](C)CCN1CC2(CCN(C3CC[NH2+]CC3)CC2)OC1=O	2
COc1ccc([C@H](O)[C@@H](C[NH+]2CCCC2)c2ccccc2)cc1	1
COc1ccc2[nH]c(C(=O)N(C)C3CC[NH+](C)CC3)cc2c1	1
Cc1cc(C)c(CSC2=[NH+]CCN2)c(C)c1CSC1=[NH+]CCN1	2
Cc1c[nH]c2cccc(OC[C@@H](O)C[NH2+]C(C)(C)C)c12	1
NS(=O)(=O)c1ccc(CC[NH2+]C[C@]2(O)CCC[N@H+]3CCCC[C@@H]32)cc1	2
Cc1nc(N2CC[NH+](C)CC2)c2cnn(CCc3ccccc3)c2n1	1
CC1(C)CC(Nc2ccc(Nc3ccccc3)cc2)CC(C)(C)[NH2+]1	1
Cc1ccc(C)[n+](CNC(=O)c2ccc(Cl)cc2Cl)c1	1
COc1ccc(-c2noc(C[N@H+]3CCC[C@@H](C(=O)NCCN4CC[NH+](C)CC4)C3)n2)cc1OC	2
O=c1cccc2n1C[C@H]1C[C@@H]2C[N@H+](CCCc2ccccc2)C1	1
O=C([C@@H]1CCCC[NH2+]1)N1CCN(Cc2cccnc2)CC1	1
COc1ccccc1[C@H](CC[NH2+]C1CC[NH+](C)CC1)c1ccccc1	2
Oc1ccc(CCc2ccc(O)c(O)c2)cc1O	0
CC[NH+](CC)C[C@@H](O)COc1cc(C(F)(F)F)ccn1	1
O=C(Cc1ccc(F)cc1)C1CC[NH+](Cc2ccncc2)CC1	1
CC[NH+]1CCN(c2cc(=O)n(-c3ccccc3Cl)c(=O)[nH]2)CC1	1
C=CCc1cc([C@H]2[NH2+][C@](CO)(CCO)[C@H]3C[N@@H+](C)C[C@@H]23)ccc1OC	2
O=[N+](Cc1cc(Br)ccc1O)c1ccccc1	1
CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1csc(C(C)C)n1	2
CN(C)C(=O)C[NH+]1CCC(NC(=O)N2CCC[C@@H]2C[NH+]2CCCC2)CC1	2
C[NH+]=C(NCCNc1cc[nH+]cc1)N1CCC([C@@]2(C)NC(=O)NC2=O)CC1	2
COc1ccc([C@@H](CNC(=O)CN2CC[NH+](C)CC2)[NH+]2CCCCC2)cc1	2
COc1cc(CNc2ccc([NH+]3CCCCC3)cc2)ccc1OCC(=O)NC(C)(C)C	1
CC1CCC([NH+]2CCN(c3ccc(F)cc3)CC2)CC1	1
C[N@H+]1CCc2c(sc(NC(=S)Nc3ccccc3)c2C#N)C1	1
Cc1nn2c3ccccc3nc2n1CC[NH+]1CCCCC1	1
COc1ccc(OC[C@@H](O)C[NH+](C)C)c(C[NH2+]C2CCCCCC2)c1	2
CCN1C(=Cc2cccc[n+]2C)C=Cc2ccc(C)cc21	1
N=C(NN=Cc1cccc(C(N)=[NH2+])n1)NN=Cc1cccc(C(N)=[NH2+])n1	2
Nc1cc(N2CCc3ccccc3C2)c2ccccc2[nH+]1	1
Nc1nc(N)c2c(-c3ccccc3)nc(N)nc2n1	0
Cc1[nH+]ccn1CCNC(=O)C(=O)Nc1ccc(CC[NH+]2CCCC2)cc1	2
O=C1CC[N@@H+]([C@@H]2c3ccccc3C3(CC[NH+](CC4CC4)CC3)[C@H]2O)CCN1	2
COc1cccc([C@@]2(O)CCCC[C@@H]2C[NH+](C)C)c1	1
CN1CCN(Nc2[nH+]cnc(NCC[NH+]3CCCCC3)c2N)CC1	2
CN(CCC[NH+]1CCOCC1)C(=O)C1([NH+](C)C)Cc2ccccc2C1	2
C[n+]1cc(C(=O)NCC[N+](C)(C)Cc2ccccc2)ccc1/C=N/[O-]	1
CCn1nc(C(=O)NC2C[C@@H]3CC[C@H](C2)[N@H+]3C)c(=O)c2ccccc21	1
COc1ccc(C[C@H](C)[NH2+]C[C@@H](O)c2ccc(O)c(NC=O)c2)cc1	1
COc1ccc(C(=O)c2c(N)sc3c2CC[N@@H+](C)C3)cc1	1
Cc1cc(=O)oc2cc(OCC[NH+]3CCN(c4ccc(Cl)c(Cl)c4)CC3)ccc12	1
C[NH+](C)C[C@@H]1CCC2=C(C1=O)C(c1ccccc1)C1=C(CC[C@@H](C[NH+](C)C)C1=O)O2	2
CC(C)CN1CCO[C@@H](CNC(=O)CN(C)CC(=O)NC2CC2)C1	0
CC1(C)NC(=[NH2+])NC(=N)N1OCc1ccc(Cl)c(Cl)c1	1
COc1ccc(C[N@H+]2CCC[C@@H](C(=O)N3CCCCC3)C2)c(OC)c1	1
Cn1c(=O)n(C)c2cc(C[NH2+]CCC[NH+](C)C)ccc21	2
NC(=O)C1([NH+]2CCCCC2)CCN(c2nc(-c3ccccc3)cs2)CC1	1
CCC(=O)N(c1ccccc1)C1(C(=O)OC)CC[NH+](CCC(=O)OC)CC1	1
C[NH+](C)CCC[NH2+]C[C@@H](O)COCc1ccc2c(c1)OCO2	2
CCOC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(OC)c(C)c2)C1	1
C[NH+]1CCN(c2ccc(NC(=O)c3ccccc3)cc2)CC1	1
C[NH+](C)Cc1cc(F)ccc1Sc1ccc(C(F)(F)F)cc1N	1
CC[NH+]1CCN(c2nc3c(c(=O)[nH]c(=O)n3C)n2CCC(C)C)CC1	1
CC1CC[NH+](CCCC(=O)c2ccc(F)cc2)CC1	1
COC(=O)c1csc2c(C(F)(F)F)cc(N3CC[NH2+]CC3)nc12	1
Nc1cc(OCC2CC2)c(C(=O)N[C@H]2C[NH+]3CCC2CC3)cc1Cl	1
COc1ccc2c3c1O[C@@H]1C(=O)CC[C@@H]4[C@@H](C2)[N@H+](C)CC[C@]314	1
CC(C)NC(=O)Cn1nnc2ccccc2c1=O	0
C[N@@H+](CCc1ccccn1)[C@@H]1CC(=O)N(c2ccccc2)C1=O	1
CCCc1cc(OC)c(C[C@@H]2c3cc(O)c(Cl)cc3CC[N@@H+]2C)cc1OC	1
COc1ccc(C[NH2+]C2CCCC2)c(OC[C@H](O)C[NH+]2CCCC2)c1	2
CC[NH+](CC)CCOc1ccc2c(C)cc(OCC[NH+](CC)CC)nc2n1	2
CCOc1ccc([N+]2=C3CCCCCN3[C@](O)(c3ccc(F)cc3)C2)cc1	1
CC[NH+]1CCN(c2nc3cc(OC)ccc3cc2C[NH2+][C@@H](C)COC)CC1	2
[NH3+]CC[NH2+]CCOCCOc1ccc(Br)cc1Cl	2
COC(=O)[C@@H]1[C@H](OC(=O)c2ccccc2)C[C@@H]2CC[C@H]1[N@@H+]2C	1
COc1ccc2c3c1O[C@@H]1[C@H](O)C=C[C@@H]4[C@@H](C2)[N@H+](C)CC[C@]314	1
CC1(C)CC(NC(=O)c2ccc(-n3cnnn3)cc2)CC(C)(C)[NH2+]1	1
CCCc1cc(N2CC[NH+](CC)CC2)n2c(nc3ccccc32)c1C#N	1
CN1CCC([NH+]2CCC(NC(=O)NCC[NH+]3CCCCC3)CC2)CC1	2
Cc1cc[n+](CCCCC[n+]2ccc(C)c(C)c2)cc1C	2
CC1(C)CC2(CC(C)(C)[NH2+]1)OC(=O)N(C1CC1)[C@@]2(C)O	1
C[N+]1(CCOCc2ccccc2)CC[N+](C)(CCOCc2ccccc2)CC1	2
CC[NH+](CC)CCn1c2ccccc2n2cc(-c3cccc4ccccc34)nc12	1
NC(=[NH2+])c1cccc(N2CCCCN(C3CCN(C(N)=[NH2+])CC3)C2=O)c1	2
O=C([C@@H]1CCC[N@@H+](Cc2ccc3c(c2)OCO3)C1)N1CCCC1	1
Cc1cc(C)n(-c2cccc(C[N@H+]3CCO[C@@H](CC[NH+](C)C)C3)c2)n1	2
CC(C)c1ccc(OCC(=O)N2CCN(c3ccccc3)CC2)cc1	0
C[C@@H](CC(C(N)=O)(c1ccccc1)c1ccccc1)[NH+](C)C	1
CC[NH+](CC)CCN1C(=O)c2ccccc2N[C@@H]1c1ccc(F)cc1	1
COc1cc(O)cc(O)c1	0
O=C(c1cccc(C[N@H+]2CCN3c4ccccc4OC[C@H]3C2)c1)N1CCCCC1	1
CC(C)[N@H+]1C[C@@H](C)[C@H](OC(=O)c2ccccc2)C[C@H]1C	1
Cc1[nH+]ccn1CC1(O)CCN(C(=O)C2C[NH+](Cc3ccccc3)C2)CC1	2
COc1ccc2c(c1O)-c1c3c(cc4c1[C@H](C2)[N@@H+](C)CC4)OCO3	1
COc1ccccc1[N+]1=C2CCCCCN2C[C@@]1(O)c1ccc(Br)cc1	1
Cc1c(CNC(=O)[C@@H]2CCC[N@H+](C3CC[NH+](C)CC3)C2)cnn1C	2
CCN1/C(=C\C=C\c2oc3ccccc3[n+]2CC)Oc2ccccc21	1
Cc1ccc2occ(CN3CCC([NH+]4CCCCC4)CC3)c(=O)c2c1	1
Nn1c(C(=O)NC[C@@H]2CCCO2)nc2ccccc2c1=O	0
CC1(C)CC(NC(=O)Cn2cccc([N+](=O)[O-])c2=O)CC(C)(C)[NH2+]1	1
COc1cc(C[N@@H+](C)C2CCN(C)CC2)cc2c1OCO2	1
CCCC[NH2+]CC(=O)Nc1ccc(NC(=O)C[NH2+]CCCC)cc1	2
O=C(OCC[NH+]1CCCCC1)c1c[nH]c2ccccc12	1
COc1cc(N[C@H](C)CCCNC(=[NH2+])NC(=[NH2+])NC(C)C)c2ncccc2c1	2
CC(=O)C(C(C)=O)=C(N)N1CCOCC1	0
CC[N@@H+](C)C[C@@H](O)CN(C)C[C@@H]1C[C@H](F)CN1c1ccnc(N(C)C)n1	1
CCc1nc(C)nc(N2CCN(C(=O)c3ccc(OC)cc3)CC2)c1Cc1cccc(F)c1	0
C[NH+](C)CCOc1ccc(CNC(=O)C(=O)N2CC[N@H+]3CCC[C@@H]3C2)cc1	2
CCn1c(SC(C)C)nc2c1c(=O)[nH]c(=O)n2C	0
CCOc1cc(C[NH2+]CCC[NH2+]C)cc(Br)c1OCc1ccccc1	2
O[C@@H](COc1ccccc1C[NH2+]Cc1cc(-c2ccccc2)n[nH]1)C[NH+]1CCCCC1	2
C[NH2+]CCN1C(=O)CC[C@H]2C[N@H+](Cc3cc(=O)n4ccccc4n3)CC[C@H]21	2
C[NH+](C)Cc1cccc(NC(=O)C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c1	2
C[NH+]1CCN(c2ccccc2/C=C2/C(=O)Nc3ccccc32)CC1	1
C[NH+](C)CCC1CC[NH+](CC(=O)NCCOc2ccc(Cl)cc2)CC1	2
CC[NH+](CC)CCNC(=O)c1ccc(N2CC[NH+](C)CC2)nc1	2
C[C@@H](C[NH+](C)C)[C@@](O)(Cc1ccccc1)c1ccccc1	1
CC(C)C[N@H+]1CCNC(=O)[C@@H]1CC(=O)NCC[NH+]1CCCC1	2
C=C(C)CSc1nc2ccccc2c(=O)n1-c1ccc(OC)cc1	0
COc1ccc(CSCC(=O)NC2C[C@@H]3CC[C@H](C2)[N@H+]3C)cc1	1
CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(F)c2)C1)C(=O)C[NH+]1CCC(O)CC1	2
COc1cc(C(=O)NCC2([NH+](C)C)CCCC2)cc(OC)c1OCc1ccccc1	1
C[N@H+]1[C@H]2CC[C@@H]1CC(NS(=O)(=O)c1ccc(F)cc1)C2	1
CCOc1ccc(N2C(=O)C[C@H]([NH2+][C@@H]3CCCCNC3=O)C2=O)cc1	1
COCC[NH+]1CCC(CNC(=O)[C@@H]2CCC(=O)N(CC[NH+](C)C)C2)CC1	2
Cc1cc(C(=O)N2CC[NH2+]CC2)c(-c2ccccc2)o1	1
COc1ccc(N2C(=O)C[C@@H]([N@@H+](C)CCc3ccc(OC)c(OC)c3)C2=O)cc1	1
CN(C(=O)C[C@@H]([NH3+])C1CCN(C(N)=[NH2+])CC1)[C@@H]1CNC(=NC(N)=O)NC1=O	2
O=C(NCC[NH+]1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1)c1ccc(F)cc1	1
O=C1Cc2c(ccc3c(CCC4CC[NH+](Cc5ccccc5)CC4)noc23)N1	1
CC[NH+]1CCN(CC(=O)NCCNC(=O)CN2CC[NH+](CC)CC2)CC1	2
Cc1c(C(=O)N(C)C2CC[NH+](C)CC2)cnn1-c1ccc(F)cc1	1
CC(C)CC(=O)N1CCC([NH+]2CCN(c3ccccc3)CC2)CC1	1
CN1CC[NH+](C[C@H]2C[C@@H](C(=O)NCC[NH+](C)C)CN(Cc3nccn3C)C2)CC1	2
COc1ccc(Nc2nc(N3CC[NH2+]CC3)nc3ccccc23)cc1	1
O=C(OC[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccccc1	1
O=[N+]([O-])c1ccc(CN2CC[NH+](Cc3ccccc3)CC2)cc1	1
COc1ccc(CSCCNC(=[NH2+])NC(N)=[NH2+])cc1	2
Cn1cc(C[N@H+]2CCCN(CC(=O)NC3CC[NH+](C4CC4)CC3)CC2)cn1	2
COc1ccc(OC)c(C[NH2+]Cc2ccccc2OC)c1	1
OC1(Cn2ccnc2)CC[NH+](C[C@]2(O)CCC[N@H+]3CCCC[C@@H]32)CC1	2
COc1cc(SC)ccc1C(=O)Nc1ccc(C(N)=O)cc1	0
O=C(NCc1ccccc1)[C@@H]1CC[C@@H](C(=O)NCc2ccccc2)[NH2+]1	1
[NH3+]C1C[C@@H]2CC[C@H](C1)N2CC(=O)Nc1ccc(Br)cn1	1
C[NH+](C)CCNC(=O)NC1(C(F)(F)F)Oc2ccccc2O1	1
C[NH+](C)CCNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	1
Cc1c(C)n(C[C@@H](O)C[NH2+]Cc2ccco2)c2ccccc12	1
CC(C)[NH+]1CCC(N2CC[N@@H+](CCCn3cccn3)C[C@@H]2CCO)CC1	2
CCCn1c(=O)c2nn(CC[NH+](C)C)nc2n(C[C@H](C)CC)c1=O	1
C[NH+]1CCC(OC(=O)COc2ccc(C(C)(C)C)cc2)CC1	1
N=c1n(CC[NH+]2CCCC2)c2ccccc2n1C[C@@H](O)c1ccco1	1
Cc1cc(C(F)(F)F)nc(CCNC(=O)[C@@]23C[NH2+]C[C@@H]2C[N@H+](C)C3)n1	2
COc1ccc(C[N@@H+](C)C2CCN(C)CC2)c(OC)c1	1
O=C(c1ccncc1)N1CC[NH+](C2C3CC4CC(C3)CC2C4)CC1	1
C[NH+](C)CCn1c2c(c3ccccc31)CCCn1cnnc1-2	1
COc1cc(C[NH2+]C2CCC2)ccc1OC[C@@H](O)C[N@@H+](C)C1CCCCC1	2
CN(CC[NH+](C)C)C(=O)c1cccc2c(N)c3ccccc3[nH+]c12	2
C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)Nc1cccc2c1CC[NH2+]C2	3
CNc1nc(N2CCn3nc(C(=O)NCC[NH+](C)C)cc3C2)cc(C)[nH+]1	2
CC(C)[NH2+]C[C@H]1CCc2cc(CO)c([N+](=O)[O-])cc2N1	1
CCCc1[nH+]c2ccc(Br)cn2c1NC(C)(C)C	1
COc1ccc2c(c1)N(CC[C@H]1CCCC[N@H+]1C)c1ccccc1S2	1
O=C(c1ccco1)N1CC[NH+](C2C3CC4CC(C3)CC2C4)CC1	1
Cc1ccccc1OCC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1	1
CCOC(=O)c1oc2ccccc2c1C[NH+]1CCC(C(N)=O)CC1	1
Cc1cc(C)cc(NC(=O)[C@@H]2C=C(O)NC(=[NH2+])S2)c1	1
C[NH+](C)CCN(Cc1ccccc1)c1nc2ccccc2o1	1
O=S(=O)(c1ccccc1)n1ccc2c(N3CC[NH2+]CC3)cccc21	1
CC[NH+]1CCC(NC(=O)C[N@@H+](CC)C[C@@H]2COc3ccccc3O2)CC1	2
COc1cccnc1NC(=O)NC1C[C@@H]2CC[C@H](C1)[N@H+]2C	1
Nc1[nH+]c2ccccc2n1CCCCn1c(N)[nH+]c2ccccc21	2
CC[NH+](CC)CCCn1nnc2c(=O)oc3ccccc3c21	1
COC(=O)c1cccc(OC[C@@H](O)C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1	2
COc1cc2c(cc1OC)C(=O)[C@@H](Cc1cc[n+](Cc3ccccc3)cc1)C2	1
CN(C)c1nccc(N(CC[NH+](C)C)Cc2ccccc2)c1C#N	1
COc1ccc(CC[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C)cc1	2
COc1ccc(C(=O)OC2C[C@@H]3CC[C@H](C2)[NH2+]3)cc1OC	1
Fc1ccc(-c2ccc(C[NH2+]CC3CC[NH2+]CC3)o2)cc1	2
Cc1cccc2nc(Cn3ccccc3=O)cn12	0
COc1ccc(Cc2c(N)nc(-c3ccccc3)[nH+]c2N)cc1	1
O=C(CC[NH+]1CCC(OCC[NH+]2CCCC2)CC1)N1CC[NH2+]CC1	3
O=C(CCN1C(=O)CCC1=O)OC[C@H]1CCC[N@H+]2CCCC[C@@H]12	1
C[NH+]1CCC(=NOC(=O)Nc2cccc(C(F)(F)F)c2)CC1	1
CC[C@@H](C)[C@@H]([NH3+])C(=O)Nc1ccc2ccccc2c1	1
COCC[NH+]1CCC(C[N@H+](Cc2ccncc2)CC(C)C)CC1	2
COCC(C)(C)[NH+]1CCN(C(=O)CCC[NH+]2CCC([NH3+])CC2)CC1	3
Cn1c(NC2CC[NH+](Cc3ccccc3)CC2)cc(=O)n(C)c1=O	1
CC(C)[C@H](CNC(=O)NCC[N@H+]1CCCC[C@@H]1C)N1CC[NH+](C)CC1	2
COc1cc(C[NH2+]C(C)(C)C)ccc1OCC(=O)NC(C)(C)C	1
CC(C)[NH+]1CCC(N2CCN(c3ccccc3)CC2)CC1	1
N#Cc1nc(-c2ccccc2)oc1NCC[NH+]1CCCCC1	1
CCC12CN3CC[NH+](CC(C3)/C1=N\N=C1/C3CN4CC[N@@H+](C3)CC1(CC)C4)C2	2
Cc1[nH+]ccn1-c1ncccc1CNC(=O)NC[C@@H](O)C[NH+]1CCCCC1	2
CCCc1c(O)n2c3cc(C)ccc3nc(N(C)C)n2c1=O	0
C[NH+](C)Cc1cc(C(N)=O)ccc1Oc1ccc(OC(F)(F)F)cc1	1
O=c1[nH]c2c(c3nc(-c4ccccn4)nn13)C[N@@H+](Cc1ccccc1)CC2	1
O=C(NC[C@@H]1CCC[N@@H+](CCn2nc3ccccn3c2=O)C1)[C@@H]1CCC[NH2+]1	2
COc1ccc(C[NH2+][C@@H](C)[C@@H]2COc3ccccc3O2)c(OC)c1	1
C[NH+](C)CCNc1nc2[nH]nc(N)c2c2c1C[N@H+](C1CCCCC1)CC2	2
CC[NH+]1CCN(C(=O)[C@@H](C)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1	2
C[N+]12CCCC[C@@H]1[C@H](CCOC(=O)c1ccc3c(c1)OCO3)CCC2	1
COc1ccccc1O[C@@H](C)C(=O)Nc1ccc(NC(C)=O)cc1	0
CCOC(=O)N1CCC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1	2
Cc1oc(-c2ccc(C(N)=[NH2+])cc2)c(C)c1-c1ccc(C(N)=[NH2+])cc1	2
CC1=C(NC(=S)NC(=O)c2ccccc2)[NH2+]Cc2ccccc21	1
C[NH+](C)Cc1cc(NS(C)(=O)=O)ccc1Oc1ccc(C(F)(F)F)cc1	1
CCC[NH+]1CCC(N2C[C@H]([NH2+]C(CC)CC)C[C@H]2C(=O)NC)CC1	2
CSc1ccc(Oc2ccc(S(N)(=O)=O)cc2C[NH+](C)C)cc1	1
CC(C)(CO)NC(=O)c1ccc(Cl)cn1	0
CCN(CC)C(=O)[C@@H]1CCC[N@@H+](Cc2cc(OC)c3c(c2)OCO3)C1	1
CCOC(=O)c1[nH]c2ccccc2c1NC(=O)C[NH+]1CCCCC1	1
CCOc1cc(C[NH+]2CCC(C(=O)NCC(C)C)CC2)ccc1O	1
CN(C)C(=O)Oc1ccc(-c2c[n+]3cc(NC(=O)c4ccccc4)ccc3n2C)cc1	1
N#Cc1ccc(-c2ccc(OC[C@@H](O)C[NH+]3CCCCC3)cc2)cc1	1
C[N+](C)(C)CCOC(c1ccccc1)c1ccccc1	1
CN1c2ccccc2Oc2nnc(N3CC[NH+](C)CC3)cc21	1
CC1(C)CC(NC(=O)C2C[C@@H]3CCC[C@H](C2)C3=O)CC(C)(C)[NH2+]1	1
Cc1cccc(OCC(=O)N2CC[NH+](C[C@@H]3C[C@H]4C=C[C@@H]3C4)CC2)c1	1
CC[C@@H](C)[C@@H]([NH3+])C(=O)N1CCN(C(=O)C2CCCCC2)CC1	1
O=C(CN1C(=O)COc2ccccc21)NCC[NH+]1CCCC1	1
Cn1ccnc1C[N@@H+](C)CC1CC[NH+](CCc2cccc(F)c2)CC1	2
CC(C)(C)c1ccc(CC[C@@H]2OC[C@@H](C[N+]3(C)CCOCC3)O2)cc1	1
Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3cc[nH+]cc3)nc21	1
c1cc(/N=N/Nc2cccc(C3=[NH+]CCN3)c2)cc(C2=[NH+]CCN2)c1	2
CC(C)C[NH+]1CCC(C(=O)N2CCN(c3ccccc3F)CC2)CC1	1
CCC(=O)Nc1ccc2[nH]cc(C3CC[NH+](C)CC3)c2n1	1
CC[NH+](CC)CCNc1cc(C)[nH+]c2c1C(=O)C(=O)C=C2N1CCCCC1	2
COc1c(C)cnc(CSc2nc3c(C)ccnc3[nH]2)c1C	0
COc1cccc([C@@H]2Oc3ccccc3C3=C2[C@@H](c2ccc(F)cc2)N2NC=NC2=[NH+]3)c1	1
COC(=O)c1ccc2[nH]c(C)c(C[N@@H+](C)C3CCCCC3)c(=O)c2c1	1
CC(=O)Oc1c(C)c(C)c2c(c1C)CC[C@](C)(CC[N+](C)(C)C)O2	1
O=C([O-])[C@@H](Cc1ccccc1)[NH2+]Cc1ccccc1O	0
O=C(NCCc1cccc2ccccc12)C1CCC1	0
c1ccc2cc3c(NCCN4CCOCC4)cc[nH+]c3cc2c1	1
COC(=O)c1c(C)[nH]c(C(=O)C[NH+]2CCC(C)CC2)c1C	1
C[NH+](C)CCC[NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1	2
C=CCN(C1=[NH+]CCN1)c1c(Cl)cccc1Cl	1
CC(=O)N1CC[NH+](c2[nH]c(=S)c(C#N)c3c2COC(C)(C)C3)CC1	1
CN(CC[NH+](C)C)C[C@H]1C[N@@H+]2CC[C@H]1C[C@@H]2CNC(=O)c1ccc(N(C)C)cc1	2
CC(C)(C)[C@@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)NCc1ccc(C(N)=[NH2+])cc1	2
c1ccc(CN(CC[NH+]2CCCC2)c2ccccc2)cc1	1
C[N@H+]1CCC[C@@H](OC(=O)COc2ccc(Br)cc2)C1	1
C[NH+](C)CCO[C@](C)(c1ccccc1)c1ccc(Cl)cc1	1
C[NH+](C)CCN1C[C@@H](C(=O)NC2CC[NH+](Cc3ccco3)CC2)CC1=O	2
C[NH+](C)[C@@](C)(CO)Cc1ccc(Cl)c(Cl)c1	1
CNC(=O)COc1ccccc1OC[C@H](O)C[NH2+]C(C)(C)C	1
C[NH+](C)CCOC(=O)c1sc2ccccc2c1Cl	1
COc1c2c(cc3c1[C@@H](c1ccc(O)cc1O)[N@H+](C)CC3)OCO2	1
C[NH+](C)CCCOc1cccc(CN2CC[N@@H+](C)[C@@H](CCO)C2)c1	2
C[N@H+]1[C@H]2CC[C@@H]1CC(NC(=O)c1c(F)cccc1F)C2	1
C[NH+]1CCN(C(=O)Nc2cccc3ccccc23)CC1	1
COc1ccc([C@@H]2SCC(=O)N2c2ccc(NC(C)=O)cc2)cc1	0
C(=C/c1cc2cc(C3=[NH+]CCN3)ccc2[nH]1)\c1ccc(C2=[NH+]CCN2)cc1	2
C[C@H]([NH3+])C(=O)N[C@H]1CC[C@H]2CC[C@@H](C(=O)NCc3ccccc3)[N@H+]2C1	2
CC[NH+](CC)CCNc1c2ccccc2nc2c1c(C)nn2C	1
[NH3+]C[C@@H]1CCC[C@@H]1NCCS(=O)(=O)N1CCN(c2ccccn2)CC1	1
C[NH+](C)Cc1ccccc1-c1ccc2ncnc(NC3CC[NH2+]CC3)c2c1	2
CC[NH+]1CCN(C(=O)c2cc(OC)ccc2OC2CC[NH+](C3CCCC3)CC2)CC1	2
O/N=C/c1cc[n+](C/C=C/C[n+]2ccc(/C=N/O)cc2)cc1	2
CC1CC[NH+](C[C@@H](O)COc2cccc3ccccc23)CC1	1
Clc1ccc2nc(N3CC[NH2+]CC3)nc(-c3ccccc3)c2c1	1
C[N@H+]1CCC[C@@H](n2nc(Cc3ccc(Cl)cc3)c3ccccc3c2=O)CC1	1
CN1CCC[NH+]=C1COC(=O)[C@@](O)(c1ccccc1)C1CCCCC1	1
Cc1cccc(S(=O)(=O)N(C)[C@H](C)CC[NH+]2CCC(C)CC2)c1	1
[NH2+]=C1N[C@@H](C(=O)c2ccccc2)[C@@H](c2ccc(Cl)cc2)N1	1
C[NH+](C)CCNc1cc(-c2cc(Cl)ccc2Cl)nc2ccccc12	1
COc1ccccc1C[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C	2
Cc1c(O)c(C[NH+]2CCCCC2)cc2c(-c3ccccc3)cc(=O)oc12	1
CC1(C)CC(NS(=O)(=O)c2ccccc2)CC(C)(C)[NH2+]1	1
CC(C)[NH+]1CCC(N(C(=O)Cc2ccccc2)c2ccc(Cl)cc2)CC1	1
C[NH+]1CCN(c2ncccc2CNC(=O)N2CC[NH+](CC3CC3)CC2)CC1	2
Nc1nc(N2CC[NH+](C/C=C/c3ccccc3)CC2)nc2ccccc12	1
C[N@@H+](Cn1c(=O)oc2ccccc21)C1CCCCC1	1
O[C@H](c1ccc(Cl)cc1)[C@@H](c1ccccc1)[NH+]1CCCCC1	1
Cc1cc[n+](Cc2ccccc2C[n+]2ccc(C)cc2)cc1	2
O=C(C[C@@H](CO)[NH2+]Cc1ccccc1)NCc1ccccc1	1
C(=C/COc1ccc(C2=[NH+]CCN2)cc1)\COc1ccc(C2=[NH+]CCN2)cc1	2
COc1cc(N)c(Cl)cc1C(=O)CCC1CC[NH+](CCNS(C)(=O)=O)CC1	1
COc1cc(C(=O)Nc2ccccc2C#N)cc(OC)c1OC	0
O=C(Nc1c[nH]c(=O)[nH]c1=O)c1cccs1	0
C#CC[NH+]1CCC(C(=O)NCCN2CC[NH+](Cc3ccccc3)CC2)CC1	2
CCNS(=O)(=O)c1cccc2nonc12	0
CC1(C)CC(N2CN(C3CCCCC3)CC2=O)CC(C)(C)[NH2+]1	1
Cc1cc(C)c2c(N)c(C3=[NH+]C(C)(C)Cc4ccccc43)sc2n1	1
Nc1c2ccccc2[nH+]c2c(C(=O)NCC[NH2+]CCO)cccc12	2
C[NH+](C)CCC=C1c2ccccc2Sc2ccccc21	1
C#CCC1(OC(=O)CC)CC[NH+](CCc2ccccc2)CC1	1
CC(C)OC(=O)C1(c2ccccc2)CC[NH+](C)CC1	1
COCCn1c(C)cc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1C	2
COc1cc(N)c(Cl)cc1C(=O)OCC[NH+]1CCCCC1	1
CC(C)CC[N@H+]1CCNC(=O)[C@H]1CC(=O)N(C)CC[NH+]1CCCC1	2
COc1cc(C)ccc1S(=O)(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1	1
CCOc1ccc2[nH+]c(C)cc(Nc3ccc(OC)cc3)c2c1	1
CCn1c([C@@H]2CCCN(C(=O)C3CC[NH2+]CC3)C2)nn(CC[NH+](C)C)c1=O	2
O=C(NCC1(CO)CCOCC1)[C@@]12C[NH2+]C[C@@H]1C[N@H+](C1CCCC1)C2	2
Cn1cc(CCNC(=O)[C@@H]2CCC[N@H+](C3CC[NH+](C)CC3)C2)cn1	2
CN(C)S(=O)(=O)c1cccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1	2
CC[C@@H]1CSC2=[N+](c3ccccc3)[C@@](O)(c3ccc(OC)cc3)CN21	1
[NH3+]CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	1
O=C(COc1ccc(Br)cc1)NCC[NH+]1CCCC1	1
C[C@@]1(C(N)=O)CCN(C(=O)NCCC[NH+]2CCN(c3cc[nH+]cc3)CC2)C1	2
CC(C)Oc1ccccc1N1CC[NH+](Cc2cccc([C@H](O)c3ccccc3)c2)CC1	1
Cc1ccc(NC(=O)[C@@H]2C=C(O)NC(Nc3cccc(C)c3)=[NH+]2)cc1	1
COc1ccc([C@@](C#N)(CC[NH+](C)C)C[NH+](C)C)cc1	2
c1ccc(CCC[NH+]2CCN(c3ccccn3)CC2)cc1	1
NC(=[NH2+])c1ccc2nc(Cc3nc4ccc(C(N)=[NH2+])cc4[nH]3)[nH]c2c1	2
C[C@@H](O)C[NH+](Cc1cccc(Cl)c1)C[C@@H](C)O	1
Cc1c(C)n(CC[NH+](C)C)c2nc[nH+]c(NCc3ccco3)c12	2
O=C([C@H]1CSCN1C(=O)/C=C/c1ccccc1)N1CCCC1	0
O=C1O[C@H](CC[NH+]2CCCCC2)OC1(c1ccccc1)c1ccccc1	1
C[NH2+]Cc1ccccc1[C@H](O)c1ccc(Cl)cc1	1
C[C@H]1C[N@@H+](C)[C@H](C)C[C@@]1(O)CC(O)(c1ccccc1)c1ccccc1	1
C[NH+]1CCN(/C=N/c2ncc(C(F)(F)F)cc2Cl)CC1	1
COc1ccc(Cl)cc1NC(=O)C[NH+]1CCC(C)CC1	1
CN(C)C(=O)C[NH+]1CCC(NC(=O)NCC(C)(C)[NH+]2CCCCC2)CC1	2
CNc1nccn2c(Br)cnc12	0
CCOC(=O)c1[nH]c2ccc(C)cc2c1NC(=O)C[NH+](C)C	1
CC(C)[N@H+]1CC[C@@H](CNC(=O)NC2CC[NH+](CC(=O)N(C)C)CC2)C1	2
C[NH+](CCCO)C1CCN(C(=O)NC[C@@H]2C[N@H+]3CCCC[C@@H]3CO2)CC1	2
CC(C)(C)[NH2+]C[C@@H](O)COc1cccc2c1SCCC2	1
CCCC(=O)Nc1ccc(OC[C@@H](O)C[NH2+]C(C)C)c(C(C)=O)c1	1
O=C(NCCC(c1ccccc1)c1ccccc1)c1cccs1	0
CC[C@@H](O)c1ccc(OC[C@@H](O)C[NH+]2CCCCC2)c(OC)c1	1
O=C1CS[C@@H](c2ccccc2F)N1CC[NH+]1CCCCC1	1
CC1CCN(Cn2ncn(C[NH+]3CCC(C)CC3)c2=S)CC1	1
O=C(c1ccccc1)N(c1ccccn1)[C@@H]1C[NH+]2CCC1CC2	1
O=C1[C@@H]2CC=C(Cl)C[C@H]2C(=O)N1CC[n+]1ccccc1	1
COC(=O)COc1ccc(Nc2nnc(C)c3ccccc23)cc1	0
C[NH+](C)Cc1nc(-c2c(Cl)cccc2Cl)no1	1
C[N+]1(C)CCc2cc3c(cc2[C@@H]1[C@@H]1OC(=O)c2c1ccc1c2OCO1)OCO3	1
C[NH+](C)CCCN1C(=O)CCn2c3c(c4cccc1c42)CCCC3	1
CCn1ccnc1C[NH+]1CCC([C@@H]2CC[N@H+](CC(C)(C)C)C2)CC1	2
COc1ccc2c(c1)-c1c(ccc(OC)c1O)C[C@@H](CCc1ccccc1)[N@H+](C)CC2	1
CCn1c(N)[n+](CC(=O)c2ccc(C)cc2)c2ccccc21	1
COc1cccc(OC)c1OC[C@@H](O)C[NH2+][C@@H](C)c1ccccc1	1
COC(=O)c1cc[n+](Cc2ccc([N+](=O)[O-])cc2)cc1	1
COc1ccc(CC[C@H](C)[NH2+]Cc2ccc(Cl)c(Cl)c2)cc1	1
CC(=O)Nc1ccc2c(CCC3CC[NH+](Cc4ccccc4)CC3)noc2c1	1
CCC[NH+]1CCC([NH2+][C@@H]2CCCc3ccccc32)CC1	2
C[n+]1ccccc1C(=O)NCCNC(=O)c1cccc[n+]1C	2
C/C(=C\c1ccccc1)C[NH+]1CCC(C(=O)N2CCC(C)CC2)CC1	1
NC(=O)CCOC1CC[NH+](C(c2ccccc2)c2ccccc2)CC1	1
CCN1C(=O)/C(=C/C=C2\CCC[N@H+]2C)N(c2ccccc2)C1=S	1
C[C@@H](O)C[NH+]1CCC(CN(C)C(=O)CCC[NH+]2CCC([NH3+])CC2)CC1	3
C[C@@H](Cc1c[nH]c2ccc(Cl)cc12)/[NH+]=C/c1ccc(N(C)C)cc1	1
C[NH+](C)Cc1ccc(C(=O)N2CCN(Cc3ccccc3)CC2)cc1	1
O=C(OCC[NH+]1CCCC1)c1ccccc1Nc1ccnc2cc(C(F)(F)F)ccc12	1
O=c1oc(CC[NH+]2CCN(c3ccccc3)CC2)c(-c2ccc(F)cc2)o1	1
CC(C)CCNC(=O)C1CC[NH+](Cc2ccccc2O)CC1	1
COc1cc2c(cc1OC)CC[NH+](CCc1ccc(N)cc1)CC2	1
CC[NH+]1CCN(c2c(Cl)cccc2NC(=O)COc2ccccc2)CC1	1
CC(C)(C)c1cc2nc(C(F)(F)F)cc(N3CC[NH2+]CC3)n2n1	1
CC(C)[N@H+]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccnc3)[C@H]2C1	1
Cc1cc2c(cc1C)[n+](C[C@@H](O)COc1ccccc1C)cn2C	1
O=C1NCCN1CC[NH+]1CCC(c2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)CC1	1
CN1CCC([N@@H+](C)C2CCN(Cc3ccccc3)CC2)CC1	1
COC(=O)c1ccc(NC(=O)c2cc[n+](Cc3ccccc3)cc2)cc1	1
CC[C@@H]1C[N+]2(C)CCc3cc(OC)c(OC)cc3[C@@H]2CC1=O	1
C[NH+](C)CCOC(=O)c1cn(Cc2ccccc2)c2ccccc12	1
CCOC(=O)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1	1
COC(=O)CCC(=O)Nc1cccc(C(=O)OC)c1	0
COc1ccc(C(=O)N2CC[NH+](C3CCCC3)CC2)cc1	1
C[NH+](C)C1CCC(NC2=CC(=O)C(NC3CCC([NH+](C)C)CC3)=CC2=O)CC1	2
COc1ccccc1N1CC[NH+](Cc2ccc(C)cc2)CC1	1
C[NH+](C)CCN1C[C@@H](C(=O)NCc2cccc(C[NH+]3CCCC3)c2)CC1=O	2
O=C(O[C@@H]1C[NH+]2CCC1CC2)N1CCc2ccccc2[C@H]1c1ccccc1	1
CCOc1cc2c(cc1OCC)[C@@H](C(CC)CC)[NH2+]CC2	1
CN(C(=O)c1cn(CC[NH3+])nn1)[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1	2
CS(=O)(=O)N(CCC[NH+]1CCCC1)CCC(=O)N1CC[NH2+]CC1	2
C[NH+]1CCN(c2ccc(CN3CCS(=O)(=O)CC3)cc2)CC1	1
Cc1cc(-n2cc[nH+]c2C)n2c(nc3ccccc32)c1C#N	1
C[NH+](C)C1CCN(CCNC(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)CC1	2
CC(C)C[NH+](CC(C)C)CN1C(=O)NC2(CC[NH+](C)CC2)C1=O	2
C[NH+](C)CC[C@@]1(C)OCCC2=C1Cc1ccccc12	1
OC(c1ccccc1)(c1ccccc1)[C@@H]1CCCC[NH2+]1	1
CC(C)[C@@H](c1ccccc1)[C@H](O)CC[NH+]1CCCCC1	1
C[C@H]1CC[C@@H](C(N)=O)C[NH+]1CC1(C[N@H+]2C[C@@H](C(N)=O)CC[C@H]2C)COC1	2
Cc1ccn2ncc(C(=O)NC3C[C@@H]4CC[C@H](C3)[N@H+]4C)c2c1	1
COc1ccc(/N=C/c2ccccc2N2CC[NH+](C)CC2)cc1	1
O=C1CC[C@@H](C(=O)N2CCC([NH+]3CCSCC3)CC2)CN1CCC[NH+]1CCOCC1	2
Nc1ccc(C(=O)NC[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1	1
Cc1cc(=O)oc2cc(O[C@@H](C)C(=O)NCc3ccco3)ccc12	0
CCOC(=O)c1c(-c2ccc([N+](=O)[O-])cc2)csc1NC(C)=O	0
CC[NH+]1CCN(Cc2nc(-c3c(C)ncc4c3CC[NH2+]C4)no2)CC1	2
C=CCOc1c(Cl)cc(C[NH2+]CCC[NH+](C)C)cc1OC	2
OCC[NH+](CCO)Cc1ccccc1Sc1cccc2ccccc12	1
Cn1cc(C2=C(c3c4n(c5ccccc35)CC[C@H](C[NH+](C)C)C4)C(=O)NC2=O)c2ccccc21	1
C[NH+](C)C[C@H](OS(C)(=O)=O)[C@H](C[NH+](C)C)OS(C)(=O)=O	2
C[NH2+]CC(=O)N1CCC([N@H+]2CCC[C@H](C(=O)N3CCN(C)CC3)C2)CC1	2
CC1(C)CC(NC(=O)c2ccccc2F)CC(C)(C)[NH2+]1	1
CC(=O)Nc1ccc2[nH]cc(C3=CC[N@@H+](C)CC3)c2c1	1
Cc1cc(N2CCOCC2)ccc1/C=N/n1cnnc1	0
CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1c(C)nn(-c2ccc(F)cc2)c1C	2
C[NH+](C)CCO[C@@H](c1ccc(Cl)cc1)c1ccccn1	1
C[N@H+]1C[C@H]2C[NH2+]C[C@@]2(C(=O)NCCN2N=C(c3ccccc3)CCC2=O)C1	2
CC(C)(C)[NH2+]C[C@@H](O)COc1cccc2c1CCC(=O)N2	1
CCOC(=O)N1CCC([NH2+]C2C3CC4CC(C3)CC2C4)CC1	1
COc1ccc(/C=N/n2cnc3ccccc3c2=O)cc1OC	0
Cc1c(Cl)nc(N2CC[NH2+]CC2)nc1NC(C)C	1
COc1ccc(C[NH+]2CCN(c3ccccc3C)CC2)cc1O	1
COc1cc2c(c(OC)c1OC)-c1ccc(N)c(=O)cc1[C@@H]([NH3+])CC2	1
C=CC[NH+](CC=C)C[C@@H](O)Cn1c2c(c3cc(C)ccc31)CCCC2	1
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(CSc2ccccc2)c1	2
COc1ccc(C(=O)N2CC[NH+](C(C)C)CC2)cc1OC	1
C[NH+](C)CCCN1C(=O)[C@H]2CC3=C(CCCC3(C)C)C[C@H]2C1=O	1
CN1C[C@@H](CC[N@@H+]2CC=C(c3ccccc3)CC2)OC1=O	1
O[C@H](CNc1ncccn1)c1ccccc1	0
CCC[S@](=O)c1ccc2nc(NC(=O)OC)[nH]c2c1	0
CCC[N@H+]1[C@H]2CC[C@@H]1CC(OC(=O)c1ccc(OC)c(OC)c1)C2	1
CCOC(=O)c1cnc2c(C)c(Cl)ccc2c1NCC[NH+](C)C	1
O=S(=O)(Cc1cccc[n+]1Cc1ccccc1)c1ccccc1	1
Cc1cc(C(=O)C[NH+]2CCCCC2)c(C)n1-c1ccc(Cl)c(C(F)(F)F)c1	1
C[N@H+]1CCc2c(sc3c2C(=O)N[C@H](/C=C/c2ccccc2)N3)C1	1
CCN(CC)C(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])o2)C1	1
Cc1cccc([N+]2=C3SCCCN3[C@@](O)(c3ccccc3)C2)c1C	1
Nc1[nH+]c2ccccc2n1Cc1ccc(Br)cc1	1
OCNc1nc2c3ccccc3nc(CC[NH+]3CCCCC3)n2n1	1
COc1cccc(C[NH2+]Cc2ccc(F)cc2)c1OC	1
COc1c(-c2ccccc2)sc2nc(C)cc(C)[n+]12	1
C[NH2+][C@@H](C)C(=O)N(C)C1CC[NH+](CC(=O)N2CCN(C)CC2)CC1	2
COC(=O)c1cn(N)c(=O)c2ccccc12	0
O=C(C[NH+]1CCCCC1)N1CCn2c3c(c4cc(C5CCCCC5)ccc42)CCC[C@@H]31	1
[NH3+][C@@H](Cc1ccccc1)C(=O)N1CCC(Cc2ccccc2)CC1	1
COc1ccccc1N1CCS[C@@H]1C(N)=O	0
CN(C)C(=O)Oc1ccc(OCc2n(C)c3ccccc3[n+]2C)cc1	1
NS(=O)(=O)c1ccc(NC(=O)C[NH2+]C2CCCCC2)cc1	1
CNC(=O)Oc1ccc(-c2c[n+]3cc(NC(C)=O)ccc3n2C)cc1	1
CC[NH+](CC)CC(=O)Nc1c2c([nH+]c3c1CCC3)CCCC2	2
CC(C)[NH+](CCNS(=O)(=O)c1ccc(C[NH3+])cc1)C(C)C	2
Cc1ccc(S(=O)(=O)C[C@H](c2ccccc2)[NH+]2CCCC2)cc1	1
CC(C)(C)c1cc(CCC(=O)N2CC[NH2+]CC2)c(C(C)(C)C)cc1O	1
CC[NH+]1CCN(CCC(=O)Nc2cc(N3CC[NH2+]CC3)cc[nH+]2)CC1	3
O=C(Oc1ccc(Br)cc1)N1CC[NH+]2CCC1CC2	1
COc1ccc(C[N@@H+](CCOC(C)=O)C2CCCCC2)cc1OC	1
CC(C)[NH2+]CCn1c(-c2ccc(Cl)cc2)cn2c3ccccc3nc12	1
CS(=O)(=O)c1ccc(N2CC[NH2+]CC2)c(Cl)c1	1
CC(C)(C)[NH2+]CCn1c(-c2ccc(Br)cc2)cn2c3ccccc3nc12	1
CSc1ccc(C[NH+]2CCC(C(N)=O)CC2)cc1	1
NS(=O)(=O)c1ccc(-n2cccc2/C=N/n2cnnc2)cc1	0
N#Cc1c(NC(=O)C[NH2+]C2CCCCC2)sc2c1CCCC2	1
[NH3+]Cc1ccc(-c2nc3ccccc3n2OC[C@@H]2C[C@@H](O)C[NH2+]2)cc1	2
NC1=[NH+]N2C(=NC(c3ccccc3)=C[C@@H]2c2ccccc2)N1	1
Cc1cc(NC(=O)CC[NH+]2CCCC2)ccc1Br	1
COc1ccc(-c2[nH+]c3ccc(C)cn3c2NC2CCCCC2)cc1	1
N#Cc1cnc(SCC(N)=O)nc1N	0
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccccc1OC	0
c1ccc2c(C[NH2+]Cc3ccc4c(c3)OCO4)c[nH]c2c1	1
CC[NH+](CC)CCO[C@@H]1CC[N@@H+](C[C@@H]2CCCN(C(=O)C[NH3+])C2)C1	3
CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)[C@H](CCSC)NC(C)=O	2
[NH2+]=C1NC(O)=C[C@@H](C(=O)Nc2cccc3ccccc23)S1	1
C[C@@H]1CN(C(=O)COc2ccccc2)C[C@@H](C)O1	0
Cc1n(C)c2ccccc2[n+]1CC(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C	1
NC(=[NH2+])NC(=[NH2+])N(Cc1ccccc1)Cc1ccccc1	2
Cc1nc(SCc2ccc([N+](=O)[O-])cc2)c(C#N)c(C)c1Cl	0
COc1ccc(-c2cc(C(=O)NCCN3CC[NH2+]CC3)nc(C)c2C[NH3+])cc1	2
C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)C(=O)NC12CC3CC(CC(C3)C1)C2	2
NC(=O)C(CCN1CC[N@H+]2CCC[C@H]2C1)(c1ccccc1)c1ccccc1	1
CN(CC[N+](C)(C)C)c1ccc(OCC[N+](C)(C)C)cc1	2
Nc1c(Cl)cc(-c2nn(C3CC[NH+](CCc4ccccc4)CC3)c(=O)o2)c2c1OCCO2	1
C[NH2+]CCC[NH2+]Cc1cccc(OCc2ccccc2F)c1	2
COc1c2c(nc3ccccc13)O[C@@H]([C@@](C)(O)CO)C2	0
CC(=O)Nc1c(NC(C)=O)n(C)c(=O)n(C)c1=O	0
C[C@@H]1C[N@@H+](CCO)CCN1C(=O)NCCN1CCC([NH+](C)C)CC1	2
CC(C)(C)[NH2+]C[C@H](O)COc1ccc(NC(=O)NC2CCCCC2)cc1	1
CN1CCC([N@@H+]2CC[C@@H](NC(=O)[C@@H]3CC(=O)N(CC[NH+](C)C)C3)C2)CC1	2
Cc1ccc([C@@H]2[C@H]3C[N@@H+](C)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1	1
NC(=O)C1CCN([C@@H]2[C@@H](O)[C@H]([NH2+]Cc3ccc(F)cc3)[C@H]3CO[C@@H]2O3)CC1	1
C1COCC[NH+](CCOCC[NH+]2CCOCCOCCOCC2)CCOCCO1	2
Cc1cnc2c(NCC[NH+]3CCCCC3)nc3cc4ccccc4cc3n12	1
CC(C)(C)[NH2+]C[C@@H](O)COc1cc(Cl)ccc1C1=CC(=O)CC1	1
CCN(CC)C(=O)[C@@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2)C1	1
CC(C)[NH2+]Cc1cccc(OCCOc2nccnc2N2CC[NH2+]CC2)c1	2
CCOc1ccc(C[NH+]2CCC(C(=O)NC(C)(C)C)CC2)cc1	1
CCC(CC)Sc1nc2cc(N3CC[NH2+]CC3)c(Cl)cc2[nH]1	1
C[C@@H](Oc1cncc(N2CC[NH2+]CC2)n1)c1cccc(F)c1	1
COc1ccccc1OCc1ccc(C(=O)NCC[NH+](C)C)o1	1
C[C@@H]1C[C@H](C[NH3+])CN1C(=O)C[C@]1(C(=O)N2C[C@@H](C[NH3+])C[C@H]2C)CC[NH2+]C1	3
COc1ccc(C[NH2+]Cc2cccnc2)c(OC[C@@H](O)C[NH+]2CCCCCCC2)c1	2
Cn1c(N)c(N)c(=O)n(C)c1=O	0
C[NH+](C)CCC[NH2+]Cc1cccc(OCc2ccc(F)cc2)c1	2
CC[C@]12CCC[N@H+]3CC[C@]4(C(=C(C(=O)OC)C1)Nc1ccccc14)[C@@H]32	1
CCOc1ccccc1N1CC[NH+](C2CCN(C)CC2)CC1	1
COc1cc2c(cc1C[N@H+]1CCC[C@H](c3nnc4n3CC[NH2+]CC4)C1)OCCO2	2
C[NH+](C)CCOC(=O)C12CC3CC(C1)CC(C(=O)OCC[NH+](C)C)(C3)C2	2
O=C1[C@H]2CC(Cl)=CC[C@H]2C(=O)N1CC[NH2+]C1CCCCC1	1
CC[NH+]1CCC(NC(=O)CN2CC[NH+](Cc3cccs3)CC2)CC1	2
Cn1c(NCc2ccc3c(c2)OCO3)[nH+]c2ccccc21	1
CCOC(=O)N1CC[NH+](CCN2CCn3c2nc2ccccc23)CC1	1
COC[C@@H](C)NC(=O)NC(=O)C[NH+]1CCC(C[NH+]2CCOCC2)CC1	2
C[NH+](C)CCN(Cc1ccsc1)c1ccccn1	1
Cc1nc2nc(S(N)(=O)=O)nn2c(C)c1C	0
CC[N@H+]1CCC[C@@H]1CN1C[C@H](C(=O)NCCN2CC[NH+](C)CC2)CC1=O	2
COc1cc([C@@H]2[NH2+]CCc3c2[nH]c2ccccc32)ccc1O	1
COc1ccc(C[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1	2
CSC1=[NH+]CCN1CC(=O)c1ccc(Cl)cc1	1
OC[C@@H](O)[C@H](O)[C@@H](O)c1cnn(-c2ccccc2)n1	0
C[C@@H](CN1c2ccccc2Sc2ccccc21)C[NH+](C)C	1
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1CCCC1	0
COc1ccccc1[C@H]1[C@H]2CCCC[C@@]2(O)CC[N@H+]1CC(N)=O	1
CCC(=O)O[C@]1(c2ccccc2)C[C@@H](C)[N@@H+](C)C[C@@H]1C	1
CCOC(=O)[C@@H](C#N)[C@@]1(Cc2ccccc2)C[C@H](C)[N@@H+](C)C[C@@H]1C	1
C[C@@H]1C[N+]2(CCCCC2)C[C@@](O)(c2ccc3ccccc3c2)O1	1
COCC(=O)N1CC[C@@H](c2cc(N3CC[NH+](C)CC3)cc(C)[nH+]2)C1	2
CC(C)CCn1c(NCC[NH+](C)C)nc2ccccc21	1
O=c1[nH]c2ccc(C#CC[NH+]3CCC(Cc4ccccc4)CC3)cc2[nH]1	1
O=c1cc(N2CCOCC2)oc2c(OCc3cccnc3)cccc12	0
COc1ccc(-c2cc(C#N)nc(N3CC[NH+](C)CC3)n2)cc1	1
NC1=[NH+]C[C@H](CCCC[NH3+])N1CCc1cccc2ccccc12	2
CC1(C)CC(OC(=O)CC[NH+]2CCCCC2)CC(C)(C)[NH2+]1	2
C[NH+](C)CCC[C@@H]1C(=O)[C@H](c2ccccc2)N(c2ccccc2)C1=O	1
CC(C)(C)NC(=S)NC1CC[NH+](Cc2ccccc2)CC1	1
C[C@@H]1CCCC[N@H+]1CCNC(=O)[C@H]1CCCN(S(C)(=O)=O)C1	1
O=C(NCCc1nc(-c2cccnc2)no1)[C@@H]1CC2(CC[NH2+]CC2)C[NH2+]1	2
COC(=O)[C@H]1C[N@@H+](C)CC[C@]1(C)OC(=O)Oc1ccccc1	1
CN(C)c1ccc(C(=[NH2+])c2ccc(N(C)C)cc2)cc1	1
C[NH+]1CCN(/N=C/c2nc(-c3ccccc3)n3ccccc23)CC1	1
Nn1nnnc1Nc1ccccc1	0
COc1ccc(Cc2c(Cl)nc(SC)[nH+]c2NN)cc1	1
Cn1c(CN2CC[NH+](C)CC2)nnc1C1CC[NH+](C[C@@H]2[C@H]3C[NH2+]C[C@H]32)CC1	3
Cn1cc([C@@H](CN2C(=O)c3ccccc3C2=O)[NH+](C)C)c2ccccc21	1
CCOC(=O)Cn1c2cccc3cccc(c32)[n+]2nc3c(cc12)c1cccc2cccc3c21	1
CNS(=O)(=O)Cc1ccc2[nH]cc(CC[NH+](C)C)c2c1	1
Cc1cccc(CN2CCC[C@@](O)(C[NH2+]CCN3CC[NH2+]CC3)C2=O)c1	2
CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](C(N)=O)C2)cc1	1
O=C(C[C@@H]1C(=O)NCC[N@H+]1C1CCCC1)NCC1CC[NH+](Cc2ccccc2)CC1	2
Oc1ccc2c(c1)OC[C@H]([NH+]1CCC(O)(c3ccc(F)cc3)CC1)[C@@H]2O	1
O=C(Nc1c2c([nH+]c3c1CCC3)CCCC2)C1CCCCC1	1
O=S1(=O)c2cccc3cccc(c23)N1CCC[NH+]1CCN(c2ccc(F)cc2)CC1	1
Cc1ccc(CN(c2ccc(C(=O)N3CC[NH+](C)CC3)cc2)S(C)(=O)=O)cc1	1
CNS(=O)(=O)CCc1ccc2[nH]cc(C3CC[NH+](C)CC3)c2c1	1
C[NH+]1CCN(c2ncc(C[NH2+]CCN3CC[N@@H+](C)C(C)(C)C3)cn2)CC1	3
CN(Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC[NH+](C)CC1	1
CN1CC[NH+](Cc2ccc(C(=O)Nc3cnn(CC[NH+](C)C)c3)cc2)CC1	2
CC[NH+](CC)CCC[C@@H](C)Nc1[nH+]c2ccccc2n1C	2
CC[NH+]1CCN(C(=O)c2ccc3c(c2)NC(=O)CS3)CC1	1
CC1(C)NC(=[NH2+])NC(=[NH2+])N1c1cccc(OCc2cccc(N)c2)c1	2
NC(=O)c1ccc(N2C(=O)C=CC2=O)cc1	0
C#CC[N+](CC)(CC)CC#CCC[N+](CC)(CC)CC#C	2
[NH2+]=C(NCCN1CC[NH+](Cc2ccccc2)CC1)NC[C@@H]1CCCO1	2
COc1ccc(OC[C@@H](O)C[NH2+]CCC[NH+](C)C)c(C(C)(C)C)c1	2
CCc1cc2c(C)cc(=O)oc2c(C[NH+](CC)CC)c1O	1
O=C(Cc1ccc(C2=[NH+]CCN2)cc1[N+](=O)[O-])c1ccc(C2=[NH+]CCN2)cc1	2
C[C@H]1C[N@H+](C2(C(=O)N(C)CCC[NH+]3CCCC3)Cc3ccccc3C2)C[C@@H](C)O1	2
CC[NH+]=C(NC[C@@H]1C[NH+]2CCN1CC2)N[C@@H]1CCc2nc(C(C)C)nn2C1	2
CC1(C)NC(=[NH2+])NC(=[NH2+])N1CCCCc1ccccc1	2
O=C(CN1C(=O)c2ccccc2C1=O)NCc1ccco1	0
C[C@@H]1CCC[N@@H+](CCS(=O)(=O)c2ccccc2)C1	1
CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(N2CCCC2=O)cc1	1
CC(=O)N1CCc2cc(NC3CC[NH+](Cc4ccccc4)CC3)ccc21	1
C[N+](C)(C)/C=C/C(=O)c1ccc(Br)cc1	1
Cc1cccc([N+]2=C3SCCCN3[C@@](O)(c3cccs3)C2)c1	1
CCN1CCN(c2ccc(NC(=O)C(C)C)cc2Cl)CC1	0
COc1ccc2c3c1O[C@@H]1C[C@H](O)C=C[C@@]31CC[N@H+](C)C2	1
NOCC1(Nc2ccccc2)CC[NH+](Cc2ccccc2)CC1	1
CC(C)[NH2+]C[C@@H](O)COc1cccc2ccccc12	1
CC(=O)Nc1ccc(S(=O)(=O)N(C)CCO)cc1	0
C[NH+](C)CC(=O)N1c2ccccc2Sc2ccccc21	1
O[C@@](C1=[NH+]CCN1)(c1ccc(Cl)cc1)c1ccccn1	1
C[NH+](C)CC(C)(C)CNC(=O)C1CC[NH+](C[C@@H]2CC=CCC2)CC1	2
COc1ccc(-n2cc(C[NH2+]C3CC[NH+](C)CC3)c(-c3cccc(F)c3)n2)cc1	2
Nc1nccc(-c2c(-c3ccc(F)cc3)ncn2C2CC[NH2+]CC2)n1	1
C[C@@H]1OC(C)(C)[NH2+][C@@H]1CNC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C	3
CC(C)[N@@H+](C)CC(=O)Nc1ccc(CC(=O)N2CC[NH+](C)CC2)cc1	2
NC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH+]2CCCC[C@@H]2C(N)=O)cc1	2
COc1ccc(C2=[NH+][C@@H](c3ccc(OC)cc3)[C@H](c3ccc(OC)cc3)N2)cc1	1
C[NH+](C)CCCNc1c2ccccc2[nH+]c2ccc(F)cc12	2
COc1ccc(C2=C(C[NH+](C)C)[C@@H](c3ccccc3)c3ccccc3O2)cc1	1
C[C@@](O)(CNC(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1)C[NH+]1CCOCC1	2
[NH3+]CCC[NH2+]CCOc1ccc(Cl)cc1Cc1ccccc1	2
CN(O)C(=O)CCc1ccc2c(c1O)C(=O)c1c(O)cccc1C2	0
C[NH+](C)CC1=CC(=NNc2ccccc2)C=C(C[NH+](C)C)C1=O	2
Cn1c(N)c(C=O)c(=O)[nH]c1=O	0
OC[C@@H]1CCC[N@H+]1C1CCN(CCc2ccccc2)CC1	1
Cn1c[n+](NC(=O)c2ccc(-c3ccc(C(=O)N[n+]4cnn(C)c4)cc3)cc2)cn1	2
C[NH+](C)CCCNCc1cc(Cl)ccc1OC[C@@H](O)C[NH+]1CCCCCC1	2
C=CCc1cccc(CNc2nc3ccccc3n2CC[NH+]2CCOCC2)c1O	1
Clc1ccc(CC[NH2+]C2CCN(Cc3ccccc3)CC2)cc1	1
C=CCN(CC=C)C(=O)Cc1ccc(Br)cc1	0
C=CCN(CC=C)C(=O)COc1ccccc1	0
NC(=[NH2+])c1cccc(NC(=O)Nc2cccc(C(N)=[NH2+])c2)c1	2
Fc1ccc(Sc2c(F)c(F)nc(N3CC[NH2+]CC3)c2F)cc1	1
CCn1c[n+](C[C@@H](O)COc2ccc(F)cc2)c2cc(C)c(C)cc21	1
CC[N@H+]1CCN(C)C[C@H](NC(=O)c2cc(Cl)c(NC)cc2OC)C1	1
C[NH+](C)CCNc1ncnc2scc(-c3ccccc3)c12	1
O=C(NC1CC[NH+](C2CC2)CC1)N1CCC(C[NH+]2CCOCC2)CC1	2
COC(=O)C1CC[NH+](C[C@H](O)COc2cccc(C[NH2+]C3CCC3)c2)CC1	2
CC(C)C[NH+]1CCO[C@@H](CNC(=O)C[N@@H+](C)CCc2ccccc2)C1	2
COc1ccc([C@@](C#N)(CCC[NH+]2CCN(C(=O)c3ccco3)CC2)C(C)C)cc1OC	1
[NH3+]CCc1cccc2c1ccn2S(=O)(=O)c1ccccc1	1
O=C1C[C@@H]([NH+]2CCCCC2)C=C1Nc1ccc(F)cc1	1
O[C@H](CO/N=C(\Cl)c1cccnc1)C[NH+]1CCCCC1	1
CN(C)c1ccc([C@@H](c2cc3c(cc2O)OCO3)[NH+]2CCCC2)cc1	1
O=C(NCc1cccnc1)[C@H]1CCC[N@H+](C2CC[NH+](CC3CC3)CC2)C1	2
[NH3+][C@@H](CC(=O)[O-])c1cccn1-c1ccc([N+](=O)[O-])cc1	0
Cc1ccc2c(c1)c1c3n2CCN(C[C@H](O)C[NH2+]CCC[NH+](C)C)[C@H]3CCC1	2
S=C1N=NC(c2ccccn2)N1Cc1ccccc1	0
Clc1ccc(-c2noc(CSC3=[NH+]CCN3)n2)cc1	1
CC[NH+](CC)CCNC(=O)c1cc(Cl)c(N)cc1OCC1=[NH+]CCN1	2
CCC[NH+]1CC[C@@H](CNC(=O)NC[C@H](O)C[N@H+]2CCc3ccccc3C2)C1	2
COc1cccc(CN2CCC([NH+]3CCC(C)CC3)CC2)c1OC	1
C[NH+](C)[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1	1
CC[NH+](CC)Cc1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1	1
CCOC(=O)C1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1	1
C[C@H]([NH2+]C[C@@H](O)COc1ccccc1)[C@@H]1COc2ccccc2O1	1
c1ccc(CCC2CC[NH+](Cc3c[nH]c4ncccc34)CC2)cc1	1
C[N@H+]1CCC[C@@H](OC(=O)C(c2ccccc2)c2ccccc2)C1	1
Cc1ccc(-[n+]2cc(-c3ccc(Br)cc3)n3c2CCC3)cc1	1
CCOc1ccc(-c2cn(-c3ccc(OC)cc3)c3[n+]2-c2ccccc2CC3)cc1	1
O=C(O[C@@H]1C[NH+]2CCC1CC2)C(CO)(c1ccccc1)c1ccccc1	1
CSc1nnc(SC)n1NC(=[NH2+])c1cccc(C(F)(F)F)c1	1
C[NH+]1CCC(NC(=O)Nc2cccc(C[N@H+]3CCC[C@@H]3C(N)=O)c2)CC1	2
CCc1n(C)c2ccccc2[n+]1C[C@@H](O)COc1ccc(F)cc1	1
C=CC[NH+](CC=C)C[C@@H](O)CN1c2ccccc2Sc2ccccc21	1
Cn1c(=O)n(C)c2cc(S(N)(=O)=O)ccc21	0
COc1ccc(C(=O)Nc2ccccc2C(C)C)cc1OC	0
C[N+](C)(C)CCNC(=O)CCC(=O)NCC[N+](C)(C)C	2
C[C@@H]([C@@H](O)c1ccccc1)[N+](C)(C)Cc1ccccc1	1
c1ccc(COc2ccnc(N3CC[NH2+]CC3)n2)cc1	1
O=C(C[NH+]1CCC(C[NH+]2CCCC2)CC1)NCCOc1ccccc1	2
Cc1ccc([C@@H]2SCC(=O)N2CC[NH+]2CCCCC2)cc1	1
CCc1ccc(OCc2ccccc2C(=O)Nc2ccc3[nH+]c(C)cc(N)c3c2)cc1	1
CC[N+](CC)(CC)C[C@@H](O)Cn1c(=O)sc2ccccc21	1
COc1cc(C(=O)NCc2ccc(C)[nH+]c2N)cc(OC)c1OC	1
Nc1cc(N)[nH+]c(SCc2noc(-c3ccc(Cl)cc3)n2)n1	1
[NH2+]=c1ccn(C/C=C/C[n+]2ccc(/C=N/O)cc2)c2ccccc12	2
C[NH+](C)CCCc1cc(C(=O)Nc2ccc(-c3ccncc3)cc2)ccc1O	1
C[C@@H](C[NH+]1CCCC1)OC(=O)c1ccccc1Br	1
OCC[NH+](CCO)Cc1ccc(F)c(Br)c1	1
Cc1cccc(N2CC[NH+](CCCNC(=O)CN3CC[NH+](C)CC3)CC2)c1	2
COc1cccc(NC(=S)N(C)C2CC[NH+](C)CC2)c1	1
CCc1ccccc1N1CC[NH+](CCc2cc(OC)c(OC)c(OC)c2)CC1	1
COC(=O)c1cc(N2CC[NH2+]CC2)nc2ccccc12	1
CCN(CC)C(=O)N[C@@H]1C[C@H]2c3cccc4[nH]cc(c34)C[C@@H]2[N@@H+](C)C1	1
CCOC(=O)c1ccc(S(N)(=O)=O)o1	0
C[C@@H]1CCCC[N@H+]1CCCNC(=O)NCCC(=O)N1CC[NH+](C)CC1	2
CCCn1c(=O)c2nc(C3CCCC3)[nH]c2n(CCC)c1=S	0
CCN1CCN(C(=O)C2CC[NH+](C[C@@H](C)c3ccccc3)CC2)CC1	1
CC[NH+]1CCN(CC(=O)N2CC[C@@]3(CCC[N@@H+](CC4CC4)C3)C2)CC1	2
C[NH+]1CCC(Oc2ccccc2Sc2ccc(C(F)(F)F)cc2)CC1	1
COc1ccc2c(C)c(C(=O)OCC[NH+](C)C)oc2c1	1
O=c1n(CCC[NH+]2CCN(c3cccc(Cl)c3)CC2)nc2ccccn12	1
C[N@@H+](Cc1ccccc1)C1CCN(C(=O)Cc2ccccc2)CC1	1
CN(C(=O)C[C@@H]([NH3+])CCCC[NH3+])[C@@H]1CN=C(Nc2ncccn2)NC1=O	2
O=C(CN1C2=NCCN2c2ccccc21)c1ccc(Cl)cc1	0
COc1ccccc1CC[NH2+]Cc1c(C(=O)N2CCC[N@@H+](C)CC2)nc2sccn12	2
COc1cc(C(=O)N[C@@H]2CCC[NH2+]C2)cc(OC)c1OC	1
C=CC[N@@H+]1CC[C@@]23c4c5ccc(O)c4O[C@@H]2C(=O)CC[C@]3(O)[C@@H]1C5	1
CC(C)COc1ccc(Cc2c[nH+]c(N)nc2N)cc1	1
C=CC[C@H](Cc1cc(OC)c(OC)c(OC)c1)[NH2+]C	1
[NH3+]CCC(=O)N1c2ccccc2Sc2ccc(C(F)(F)F)cc21	1
Cc1cccc(C[N@@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@@H](CCO)C2)n1	2
Cc1nc2n(c(=O)c1CC[NH+]1CCC(c3noc4cc(F)ccc34)CC1)CCCC2	1
O=C(CN1N=C(c2ccccc2)CCC1=O)NCC[NH+]1CCCC1	1
O=C1Cc2cc(CC[NH+]3CCN(c4nsc5ccccc45)CC3)c(Cl)cc2N1	1
CC[NH+]1CCN(C(=O)CC2CC[NH+](C[C@@H](O)Cn3cccn3)CC2)CC1	2
NS(=O)(=O)c1ccc(NC(=O)C[NH2+]CCCN2C=[NH+]CC2)cc1	2
CN1C(=O)CC2(CC[NH+](CCCC(=O)c3ccc(F)cc3)CC2)C1=O	1
CCN1C[C@H]2C[N@@H+](C)C[C@@H](C1)C2OC(=O)c1ccc(Cl)cc1	1
CC1CC[NH+](CC(=O)Nc2sc3c(c2C(N)=O)CCC3)CC1	1
C[N@H+]1CC[C@]2(OC(=O)c3ccc([N+](=O)[O-])cc3)CCCC[C@@H]2C1	1
CC[NH+](CC)CCOc1cc2oc(=O)cc(C)c2cc1OCC[NH+](CC)CC	2
CC[NH+](CC)CCC[NH2+]Cc1cccc(Br)c1	2
C[NH+](C)C[C@@](C)(O)CNC(=O)NCc1ccc(N2CC[NH+](C)CC2)nc1	2
CC(C)[N@@H+](C)CC(=O)NC[C@@H](C)[NH+]1CCN(c2ccccc2)CC1	2
COc1cc(NCc2ccc3[nH+]c(N)nc(N)c3c2C)cc(OC)c1OC	1
C[N@H+]1[C@H]2CC[C@@H]1CC(NC(=O)c1ccc(Cl)cc1)C2	1
CCC[NH+](CCC)C[C@@H](O)CN1C(=O)NC(C)(C)C1=O	1
c1ccc(Cn2c(CNc3nc4ccccc4n3CC[NH+]3CCCCC3)nc3ccccc32)cc1	1
Cn1c(=O)c2c(ncn2CC(=[NH2+])N2CCCCC2)n(C)c1=O	1
CCN1C(=O)N(CC[NH+](C)C)C(=O)C12CC[NH+]([C@@H]1CCSC1)CC2	2
C[NH+](C)CCn1cnc2sc3c(c2c1=O)CC[C@@H]([NH2+]Cc1ccc(F)cc1F)C3	2
Cc1ccc(CNc2nc3ccccc3n2CC[NH+](C)C)o1	1
CC(=O)Nn1cnc(=O)c(C#N)c1	0
CC(C)(O)[C@H]1OC2=C(C(=O)c3ccccc3C2=O)[C@@H]1O	0
CCOC(=O)c1c2c(cc3sc(C)c(C)[n+]13)-c1cccc3cccc-2c13	1
O=S(=O)(Cc1ccccc1)C[C@@H]1CO1	0
C[C@@H]1COC(=O)C(=NNc2ccccc2)N1	0
C[n+]1c(COc2ccccc2O)sc2ccccc21	1
Cc1ccc2cc(C[NH2+]CCC[N@H+]3C[C@@H]4C=C[C@H]3C4)c(N3CCC(O)CC3)nc2c1	2
CC[N+](CC)(CCO)CCCN1C(=O)[C@@H]2CC=C(Cl)C[C@H]2C1=O	1
CCC[NH+]1CCC(NC(=O)N2CCN([C@@H](C)C(=O)NC3CC3)CC2)CC1	1
Cc1c(C[N@@H+]2CCCC[C@@H]2C)c(=O)n(-c2ccccc2)n1C	1
O=C1C[C@H]([NH2+]Cc2ccco2)C(=O)N1CCc1ccccc1	1
CCOC(=O)N1CCC([NH2+]CCc2c[nH]c3ccccc23)CC1	1
COc1cccc(NC(=O)CC[NH+]2CCCCCC2)c1	1
CC(C)(C)OC(=O)NCC1CC[NH+](Cc2ccccc2)CC1	1
CC1(C)CC(NC(=O)NC2CCCCC2)CC(C)(C)[NH2+]1	1
C[NH+](C)CCc1nc(N2CC[NH2+]CC2)c2ccccc2n1	2
Nc1cc(N)[nH+]c(SCc2c(Cl)cccc2Cl)n1	1
COc1ccc(C2=[N+]3CCCCN3[C@@](O)(c3ccc(OC)cc3)C2)cc1	1
CCc1ccc(NC2=NC(=O)C[C@@H](C(=O)c3ccccc3)N2)cc1	0
Cc1[nH+]ccn1CCCN1C(=O)OC(C)(C)[C@@]1(C)O	1
C[NH+](C)CCCn1ccc2nc(N3CC[NH+](C)CC3)ncc2c1=O	2
C[C@H](CC[NH+](C)C)Nc1cc(O)cc2cccnc12	1
Brc1ccc(OCC[NH+]2CCCC2)cc1	1
C1C[NH+](C[C@@H]2CO2)CCC1C1CC[NH+](C[C@@H]2CO2)CC1	2
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](C)C1	1
CC[C@]1(c2ccccc2)NC(=O)N(c2nccs2)C1=O	0
CCOC(=O)Cn1c2ccccc2n2nc(C)c(=O)nc12	0
CCOc1ccc2c(c1)Sc1ccccc1N2CC[NH+](CC)CC	1
C[NH+](C)CCNC(=O)C(=O)Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1	2
COc1ccccc1N(C(=O)c1ccccc1)[C@H]1C[NH+]2CCC1CC2	1
N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccccc2)[C@H]2C[NH2+]CC=C12	1
CCOC(=O)COc1ccc2c(C)c(CC[NH+](CC)CC)c(=O)oc2c1Cl	1
COc1ccc(C[NH2+]CC2(c3ccccc3)CCCC2)cc1OC	1
COc1ccccc1N1CCN(CCn2cnc3sc4c(c3c2=O)CC[N@H+](C)C4)CC1	1
Cc1ccc(C[n+]2c3n(c4ccccc42)C[C@@H](O)CS3)cc1	1
C[C@H](C[NH2+]C1CCCCC1)OC(=O)c1ccccc1	1
O[C@@H]1C[N@@H+](C2CCOCC2)CC[C@H]1N1CC[NH+](CCc2ccccc2)CC1	2
CC[NH+](CC)CCn1nc2c3ccccc3sc3c(C[NH3+])ccc1c32	2
O=[N+]([O-])c1cc2c(cc1CN1CCC([NH+]3CCCCC3)CC1)OCO2	1
CC1=NN(c2ccccc2)[C@H]2c3ccccc3[N+](=O)C(C)[C@@H]12	1
O=C(CN1CC(=O)[O+]=N1)N[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2)C1	2
CC(=O)Nc1ccc(-c2c[n+]3cc(Sc4ccccc4)ccc3n2C)cc1	1
CC(C)[N@@H+](C)C1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	1
OCCN1CC[NH+]([C@@H]2CC[C@@H]3CC[C@H]2c2ccccc23)CC1	1
COc1ccc(Br)cc1C[N@H+]1CCC[C@@H](CO)C1	1
Cc1ccc(N(CC2=[NH+]CCN2)c2cccc(O)c2)cc1	1
C[C@@H](C(=O)Nc1cc(-c2ccccc2)nn1-c1ccccc1)[NH+](C)C	1
CCOC(=O)C1CC[NH+](C/C=C/c2ccccc2OC)CC1	1
COc1cc(OC)c(C[N+](=O)C(C)(C)C)c(OC)c1	1
CC(=O)O[C@@H](C[N+]1(C)CCCCCC1)c1ccccc1	1
Cc1cc(C)c(NC(=O)[C@@H]2CCC[N@H+]2CCO)c(C)c1	1
c1ccc(C[NH+]2CCN(c3ncnc4ccccc34)CC2)cc1	1
CCOC(=O)C(CC[NH+](C)C)(CC[NH+](C)C)c1ccccc1	2
Nc1nccc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@@H]1O	0
CS(=O)(=O)c1cc(Cl)ccc1N1CC[NH2+]CC1	1
COc1ccc(CCNc2cc(C)[nH+]c(N)n2)cc1OC	1
CC(=O)c1cccc(N2C(=O)[C@@H]3[C@H]4C=C[C@](CO)(O4)[C@@H]3C2=O)c1	0
Cc1cc(Nc2ccc3c(c2)OCCO3)c2ccc(Cl)cc2[nH+]1	1
Cc1ccc(S(=O)(=O)N2CCC([NH+]3CCCCCC3)CC2)cc1	1
CC(C)CNC(=O)NC(=O)[C@@H](C)[NH+]1CCC(C[NH+]2CCOCC2)CC1	2
O=C(NCC[NH+]1CCCC1)[C@@H]1CC(=O)N(C2CCCCC2)C1	1
OC[C@@H]1CCCC[N@H+]1Cc1cc(Br)cs1	1
CC[NH+]1CCO[C@@H](C(=O)Nc2ccccc2C[N@H+]2CCC[C@H](C(N)=O)C2)C1	2
CN1CCN(C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1	1
CCc1ccc(NC2=[NH+][C@@H](C(=O)NC3CCCCC3)C=C(O)N2)cc1	1
C[NH+](C)CCOC(=O)[C@@]1(C#N)CC2c3ccccc3C1c1ccccc12	1
C=C(C)c1cccc(C(C)(C)NC(=O)N2CC[NH+](CC)CC2)c1	1
COc1ccccc1-n1cc(-c2ccccc2)[n+]2c1SC[C@@]2(O)c1ccccc1	1
Cc1cc(N2CCN(C(=O)C[NH+]3CCCC3)CC2)cc([C@@H]2CCC[NH2+]2)n1	2
Cc1ccccc1NC(=S)N(C(C)C)C1CC[NH+](C(C)C)CC1	1
O=C(c1ccccc1F)N1CC[NH+](C2CCCCCC2)CC1	1
C[NH+](C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccccc3C[NH+](C)C)c(=O)n1C2	2
O=C(Nc1ccc(F)cc1)N1CC[NH+](CCc2ccccc2)CC1	1
CCn1c(=O)c2ccccc2n(-c2cccc([N+](=O)[O-])c2)c1=O	0
O=C(CC[NH+]1CCC(CCC[NH+]2CCOCC2)CC1)N1CC[NH2+]CC1	3
CCC[NH+]1CCN(Cc2nc3nc(C)cc(N4CC[NH+](C)CC4)n3n2)CC1	2
C[NH+](C)CCC(=O)C(=Cc1ccco1)C(=O)CC[NH+](C)C	2
CC[NH+]1CCN(C(=O)c2cc(-c3ccc(C(C)C)cc3)nc3ccc(Br)cc23)CC1	1
Cc1nnc(NC(=O)COC(=O)c2ccco2)s1	0
C[C@@H](C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1)[N@@H+](C)CC1CC1	2
Cc1nnc(SCC(=O)Nc2ccc(F)cc2)s1	0
COC(=O)c1ccn(C(=O)c2ccnn2C)n1	0
COc1cccc(C(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)c1	0
C[NH+]1CCN(c2ncnc3c2cnn3Cc2ccccc2)CC1	1
C#CC[N@H+](C)C[C@H]1CN2CC[C@H]1C[C@@H]2CNC(=O)c1ccc(N(C)C)cc1	1
COc1ccc(CC[C@@H]2[NH2+]CCn3cccc32)cc1OC	1
O=[N+]([O-])c1cccc(S(=O)(=O)CCO)c1	0
C#CC[N@H+](C)C[C@H]1CN2CC[C@H]1C[C@@H]2CNS(=O)(=O)c1ccc(OC)cc1	1
COC(=O)COc1ccc(C[C@@H](C)[NH2+]C[C@H](O)c2cccc(Cl)c2)cc1	1
Cc1cc(C)c(NC(=O)[C@@H]2CCCN2CCC[NH+](C)C)c(C)c1	1
O=C1C[C@@H]([NH2+]CCc2ccccc2F)C(=O)N1c1ccc(Cl)cc1	1
[NH3+]CCc1c[nH]c2c(OCc3ccccc3)cccc12	1
c1ccc(C[NH+]2CCC(n3nnc4cccnc43)CC2)cc1	1
COc1cccc(CN2CCC([NH+]3CCCCCC3)CC2)c1	1
Cc1cc(C)c(NC(=O)CC[NH+]2CCCCC2)c(C)c1	1
Cc1cc(NC(=O)C[NH+]2CCCCC2)n(-c2ccccc2)n1	1
CC[N@H+]1CCC[C@@H]1CNC(=O)CCC1CC[NH+](CCCn2cccn2)CC1	2
C[NH+](C)C[C@@H]1CCCCCCCCC[C@@H](C[NH+](C)C)C1=O	2
CCCC(=O)Nc1ccc(Oc2cccc(F)c2)cc1	0
Cc1nc(N2CCC[N@H+](C)CC2)c2c3c(sc2n1)CCC3	1
CCOc1cccc(N2C(=O)C[C@H]([NH+]3CCCCC3)C2=O)c1	1
CC(C)n1c(=O)[n+](C)c(-c2ccccc2)c2cc3c(cc21)OCO3	1
O=C(NCC[NH+]1CCCC1)c1sc2ccccc2c1Cl	1
C[N+]1(CCN[N+]2(C)CCCCC2)CCc2ccccc2C1	2
O[C@@H](COc1ccc(Br)cc1)C[NH+]1CCN(Cc2ccc(Cl)cc2)CC1	1
COc1cc(N)c(Cl)cc1C(=O)N[C@@H]1CC[NH2+]C[C@@H]1OC	1
c1ccc(-n2nnnc2SCC[NH+]2CCCCC2)cc1	1
c1ccc2c(N3CCOCC3)cc(-c3ccncc3)[nH+]c2c1	1
C=C(C(=O)OC1C[C@@H]2CC[C@H](C1)[N@H+]2C)c1ccccc1	1
C[NH+](C)CCOc1ccccc1-c1nc(-c2ccccc2)c(-c2ccccc2)[nH]1	1
COC(=O)C1=C(C)N(Cc2ccco2)C(=O)C1	0
Cc1cc(C=C2NC(=O)[N-]C2=O)c(C)n1-c1cc[nH+]cc1	0
CC[NH+](CC)CCN1C(=O)[C@@H]2C[NH2+]C[C@]2(C)NC(=O)c2ccccc21	2
COc1ccc(CC[NH+]2CCN(c3ccc(C)c(C)c3)CC2)cc1OC	1
COc1cc2c(cc1OC)C[N@@H+](C[C@@H](O)COc1ccccc1)CC2	1
C[NH+](C)C1CCN(CCNC(=O)NC[C@@H]2C[N@H+]3CCCC[C@@H]3CO2)CC1	2
COc1ccc(F)c([C@@H]2NC(=O)CC[C@H]2[NH2+]Cc2ccc(C[NH+](C)C)cc2)c1	2
CC(C)(C)[C@H](C[NH+]1CCCC1)OC(=O)c1ccccc1	1
O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(Cc2ccccc2)CC1	1
C[NH+](C)CCn1c(N)c(C#N)c2nc(C#N)c(C#N)nc21	1
C[C@H](CCc1ccccc1)[NH+]1CCN(c2ccccc2F)CC1	1
CCc1ccc2[nH]c(C(=O)NCC[NH+]3CCCCC3)cc2c1	1
C[NH+](C)CCn1nc(Cc2ccccc2)c2ccccc2c1=O	1
CCC[NH+]1CCC(N2CCN(c3ccc(F)cc3)CC2)CC1	1
C[N+]12CCC(CC1)[C@H](CN1c3ccccc3Sc3ccccc31)C2	1
CC(C)[C@@H](C(=O)NC1CC[NH+](CC(=O)N(C)C)CC1)[NH+]1CCCCC1	2
CC(C)c1cc(N2CC[NH+](C)CC2)n2c(nc3ccccc32)c1C#N	1
CN(C(=O)C[NH+]1CCCCC1)C(C)(C)C(=O)c1ccccc1Cl	1
CNC1=[NH+]c2ccc(Cl)cc2C(c2ccc[nH]2)=NC1	1
C[C@]12C[NH2+]C[C@](C)(CN(Cc3cccc(Br)c3)C1)C2	1
COC(=O)C1=CO[C@H](C)[C@H]2C[N@H+]3CCc4c([nH]c5ccccc45)[C@H]3C[C@@H]12	1
C[NH+](C)C1(CNC(=O)NCC2([NH+]3CCCC3)CCOCC2)CCOCC1	2
Nc1n[nH]c(NCc2ccco2)n1	0
COc1ccc(C(=O)c2c(NC(C)=O)sc3c2CC[NH2+]C3)cc1	1
Cc1nc(NCC[NH+](C)C)c2c3c(sc2n1)CCCC3	1
C=CC[N+]1(CC(=O)OC)CC[N+](CC=C)(CC(=O)OC)CC1	2
COc1ccc(C/[NH+]=C/c2ccc(NC(C)=O)cc2)cc1	1
NS(=O)(=O)c1ccc(NCc2ccccc2)cc1	0
CN(C)C(=O)Oc1ccc[n+](Cc2ccccc2)c1	1
CCCC[C@@H](CC)C[NH2+]Cc1cccn1CC[NH+]1CCOCC1	2
COc1ccc2c(c1)c(C(=O)C[NH+]1CCCCC1)c(C)n2C	1
Cn1c(=O)c2c(O)c(-c3ccccc3)c(=O)n(C)c2n(C)c1=O	0
N#Cc1cccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1	2
[NH3+]CCn1cc(C(=O)N[C@H]2C3CN4CC[N@H+](C3)CC2(c2ccccc2)C4)nn1	2
CC[C@@H](C)NS(=O)(=O)c1c(C)cc(C)cc1C	0
C[NH+]1CCN(c2ccc(C(=O)N[C@@H]3CCC[N@@H+](Cc4ccccc4F)C3)cc2)CC1	2
Fc1ccccc1NC1CC[NH+](CCc2ccccc2)CC1	1
OC(C[n+]1ccc2ccccc2c1)C[n+]1ccc2ccccc2c1	2
CC(=O)c1ccc[n+]([C@@H](C)CC[C@H](C)[n+]2cccc(C(C)=O)c2)c1	2
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(C)=O)cc1	0
C[C@]12CN(Cc3ccccc3Br)C[C@](C)(C[N@H+](Cc3ccccc3)C1)C2	1
COc1ccc(-c2cc(C#N)nnc2-c2ccc(OC)cc2)cc1	0
CC(=O)Nc1ccc(S(=O)(=O)N(C)c2ccccc2)cc1	0
CC[NH+](CC)CCn1c2ccccc2n2c(C(=O)OC)c(C)nc12	1
CCOC=C(C(=O)OC1CC(C)(C)[NH2+]C(C)(C)C1)C(=O)OC1CC(C)(C)[NH2+]C(C)(C)C1	2
COC(=O)c1cnc(N2CCOCC2)nc1C(F)(F)F	0
C=C[C@@H]1C[N@@H+]2CC[C@H]1C[C@@H]2[C@H](O)c1ccnc2ccccc12	1
NC(=O)C1([NH+]2CCCCC2)CCN(C(=O)C23C[NH2+]CC2C[NH2+]C3)CC1	3
Cc1cc(N2CC[C@@H]([NH+]3CCN(CCc4ccccc4)CC3)[C@H](O)C2)nc(N)[nH+]1	2
COc1cc(N)c(Cl)cc1C(=O)NCC[N@@H+](C)C1CC1	1
NC(=[NH2+])c1ccc(-c2ccc(-c3ccc(C(N)=[NH2+])cc3)s2)cc1	2
NC(=O)C1CC[NH+](CC(=O)N2CCc3[nH]c4ccccc4c3C2)CC1	1
Cc1ccccc1OC[C@@H](O)C[n+]1c(C)n(C)c2ccccc21	1
CC(=CC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1)NC1CC(C)(C)[NH2+]C(C)(C)C1	2
C[C@@H]([NH2+]CCn1cnc2c(N)ncnc21)c1ccccc1	1
Cc1c(C[N@@H+](C)CCc2ccccc2)c(=O)n(-c2ccccc2)n1C	1
CC(C)(CNC(=O)[C@@H]1CCC[NH+](CC(N)=O)C1)[N@H+]1CCc2ccccc2C1	2
C[NH+]1CCC(N=Nc2ncnc3sc4c(c23)CCCC4)CC1	1
CC1(C)CC(NC(=O)c2cc3ccccc3oc2=O)CC(C)(C)[NH2+]1	1
Cc1c(C[N@H+]2CCc3ccccc3C2)c(=O)n(-c2ccccc2)n1C	1
Cc1ccc2c(c1)c1c(n2C[C@@H](O)Cn2cc[nH+]c2C)C(=O)CCC1	1
C[N+]1(Cc2cc(Cl)cc3c2OCOC3)CCCC1	1
O=S(=O)(Nc1ccc(O)c(C[NH+]2CCCCC2)c1)c1ccccc1	1
CC[C@H]1NC(=O)c2cc(S(N)(=O)=O)c(Cl)cc2N1	0
Cc1ccc2[nH]c(CC[NH+](C)C)c(CN3CCOCC3)c2c1	1
C[n+]1ccccc1CC(=O)c1ccc(Br)cc1	1
COc1ccccc1NC(=O)CC[N@H+]1CCc2ccccc2C1	1
CC1CC[NH+]([C@@H](CNC(=O)[C@@H]2CC(=O)N(CC[NH+](C)C)C2)C(C)C)CC1	2
NC(=O)C1CC[NH+](CC(=O)N2CCN(Cc3ccccc3)C[C@@H]2CO)CC1	1
CC[NH2+][C@@H](C)Cc1cccc(SC(F)(F)F)c1	1
CCn1c(C)[n+](CC)c2cc(S(=O)(=O)C(F)(F)F)ccc21	1
CO[C@@H]1CC(=C(c2cccs2)c2cccs2)C[N+](C)(C)C1	1
O=C(CC[NH+]1CCN(c2ccccc2)CC1)Nc1ccccc1	1
Cc1ccc(C(=O)c2c(C)[n+](-c3ccccc3)c3scc(C)n23)cc1	1
CCOC(=O)C1=C(C)N(C)C(C)=C(C(=O)OCC)C1c1ccsc1	0
COc1c2c(cc3c1[C@H](C[C@H](O)C(C)C)[N@H+](C)CC3)OCO2	1
CCN(CC)C(=O)CSc1nnc([C@@H]([NH3+])Cc2ccccc2)o1	1
CNc1oncc1C1=CCCN(C)C1	0
O=C(CSC1=[NH+]CCN1)Nc1cccc(C(F)(F)F)c1	1
CCOC(=O)c1cnc(C[NH3+])c2c(OC)cc(OC)cc12	1
CCOCCC[N@H+]1CC[C@H](NC(=O)N2CCN(C)C[C@@H]2C[NH3+])[C@@H](C)C1	2
CCN1C(=O)OC2(CC(C)(C)[NH2+]C(C)(C)C2)[C@@]1(C)O	1
Cn1cc(OC[C@H](O)C[NH2+]C(C)(C)C)c2ccccc2c1=O	1
CC[NH+]1CCN(c2ccc(NC(=O)Cc3ccccc3)cc2)CC1	1
CCOc1ccc(N2C(=O)C[C@H]([NH2+]Cc3cccnc3)C2=O)cc1	1
c1coc(CNc2nc3ccccc3n2CC[NH+]2CCOCC2)c1	1
CNc1nc(-c2ccccc2)[n+](-c2ccccc2)s1	1
C[N+](C)(CCNC(=O)c1ccc(/C=N/O)nc1)Cc1ccccc1	1
CC[N@H+]1CCC[C@H](NC2=CC(=O)OC23CCCCC3)C1	1
O=C(c1ccccc1)c1cc[n+](CCC[n+]2ccc(C(=O)c3ccccc3)cc2)cc1	2
C[NH+](C)CCC[NH2+]Cc1ccc2[nH]c3c(c2c1)CCCC3	2
COc1ccccc1C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1	2
COc1ccc([C@@H]2SCC(=O)N2CCC[NH+](C)C)cc1	1
NC(=O)C[NH+]1CCC(NC(=O)c2cccc(C[NH+]3CCCC3)c2)CC1	2
COc1cc2c3c(c1OC)C1(C=CC(=O)C=C1)C[C@@H]3[N+](C)(C)CC2	1
CC[NH+]1CCN(C(=O)c2ccc(Br)cc2)CC1	1
C[N+](C)(C)NP(=O)(N[N+](C)(C)C)c1ccccc1	2
CCC[NH+]1CCC(N2CC[NH+](CCN3C(=O)NC(C)(C)C3=O)CC2)CC1	2
CC[NH+](CC)CCn1c(C)nn2c3ccccc3nc12	1
CC[NH+](CC)CC(=O)Nc1scc2c1c(=O)oc1ccccc12	1
COCC1CC[NH+](Cc2cccc(OC[C@@H](O)C[N@@H+](C)C3CCCCC3)c2)CC1	2
Cc1cc(C)c(C[C@]2(O)C[C@H](C)[N@H+](C)C[C@@H]2C)cc1C	1
Clc1ccc2nc(N3CCC[NH2+]CC3)sc2c1	1
COc1ccc(COC[C@@H](O)C[NH2+]C2Cc3ccccc3C2)cc1	1
C[NH+]1CCN(C(=O)c2ccc(CNS(=O)(=O)c3cccc(Cl)c3)cc2)CC1	1
C[NH+]1CCC(NC(=O)C(=O)Nc2cccc(CN3CC[NH+](C)CC3)c2)CC1	2
c1ccc(-n2c(-c3ccc4c(c3)OCCO4)c[n+]3ccccc23)cc1	1
CCOC(=O)c1ccc(NC(=S)NCC[NH+]2CCC(C)CC2)cc1	1
O=C(C[NH+]1CCC(C[NH+]2CCCC2)CC1)NC(=O)NCC(F)(F)F	2
c1ccc(C[NH+]2CCC([NH2+]C[C@@H]3CCCO3)CC2)cc1	2
CC[N+]1(C)CCC[C@H](OC(=O)C(O)(c2ccccc2)c2ccccc2)C1	1
c1ccc(C(CNC2=[NH+]CCN2)c2ccccc2)cc1	1
CN(C)c1ccc(/C=C/CN(CCC[NH+](C)C)CCC[NH+](C)C)cc1	2
CCOc1ccc(C[NH+]2CCN(c3ccccc3)CC2)cc1	1
C[N@@H+]1[C@@H](CCC(=O)N2CCC(O)CC2)CNC(=O)[C@@H]2[C@H]1CCN2Cc1ncc[nH]1	1
CNc1nc(C2CC[NH2+]CC2)nc2c1CC[N@@H+](CCC(=O)N1CCOCC1)C2	2
C[C@@H](C[N+](C)(C)C)OC(=O)c1ccc(S(=O)(=O)N(C)C)o1	1
O=C(C[NH+]1CCCCC1)Nc1ccc(F)c(Cl)c1	1
CCCn1c(=O)c2c(nc(N3CC[NH2+]CC3)n2CCC)n(C)c1=O	1
COC(=O)c1ccc(OC[C@H](O)C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1	1
COc1nc(Cl)nc(N2CCOCC2)n1	0
O=C(c1ccccc1)N1CCN(c2cc[nH+]c(N3CCCCC3)n2)CC1	1
CCOC(=O)c1ccc2[nH+]c(C)cc(Nc3ccc(O)cc3)c2c1	1
Nc1c(Cl)cc(C(=O)NCCC23CCC[NH+]2CCC3)c2c1CCO2	1
CCN(Cc1ccccc1)C(=O)[C@H](C)Oc1ccccc1	0
O=[N+]([O-])c1cccnc1Sc1ccccc1C1=[NH+]CCCN1	1
CCOC(=O)[C@@H]1CCC[N@@H+](CC(=O)NC2CC[NH+](C3CC3)CC2)C1	2
O=C(CC[N@@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1)N1CCN(c2ccccn2)CC1	2
Cc1cc(Nc2cc(Cl)cc(Cl)c2)nc(N)[nH+]1	1
C[N+]12CCCC[C@H]1[C@H](CN1C(=O)c3ccccc3C1=O)CCC2	1
O=C1CNC(=S)N1Cc1ccc([N+](=O)[O-])cc1	0
O=C(CC[NH+]1CCN(c2ccccn2)CC1)NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1	2
Cc1ccccc1-[n+]1c(-c2ccc(Br)cc2)cn2c1SCCC2	1
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1	0
C[NH+]=C(NC[C@@H](C)[NH+](C)C)N1CCN(S(=O)(=O)Cc2ccon2)CC1	2
Cc1nc(-c2ccc(S(=O)(=O)NCC[NH+](C)C)s2)cs1	1
Cn1c(N)c(NC(=O)c2cccs2)c(=O)n(C)c1=O	0
Fc1ccc(O[C@@H](c2ccccc2)C2CC[NH2+]CC2)cc1	1
[NH3+]CCCC[C@@H]1NC(=O)[C@@H]2C[C@H]([NH2+]Cc3ccccc3)CN2C1=O	2
COc1ccccc1NC(=O)N1CC[NH+](CCc2ccccc2)CC1	1
CN1C(=N)N(c2nc(N(C)C)nc(N(C)C)n2)CC1=O	0
C[NH2+]CCC[NH2+]Cc1ccc(-c2ccc(C(=O)OC)cc2)o1	2
NC(=O)C1CC[NH+](Cc2nc(-c3ccccc3)no2)CC1	1
[NH3+]Cc1cn(C2CC[NH+](Cc3cccn3-c3ncccn3)CC2)nn1	2
C[NH+](C)CCc1cn(CC[NH2+]CCO)c2c1C(=O)c1ccncc1C2=O	2
CCC(=O)Nc1nc2ccccc2n1CC[NH+](CC)CC	1
FC(F)(F)c1ccc2c(c1)nnn2C1CC[NH2+]CC1	1
C[NH+](C)CCNc1oc(COc2ccccc2)nc1C#N	1
COc1cc(N)c(Cl)cc1C(=O)NC1CC[NH+](Cc2ccccc2)CC1	1
COc1cc(C(=O)N2CC[NH+](C3C4CC5CC(C4)CC3C5)CC2)cc(OC)c1OC	1
NC(=O)C1([NH+]2CCCCC2)CCN(CCCN2c3ccccc3CCc3ccc(Cl)cc32)CC1	1
Cc1ccc(OC[C@@H](O)C[NH+]2CCC(C(N)=O)CC2)c([N+](=O)[O-])c1	1
O=C(c1ccccc1)c1cc[n+](Cc2ccccn2)cc1	1
c1ccc(Cc2ccc[n+](Cc3ccccn3)c2)cc1	1
OC[C@@H]1CCCC[N@H+]1Cc1ccc(F)c(Br)c1	1
c1ccc(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)cc1	1
CCOc1ccc([C@@](O)(CC)CC[NH+]2CCCCC2)cc1	1
c1ccc(N2CC[NH+](C3CCN(Cc4ccco4)CC3)CC2)cc1	1
O=C1NCC[N@@H+](C2CCCC2)[C@@H]1CC(=O)N1CCN(c2cc[nH+]cc2)CC1	2
COc1cc(C(=O)NN2CC[NH+](C)CC2)cc(OC)c1OC	1
C[NH+](C)CCC1CC[NH+](CC(=O)NCC(C)(C)N2CCOCC2)CC1	2
CNC(=O)CN(c1ccccc1OC)S(C)(=O)=O	0
CCOC(=O)c1ccc2c(c1)c1c3n2CC[NH2+][C@@H]3CCC1	1
Cn1c(-[n+]2ccccc2)c(C=O)n(-c2ccccc2)c1=O	1
CC(=O)N1CCC(NC(=O)[C@@]23C[NH2+]C[C@@H]2C[N@@H+](Cc2ccccc2)C3)CC1	2
O=S(=O)(N[C@@H]1CCCC[C@@H]1[NH+]1CCCCC1)c1ccccc1	1
Cc1cc(NC(=O)C[NH2+]C(C)(C)C)c2ccccc2n1	1
COc1ccc(-[n+]2ccc(-c3cc[n+](-c4ccc(OC)cc4)cc3)cc2)cc1	2
C[C@H](c1ccccc1)[N@H+]1CCc2nc(=O)n3cc(-c4ccccc4F)[nH]c3c2C1	1
O=C1CCC(=O)N1OC[C@@H]1CCC[N@H+]2CCCC[C@H]12	1
O=C(COC[C@@H]1CCC[N@H+]2CCCC[C@@H]12)N1CCOCC1	1
Nc1cccc(OC[C@H]2CCC[N@H+]3CCCC[C@H]23)c1	1
CCOC(=O)c1ccc(N2C(=O)C[C@@H]([NH+](CC)CC)C2=O)cc1	1
O=C(CN1CC[n+]2cc(-c3ccccc3)sc21)c1ccccc1	1
COc1ccc([C@]2(C)N(O)[C@@H](C)C(c3ccccc3)[N+]2=O)cc1	1
C[C@@H](C[NH+]1CCCCC1)OC(=O)[C@@H]1COc2ccccc2O1	1
Cn1c(=O)c(C(N)=S)cn(-c2ccccc2)c1=O	0
Cc1ccnc(S[C@@H]2C[C@@H](C(=O)NCC[NH+](C)C)[N@H+](Cc3ccccc3)C2)n1	2
COc1ccc(Cl)cc1C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1	1
CC[C@@H](CO)NC(=O)[C@H]1C=C2c3cccc4c3c(cn4C)C[C@@H]2[N@H+](C)C1	1
Cn1cc(C(=O)OCC2CC[NH+](CCNS(C)(=O)=O)CC2)c2ccccc21	1
COC(=O)c1sc(N)nc1C	0
COC(=O)Nc1nc2ccccc2n1C(=O)COc1ccccc1	0
O=C(CC[NH+]1CCCCC1)Nc1ccc(Cl)cc1	1
c1cc(C[S+]2CCCC2)ccc1C[S+]1CCCC1	2
CC[NH+](CC)CC(=O)N1CCN(C(=O)C2CC[NH+](C(C)C)CC2)CC1	2
CCOC(=O)C(=C1CC(=O)N(c2ccccc2)C1=O)C(C)[NH3+]	1
COc1ccc(N2CC[NH+]([C@@H]3CCCN(C(=O)CCn4cc[nH+]c4C)C3)CC2)cc1	2
C[C@@H](Oc1ccccc1F)C(=O)NCC[NH+]1CCCCC1	1
CC[NH+]1CCN(C(=O)CCC2CCN(C(=O)[C@H]3CCC[N@@H+](C)C3)CC2)CC1	2
CCOC(=O)[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2C)C1	1
C[N@H+]1CCC[C@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12	1
C[C@@H](CC[NH+](C)C)NC(=O)NCC[NH+]1CCN(c2ccccc2)CC1	2
COc1c(O)cc2c(c1OC)CC(=O)CCC2	0
Cc1ccnc(N2CC[NH+](CCc3c(C)n4c5c(cccc35)CCC4)CC2)c1	1
CNC(=O)C[NH+]1CCC(NC(=O)NC[C@@H](C2CCCCC2)[NH+](C)C)CC1	2
COc1ccc(/C=C/C(=O)Nc2ccc(OC)c(Cl)c2)c(OC)c1	0
C[NH+](C)Cc1cc(CCNC(=O)c2ccc(Cl)cc2)ccc1O	1
COc1cccc(OC[C@@H](O)C[NH+]2C(C)(C)CC(O)CC2(C)C)c1	1
Cc1cc(OC[C@@H](O)C[NH+]2CCCC2)ccc1Cl	1
N#Cc1ccc2c(c1)N(CCC[NH+]1CCC(O)CC1)c1ccccc1S2	1
CC(C)(C)N1C[C@@H](COc2cccc3c2SCCC3)OC1=O	0
O=C(NCCC[NH+]1CCN(c2ccc(Cl)cc2)CC1)[C@@H]1CCC[NH2+]1	2
CC[NH+](CC)CCNC(=O)c1cnc(N2CC[NH+](CC)CC2)nc1C	2
O=C(NCCC[NH+]1CCOCC1)C1CC[NH+](Cc2ccccc2)CC1	2
COCCC[N@H+]1CC[C@@H](Cn2cnc3sc4c(c3c2=O)CC[NH2+]C4)C1	2
CC[NH+](CC)c1ccc(Nc2[nH]c(=O)nnc2C)cc1	1
O[C@@](c1ccccc1)(c1cccs1)[C@@H]1C[NH+]2CCC1CC2	1
C[N@@H+](CCCn1ccnc1)CCOc1ccc(Cl)cc1	1
C[N@@H+](CCC(=O)Nc1ccc2c(c1)OCO2)Cc1ccccc1	1
O=C(N[C@@H]1C[NH+]2CCC1CC2)c1cc(Br)cc2nc[nH]c12	1
COc1ccc(NC(=O)CC[N@@H+](C)Cc2ccccc2)c(OC)c1	1
FC(F)(F)c1cc(N2CC[NH2+]CC2)c2ccccc2n1	1
O=C1C[C@H](Nc2ccc([NH+]3CCCCC3)cc2)C(=O)N1Cc1ccccc1	1
C[NH+]1CCN(c2ccccc2Cc2ccccc2)CC1	1
C[N@H+]1[C@H]2CCC[C@@H]1CC(NC(=O)c1nccc3ccccc13)C2	1
Cn1c[n+](Cc2ccc(C=NNC(N)=[NH2+])cc2)c2ccccc21	2
CC1(C)NC(=[NH2+])NC(=N)N1c1c(Cl)cccc1Cl	1
CC[C@@H](C)[NH+]1CCN(Cc2ccccc2[N+](=O)[O-])CC1	1
CC[N@H+]1CCC[C@@H](OC(=O)C(O)(c2ccccc2)c2ccccc2)C1	1
CC[NH+](CC)CCNc1ncc2c(c1C#N)Nc1ccccc1C2	1
Cc1c(C)n(-c2cc[nH+]cc2)c2ncnc(NCC[NH+](C)C)c12	2
C[N@@H+](CC(=O)Nc1ccc(C[NH+]2CCCC2)cc1)Cc1ccccc1	2
COC(=O)c1ccccc1C(=O)c1ccc(OCC[NH+]2CCCCC2)cc1	1
COc1cc2c(cc1OC)-c1c(C)c3ccc(OC)c(OC)c3c[n+]1CC2	1
CC(C)COC(=O)N(C)C1CC[NH+](C2Cc3ccccc3C2)CC1	1
Fc1ccc([C@@H]2CCCN(CC[NH+]3CCCC3)c3cc(F)ccc32)cc1	1
CCc1ccccc1NC(=O)COc1ccc(Br)cc1	0
C=C(C)Cn1c(NCC[NH+](C)C)nc2c1c(=O)[nH]c(=O)n2C	1
CC[NH+]1CCC(COc2nc3ccsc3n3cccc23)CC1	1
COc1cc(CNc2[nH+]c3ccccc3n2C)cc(OC)c1OC	1
CCc1cccc(CC)c1N1C(=[NH2+])NC(=N)NC1(C)C	1
[NH3+]CCNC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)[C@@H]([NH3+])Cc2ccccc2)C1	3
CC[N@H+]1CCC[C@@H]1CNS(=O)(=O)c1cccc2cccnc12	1
C[C@@H](NC(=O)C1CC[NH+](Cc2ccc(F)cc2)CC1)c1ccccc1	1
OCCN1CC[NH+]([C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)c3ccccc32)CC1	1
CCOC(=O)Cn1c(C)c(Sc2ccccc2)c2ccccc21	0
NC(=O)c1oc2ccccc2c1NC(=O)C[NH+]1CCCCC1	1
FC(F)(F)c1nnc2ccc(N3CCOCC3)nn12	0
COc1cc(NS(=O)(=O)c2ccc(N)cc2)ncn1	0
COc1cccc(NC(=O)N(CC[NH+](C)C)[C@@H](C)c2cccnc2)c1	1
CC(=O)c1cccc(OC[C@@H](O)C[NH2+]CC(C)(C)C[NH+](C)C)c1	2
COc1ccc(C(=O)N2CC[NH+](C[C@@H]3CC=CCC3)CC2)cc1	1
CC(C)[N@@H+](C)CC(=O)N1CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC1	2
Cn1c(C(C)(C)C)nc(N)nc1=O	0
C[C@H](CCc1ccc(O)cc1)[NH2+]C[C@@H](O)c1ccc(O)cc1	1
CCOC(=O)N1CCC([NH2+]CCc2cccc(F)c2)CC1	1
C[NH+](C)CCCN(CCC[NH+](C)C)Cc1ccc(Cl)c([N+](=O)[O-])c1	2
COC(=O)c1[nH]c2ccc(C)cc2c1NC(=O)C[N@H+]1CCCC[C@@H]1C	1
C[NH+](C)CCOC(=O)[C@@H](c1ccccc1)C1(O)CCCC1	1
C=C(C)Cn1c(SCc2ccccc2)nc2ccccc2c1=O	0
C[NH+](C)CCC(C=O)(CC[NH+](C)C)c1cccc2ccccc12	2
C[NH+](C)C[C@@H](O)[C@H](c1ccccc1)c1cccc(Cl)c1	1
COc1ccc(C[NH2+]C[C@@H](O)CSc2ccc(OC)cc2)cc1	1
CC[N@H+]1CCC[C@@H]1CNC(=O)CCC1CC[NH+](C2CCOCC2)CC1	2
COc1ccc(CN(CC[NH+](C)C)c2ncccn2)cc1	1
c1ccc(-c2nc(C3OCCCO3)[nH]c2-c2ccccc2)cc1	0
C[C@@H](C[NH+]1CCCCC1)OC(=O)c1ccc2c(c1)OCCO2	1
COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H](C)C2)cc1	1
C[NH+]1CCN(c2ccc(-c3nc4ccc(I)cc4s3)cc2)CC1	1
C[NH+]1CCC([NH+]2CCC(CC[N@H+](C)CCC(=O)NC(N)=O)CC2)CC1	3
CC[N+](C)(CC)C[C@@H]1CO[C@H](C[N+](C)(CC)CC)CO1	2
Cc1cc(/C=C/c2ccc(OC[C@@H](O)C[NH2+]C(C)C)cc2)on1	1
COc1cc(CN(CCC[NH+](C)C)CCC[NH+](C)C)cc(OC)c1	2
Cn1nc(C2CCN(C(=O)[C@@H]3CCC[NH2+]C3)CC2)cc1C[NH+](C)C	2
Cc1cc(=O)oc2cc(NC(=O)[C@@H]([NH3+])CC(C)C)ccc12	1
COc1cc2c(cc1OC)C(CC[NH+]1CCCC1)=NC(C)(C)C2	1
CNc1ncc(CN(C)C(=O)[C@@]23C[NH2+]C[C@@H]2C[N@H+](C2CCCC2)C3)cn1	2
Fc1ccc(OCC2CC[NH+](CC3CC3)CC2)cc1	1
CN1CC[C@@H]2[C@H]1C(=O)NC[C@H](CCC(=O)N1CC[NH+](C)CC1)[N@H+]2C	2
O=C(C[NH+]1CCCC1)Nc1ccc(OC(F)(F)Cl)cc1	1
Nc1[nH+]c2ccccc2n1CCOc1ccc([N+](=O)[O-])cc1	1
CC(C)(C)c1cc(C(=O)N2CCC[NH2+]CC2)cc(C(C)(C)C)c1O	1
FC(F)(F)c1ccccc1CN1CCC([NH+]2CCCCC2)CC1	1
CC1(C)CC(NCC(=O)OC2CCCCC2)CC(C)(C)[NH2+]1	1
CCN(CC)CC(=O)Nc1c(C)cccc1C	0
NS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2)cc1	0
CC[NH+](CC)C[C@@H](O)Cn1c2c(c3ccccc31)CCCC2=O	1
CN1CC[NH+](CCOc2ccccc2C[N@H+]2CC[C@@]3(CC(=O)NC3=O)C2)CC1	2
Nc1cc(N)[nH+]c(SCc2nc(-c3ccccc3)no2)n1	1
O=c1c(C[NH+]2CCC3(C=Cc4ccccc43)CC2)coc2ccccc12	1
CN(C)C(ON1C(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@H]2C1=O)=[N+](C)C	1
CC[N@H+]1CCC[C@@H]1CNS(=O)(=O)c1cc(Cl)c(N)cc1OC	1
C[NH+]1CCC(c2n[nH]c3ccc(NC(=O)c4ccc(F)cc4)cc23)CC1	1
COc1cccc(CSc2nnc(N)s2)c1	0
Cc1cc(NCCCCCC[NH3+])nc(N2CCCCC2)[nH+]1	2
CCC(C)(C)C(=O)Nc1ccc(C)cc1OC	0
COc1ccc([C@H]2CC(c3cc(OC)cc(OC)c3)=NC(=[NH2+])N2)cc1	1
O=C(c1ccc(F)cc1)C1CC[NH+](CCn2c(=O)[nH]c3ccccc3c2=O)CC1	1
O=C(c1ccc(F)cc1)C1CC[NH+](CCc2ccccc2)CC1	1
Cc1cccc(NC(=O)Cc2ccccc2)c1C	0
O[C@H]1C2CC[NH+](CC2)[C@H]1C(c1ccc(F)cc1)c1ccc(F)cc1	1
Cc1ccc(S(=O)(=O)Cc2sc3ccccc3[n+]2C)cc1	1
CC[NH+](CC)CCSc1nnc2c3ccccc3n(C)c2n1	1
O=C(c1ccc(F)cc1)C1CC[NH+](CCCn2c(=O)[nH]c3cc(Cl)ccc32)CC1	1
COCC[NH+]1CCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1	2
O=[N+]([O-])c1ccc([C@@H]2OCOC[C@@H]2O)cc1	0
OC[C@@H]1CCC[N@@H+](Cc2ccc(F)c(Br)c2)C1	1
NC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1	2
COc1ccccc1[C@@H](O)C(C[NH+]1CCCCC1)C[NH+]1CCCCC1	2
Nc1noc(Cc2ccc3[nH]cc(CC[NH3+])c3c2)n1	1
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C[NH+]3CCCC3)C2)cc1	1
CNc1cc[nH+]c(N2CCC([N@H+]3CCC[C@@H](C(=O)N4CCOCC4)C3)CC2)n1	2
O=[N+]([O-])c1ccc(Cc2cc[n+](Cc3ccccn3)cc2)cc1	1
C[NH+](C)CCOC(=O)c1ccc(C(=O)c2ccccc2)cc1	1
Cc1ccc(OC[C@@H](O)C[NH2+]Cc2ccco2)cc1C	1
C[NH+](C)CC(=O)Nc1ccc2[nH]c(=O)c3ccccc3c2c1	1
COC(=O)Cn1c(=N)n(CC[NH+]2CCCCC2)c2ccccc21	1
Cc1cc[nH+]c(NC2CCN(C(=O)c3ccoc3)CC2)c1	1
CC[N@@H+](CC(=O)NCC1([NH+]2CCOCC2)CCCCC1)C1CC1	2
Cn1c(CCCCc2n(C)c3ccccc3[n+]2C)[n+](C)c2ccccc21	2
Nc1ccccc1NC1=C([N+](=O)[O-])CS(=O)(=O)C1	0
COCC[N@@H+](C)CC1CC[NH+](Cc2ccccc2OC)CC1	2
O=C(COc1ccccc1)NC1CC[NH+](Cc2ccccc2)CC1	1
c1ccc(-c2cc(C[NH2+]CCC[NH+]3CCCCC3)c3nnnn3c2)cc1	2
C[NH+]1CCN(c2c3c(c(C#N)c4nc5ccccc5n24)CCC3)CC1	1
Clc1ccc(-c2noc(CSC3=[NH+]C[C@@H]4CCC[C@@H]4N3)n2)cc1	1
COc1ccc([C@H](C)Cn2cc[nH]c2=O)cc1OCC1CC1	0
COc1cccc(OC)c1C(=O)N1CCN(c2ccc(F)cc2)CC1	0