File: MMFF94_hypervalent.smi

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SMILES Name
NCC(=O)O AGLYSL01
O=C([O-])C(O)C(O)C(=O)O AMHTAR01
Cc1nc2[nH+]c(N)nc(N)c2nc1C AMPTRB10
NC(N)=[NH+]CCCC(N)C(=O)[O-] ARGIND11
O=C([O-])C(=O)[O-] BAOXLM01
O=C1SCC1NS(=O)(=O)c1ccc(Br)cc1 BBSPRT10
N#CC(C#N)=C1C(=C(C#N)C#N)C(=C(C#N)C#N)C1=C(C#N)C#N BEVJER10
CC(=O)NC=C[S+2](=O)C1=C(C(=O)OCc2ccc([N+](=O)[O-])cc2)N2C(=O)C(=C(C)COC(C)=O)C2C1 BEWCUB
Nc1ccc(S(=O)(=O)[N-]c2cccc[nH+]2)cc1 BEWKUJ04
Cc1[nH+]cc2c(c1[O-])C(O)OC2 BIHKEI01
O=c1[nH]c(=O)n(C2CCCO2)cc1F BIPDEJ02
O=C(O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] BIPJUF10
c1ccc(-c2cccc[nH+]2)[nH+]c1 BIPYCL01
Cc1cc(C)n(-c2nc3ccccc3s2)n1 BITNAT10
c1ccc2c(c1)Nc1ccccc1S2 BIYBIU10
CON=C(C(N)=O)c1csc(N)n1.CSC1=NNC(C)S1 BODKOU
Oc1ccc(Br)cc1C=Nc1ccccn1 BSALAP01
CC(C)(C)P(C)(=S)P(C)(=S)C(C)(C)C BUPSLB10
CC(C)(C)P(C)(=S)SP(C)(=S)C(C)(C)C BUPSLD10
N#Cc1cn(C2OC(CO)C(O)C2O)n2ccnc12 BUYTIY10
N#Cc1cnn2ccn(C3OC(CO)C(O)C3O)c12 BUYTOE10
CSCCC(NC=O)C(=O)NC(C(=O)O)C(C)C BUYXEY10
CN1CCOSC1=NC(=O)c1ccccc1 BYITOT02
O=S1(=O)CC=C(c2ccccc2)C1 CABWEH10
O=C[O-] CAFORM07
O=S1(=O)N=C(c2ccccc2)OS(=O)(=O)O1 CAGREH10
CC([NH3+])C(=O)NCC(=O)NCC(=O)[O-] CALXES20
O=C([O-])CC(=O)[O-] CAMALD03
CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)CSC12)c1csc(N)n1 CEFMEN
CC1OC2C(O)C(O)C(CO)OC2SC1C#N CETROI01
O=P(c1ccccc1)(c1ccccc1)c1ccccc1 CEWCUC10
CC(C)Cn1c2nc[nH]c2c(=O)n(C)c1=O CEWVIJ10
Oc1cccc2c1-c1c-2cccc1O CEWYIM30
C1OC1C1OC1C1CO1 CIHWUL10
CC1=[NH+]C2CC(=O)C1C(C)C2 CIJXOI10
N#Cc1cnc2cccc3ncnc1-n-3-2 CIKSEU10
COC1OC(CO[N+](=O)[O-])C(O[N+](=O)[O-])C(O[N+](=O)[O-])C1O[N+](=O)[O-] CILBII
NC(=S)NN=C(CCC(=O)O)C(=O)O CILDOQ
c1cnnnc1 CILWUP11
COC(=O)C1(NC(=O)c2ccccc2)CC1Cl CIMRUL10
CC1(O)C(=O)C([N+](=O)[O-])=CC(C2CC2)([N+](=O)[O-])C1[N+](=O)[O-] CINVIE
CCOC(=O)c1c(C)nn2c1nnn2C CIPVOM
N#CC(C#N)=C1C(=C(C#N)C#N)C1=C(C#N)C#N CIPYAB10
c1cc2nsnc2c2nsnc12 CISMOG
O=[N+]([O-])c1cc2c(cnn2-c2nnn[nH]2)c([N+](=O)[O-])c1 CISPOJ
CC(=O)Oc1c(Cl)ccc(Cl)c1Cl CITDIS
CCSC(=O)CNC(=O)c1ccccc1 CITNOI10
CCSC(=S)C(C)NC(=O)c1ccccc1 CITPEA10
NC=[NH+]O CITSED10
O=c1n(CC2CO2)c(=O)n(CC2CO2)c(=O)n1CC1CO1 CIVCEP02
COC(=O)C1C2C(C(=O)OC)C1C21OCCO1 CIVLAU02
O=C1OC2CC(O)CC(C2)O1 CIXWAH
O=C1c2nsnc2C(=O)c2nsnc21 CIYNUT
CC1CC2C=CC(C)[S+2](=O)N2C(=O)O1 CIZFIA
C[Si](C)(C)C1(Cl)[Si](C)(C)C(Cl)([Si](C)(C)C)[Si]1(C)C CIZJAW
N#CN=[N+]([O-])c1ccccn1 CIZWUD
CSC(=C(C#N)c1ccccc1)N(C)C CIZYEP
O=C1NCCN1c1ncc([N+](=O)[O-])s1 CIZZUG
CCOC(=O)C1(C(N)=O)CN1OC COBKIN01
N#CN=C1C=CC(=NC#N)c2ccccc21 COCXUN
c1ccc2c(c1)ccc1nn3nnnc3nc12 COGDEH
Clc1cnn(-c2ccccc2)n1 COGYAY
COC(=N)c1nc(C#N)ns1 COHKOZ
CN(C)c1[nH+]cnc2[nH]c[nH+]c21 COJFIQ
C#CC(O[S+2](C)=O)C(C)(C)C COKDEL
Cc1cc([N-]S(=O)(=O)c2ccc(N)cc2)no1 COKROJ
CP1N2CCCN1CCN1CCCN(CC2)P1C COLZUY
O=C1C=C(Br)C(=O)C2C3C=CC(C3)C12Br COMDIR
N#CC1CC2COC(=O)C12 COMKAQ
O=Cc1c[nH]c2ccccc12 COMWOQ
CN(C)Cc1c[nH]c2ccccc12 COMWUW
CN1C(=O)N(C)C2C3N(C)C(=O)N(C)C(=O)C3(F)C2(F)C1=O CONBAI
COC(N)=S CONFAM
C[N+]1(C)CC[N+](C)(C)C1 CONLIA
CS(=O)(=O)C(Cl)C(=O)c1ccccc1 CORDOC
O=CNC(=S)[S-] CORWUB10
Cn1c2ccccc2sc1=O COSFAR
S=C([S-])NCCNC(=S)[S-] COSSEI
C=CC1=CC=C(C#N)C=CC(OC)=N1 COSWIQ
NNC(=S)Nc1ccc(Cl)cc1 COTMON
O=C([O-])C(=O)CCC(=O)O COTPEG
[O-][N+](=Nc1ccccc1)c1cc[n+]([O-])cc1 COTRIM
CSC(=O)SSSC(=O)SC COVHUQ
CC(C)(C)N=CC=NC(C)(C)C COVMAB
Cc1cc(C)nc(NS(=O)(=O)c2ccc(N)cc2)n1 COVXIU
CC(C)[NH2+]C(c1ccccc1O)[P+]([O-])([O-])O COWTIR
COP(=O)(OC)C1SCSCS1 COXBAS
CSC(=S)N=C(N)N COXZEU
NC(=O)C1(C(N)=O)CN1c1ccccc1 COYMOS
NN1C(=O)c2ccccc2C1=O COYNAF
CNS(=O)(=O)c1ccccc1-c1nnc(N)s1 COYVIV
Cc1cccc(Cc2c[nH]c[nH+]2)c1C CUBTUO
Cc1cccc2c1C(C)(O)C1OC1C2=O CUCDAF
CC(=O)C12CC1(C(C)=O)C(C)(O)CC2=O CUCHOX
Cn1cnc([N+](=O)[O-])c1Sc1ncccc1O CUCHUD
CC(=NO)C(=NO)N1CC1C(N)=O CUDJAM
COC1([Si](C)(C)C)CCCCC1O CUDNEU
O=[N+]([O-])C(=N[O-])c1ccncc1O CUDPAS
CC1(C)N=NC(=S)N1c1ccccc1 CUDPOG
Nc1[nH+]ccs1 CUDREY
O=C1OC2(c3ccccc31)c1ccc(O)cc1Oc1cc(O)ccc12 CUFFAK
CCOc1[nH]c(=O)c2c(c1C#N)CCCC2 CUGBEL
CC(Cl)(C=C(Cl)C(Cl)C(Cl)(Cl)[N+](=O)[O-])C(=O)O CUGGOA
O=[N+]([O-])C12C3CC4C5C3C1C5C([N+](=O)[O-])([N+](=O)[O-])C42 CUGLOF
CSC(=NO)c1cccc[n+]1C CUJYUB10
CS(=O)(=O)N1OC1c1ccccc1 CULGEV10
[O-][N+]1(CCN2CCCCC2)CCCCC1 CULHIA10
CC(C)C1OP(=O)(Cl)OCC1(C)C CULVEK
CC(=O)C(C)=NNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] CUNVAI
COC(=O)C1(Cl)CC1(C#N)SC(C)(C)C CUNVEM
CCC1C2CC(C3OC32)S1(=O)=O CURZIY
[NH3+]C(CSSCCC(=O)O)C(=O)[O-] CUVFOO
CC1(O)CCC(C)(O)P1(=O)O CUVGAB
C[NH2+]N CUVJOS
COc1cc2oc(C(C)=O)cc2c(OC)c1 CUYRAP
N#CN CYANAM01
CC1(C)NC(N)=NC(N)=[N+]1c1ccc(Cl)cc1 CYGUAN01
COc1cc(=NS(=O)(=O)c2ccc(N)cc2)[nH]c(C)n1 DABHAP
FC1(F)C2CC3C(CC21)C3(F)F DABLIB
CC(c1ccccc1)N1CCCOP1(=O)F DACSAB
CC1C(C)(C)P(=S)(N(C)C)C1(C)C DACYIP
O=C1CCC(=O)OC2CCN3CC=C(CO1)C23 DADDAN
C=C1NC(=O)C(N)=C1C(C)=O DADLAV
C=C1OC(=N)C(N)=C1C(C)=O DADLEZ
CNN=Nc1ccc(C)cc1 DAFKIE
Nc1nonc1[N+](=O)[O-] DAFPUV
CON(N(OC)S(C)(=O)=O)S(C)(=O)=O DAGTUA
CN(C)C(=O)c1cccc(=O)n1O DAHBAP
C[Si](C)(Cl)CC[Si](C)(C)Cl DAHNAB
CC12C(=O)NC(=O)N3CCCN4C=NC1C4C32 DAJXER
CC(=O)C1=C(C)NC([S-])=C(C#N)C1c1ccccc1[N+](=O)[O-] DAKBAS
[N-]=[N+]=Nc1nn2nnnc2c2ccccc21 DAKCEX
O=C(O)CC1c2cc(Cl)ccc2C(=O)NN1c1ccc2snnc2c1 DAKDOI
C1CS[Si]2(S1)SCCS2 DANCUQ
Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1 DAPSUO03
CN=C1SCC2CSC(c3nc[nH]c3C)N12 DARDEF
CCN(CC)C(=P[Si](C)(C)C)N(C)C DARPOB10
Cc1cc(=S)n(-c2ccccc2)n1C DARXID
CCN1N=Nc2ccccc2C1O DARZEB
CC1([N+](=O)[O-])C(=O)C(C)([N+](=O)[O-])C(C)([N+](=O)[O-])C(Br)=C1Br DAVWEC
CC1=C([N+](=O)[O-])C(C)([N+](=O)[O-])C(C)([N+](=O)[O-])C(=O)C1(C)[N+](=O)[O-] DAVXED
CN=[N+]([O-])C1=C(NC)C(F)(F)C1(F)F DAWXII
O=c1cc(Cl)c2ccccc2o1 DAWYUV
O=P1(OP2(=O)OCCCO2)OCCCO1 DAYWEF
O=C1C2(CC2)C(=O)C2(CC2)C(=O)C12CC2 DAZVEF
O=C([O-])C=CC(=O)O DEBMOM01
O=C([O-])C1[NH2+]CCc2c(O)noc21 DECJAW
CN1C=C(C(N)=O)C(=O)N2CCCCC12 DECKUR
CN(C)c1oc2ccccc2[n+]1C DECRIM
CC1(Cl)c2cc(Cl)cc(Cl)c2NC1=O DEDCIY
CC(C)(C)OC(=O)C#CN1C(=O)CC1CI DEDSIO
C[N+]([O-])=NNc1ccc(C(N)=O)cc1 DEFGIE
CC(=O)N1C(=O)N([N+](=O)[O-])C2C1N([N+](=O)[O-])C(=O)N2C(C)=O DEFLEF
CNc1nsc(N)[n+]1C DEFPUZ
CN(C)c1nnn(-c2ccccc2)c(=O)n1 DEFTUD
Cc1ccc(N[N+]2=NC(N(C)C)=NC2=O)cc1 DEFVAL
NC1=C(C(=S)S)CCC1 DEFYUI
C[N+](C)=C(N)Cl DEGLUW
Cc1ccc2c(c1)CN1CN2Cc2cc(C)ccc21 DEGRIQ
CN1C(=O)NC(=O)C12OC(=O)[N-]C2=O DEKRUG
NC(=O)c1ncn2c1nnn(CCCl)c2=O DEMBIG
c1cnc2c(c1)Oc1nccnc1S2 DEPKEO
CN(C)C1=[N+](N=C([O-])C(F)(F)F)C(=O)NC1(C)C DERZUV
CCOC(=O)c1ncsc1N DESWUT
C=C(N)C#N DESYOP
CCn1nc(C(=O)O)c(=O)c2cc3c(cc21)OCO3 DEWHOC
C[Si](C)(C)N1C=CN([Si](C)(C)C)C=C1 DEWJEU
CC(O)C1C(=O)NC1c1ccccc1 DEXCIS
O=CNC(=O)c1ccn2c1NC(=O)CC2 DEXGIW
FC12C3CC(F)(F)C1(F)C3CC2(F)F DEZDUH
CS(=O)(=O)C1=NC=CC2C=CC=CC1C2 DEZNIF
O=C1OCC2=C(Cl)C=CC=C(Cl)N12 DEZXEL
Nc1ncnc2c1ncn2C1C=CC(CO)O1 DHOADS01
c1cn(Cc2cc3ccccc3c3sccc32)c[nH+]1 DICKIJ
[O-][n+]1oncc1-c1ccccc1 DICPUA
[O-][n+]1cc(-c2ccccc2)no1 DICRAI
CN(C)[Si](C)(C)C DICYIX
CCN(CC)C(Cl)=NC(=O)C(Cl)(Cl)C(=O)Cl DICYOD
COC(=O)C(O)C(O)C1CC=NO1 DIDYOE
O=[N+]([O-])c1ccccc1[S+2](=O)c1ccccc1[N+](=O)[O-] DIFSIU
S=C([S-])NNC(=S)[S-] DIGCOL
CSC(=S)SCCSC(=S)SC DIGCUR
O=C(NC1C(=O)OC1Cc1ccc([N+](=O)[O-])cc1)c1cccc(O)c1O DIGLEK
CC1=CC(=O)c2cnn(C)c2C1=O DIHTET
CC1C(C)(C)N(C(=O)C(Cl)(Cl)Cl)S1(=O)=O DIKGAF
CC1C(C)(C)OC(C(Cl)(Cl)Cl)=NS1(=O)=O DIKGEJ
ON1C23CCCCC2NC2CCCCC21ON3 DIKWID
O=CC1=CCC2C1C(=O)C2(Cl)Cl DIKYUR
CC(C)=C1C(=O)NC1OC(=O)C(C)(C)C DILCOQ
O=[N+]([O-])c1cc([N+](=O)[O-])c(S(=O)(=O)c2ccccc2)s1 DIMYIH10
Cc1cc(=O)nc2n1C1OC(CO)C(O)C1O2 DIPDAH10
Nc1[nH]c(CC[NH3+])c[nH+]1 DIPDIP10
CS(=O)(=O)NO DIRMIA
CC1=CC(C)(C)N=C2C=CC(=O)C=C12 DISHES
CCOC([O-])=C(Cl)[N+](=O)[O-] DISJOE
CSC(=[NH2+])NN DITRAZ
O=C(CC1CCC1)c1ccc(Cl)cc1 DITYAG10
CNC1=[NH+]CCSC1=NO DIVJUN
OC1c2ccccc2OC2CCC21 DIVTUX
NC(=[NH2+])NC(N)=O DIVVEJ
O=C(O)C1=C(c2ccccc2)C(=O)C(=Cc2ccccc2)O1 DIVWEK
NNC(NN)=[NH+]N DIWCOB
CN(C)c1nc[nH+]c2[nH]cnc21 DIXJEZ
O=Cc1ccccc1OCC(=O)O DIYDIY
CC(O)C(O)C1CNc2[nH]c(N)[nH+]c(=O)c2[NH2+]1 DIYPOQ
O=C(N1CC1)N1CC1 DIYPUW
CC(=O)C1=CCCC2CCC1[NH2+]2 DIZPUX
COC(=O)C(=O)OC DMEOXA01
S=C([S-])c1ccc(C(=S)[S-])cc1 DOCCIH
N#Cc1nsc(C(Cl)=NSN=C(Cl)c2nc(C#N)ns2)n1 DOCFIK
CC(=NO)C(=NO)n1cccc(C)c1=O DOCWUN
CCS(=O)(=O)N(S(=O)(=O)CC)S(=O)(=O)CC DODNOZ
CCS(=O)(=O)NS(=O)(=O)CC DODNUF
O=S1(=O)CC2C3C=CC3C2C1 DOJPAT
C[NH+](C)C(CSS(=O)(=O)[O-])CSS(=O)(=O)[O-] DONFOB
NC(=O)N1CCS1(=O)=O DOSNOO
S=CN(C=S)c1ccccc1 DOTNIJ
NC1=NS(=O)(=O)NC(=O)C1 DOTVEN
CCOc1ccc(C2(C(=O)O)CC2(Cl)Cl)cc1 DOTWOY
CSc1nc(N)oc(=O)c1C#N DOWDEY
[NH3+]C(C[N+]([O-])=NO)C(=O)[O-] DOXXAP
ON=C1Cc2ccccc21 DOXZOF
C[NH+](C)NC(=O)C(F)(F)[N+](=O)[O-] DOZFON
O=[N+]([O-])Nc1nnc(N[N+](=O)[O-])[n-]1 DOZNIP
Cn1c(=O)n2n(c1=O)C1C=CC2C1 DUBNET
CC1=NN(CO)C(C)N=N1 DUDMUK
N#CC(=NO)c1ccccc1 DUGMUN
CN(S(C)(=O)=O)S(C)(=O)=O DUGWIL01
CC(=O)N1C=CS(=O)(=O)C=C1 DUJHEV
CN1CCOC2(c3ccco3)C1OCCN2C DUJMEA
Nc1n[nH+]c(N)s1 DUKVAG
NC1C(O)OC(CS(=O)(=O)O)C(O)C1O DUKWUB
OCC12OC3CCN(CC1Br)C32 DULTIN
COC1OCC2OC(=S)OC2C1OC DUMHIC
CN(CC1(CN(C)[N+](=O)[O-])COC1)[N+](=O)[O-] DUMPAC
CSC(=C[N+](=O)[O-])Nc1ccccc1Cl DUPHEB
O=S(=O)(c1ccccc1)n1cccc1 DUPTAJ
CC1=CC(C)(C)[N+]([O-])=[N+]1[O-] DURDID
COC1(C2=[NH+]CCN2)COc2ccccc2O1 DUTHIJ
Cc1c(C=Cc2cnccn2)ssc1=S DUVHUX10
Cn1c2n[nH]nc2c(=O)[nH]c1=O DUVXIB
CN1CC[N+](C)(C)P1Cl DUWGAD
CON=C(Nc1nonc1N)C(Cl)(Cl)Cl DUWKUB
O=[N+]([O-])C1=CC(O)C(O)C(CO)O1 DUWRIW
O=C(NO)C(=O)NO DUXTIZ
CC(=O)N1N=C([S+2](C)=O)SC1c1ccccc1 DUXWUO
CC(=O)N1N=C([S+2](C)=O)[S+2](=O)C1c1ccccc1 DUXXAV
CC12CC3(C)OC(C)(C1)N(N)C(C)(C2)N3N DUYNOA
CN(C)C(OC(=CC(=O)c1ccccc1)c1ccccc1)=[N+](C)C DUYPES
CC(C)(C)P1CP(C(C)(C)C)NN1 DUYRAQ
CC(=O)N1N=C(C)C2C3C=CC(C3)P21 FACMIF
O=[N+]([O-])C1OC(CO)C(O)C1O FACREG
N#Cc1occ2cc3c(cc21)OCO3 FACYAJ
O=c1[nH][nH]c2ccccc21 FADMIG
CS(=O)(=O)ON(S(C)(=O)=O)S(C)(=O)=O FADVEL
CS(=N)(=O)CCC([NH3+])C(=O)[O-] FADVUB
CN(C)C(=[N+](C)C)P(=O)([O-])C(N(C)C)=[N+](C)C FAGBUK
CS(=O)(=O)N1C(=O)CC1c1ccccc1 FAGCOF
ClP1Oc2ccccc2O1 FAGLII
O=C1C(=O)C(=O)C1=O FAGVEO
O=C1C([O-])=C(Br)C(=O)C([O-])=C1Br FAGZOC
O=S1(=O)CC2C=CC3c4ccccc4N1C3N2 FAHPUZ
CNc1nc[n+](C)c2c1[nH]c(=O)n2C FAHSUC
CSC(c1ccccc1)=[N+](C)[O-] FAHYUI
CC1=C(c2ccccc2)OS(=O)(=O)NC1=O FAHZET
COc1nc(=O)[nH]c(OC)n1 FAJWIW
CC1OP(=S)(N(C)C)c2ccccc21 FAMHAC
O=C1CCC(=O)N1Br FAMYUN
O=C1NC(=O)NP(=O)([S-])N1 FAPLUD
c1ccn2c(c1)nc1nc3ccccn3c12 FARMAM
N#CC(C#N)=c1c2nsnc2c(=C(C#N)C#N)c2nsnc21 FARSOG
CC(N)=NC(=S)[S-] FARWEA
NN=C(NN)NN FASGUB
CN(C)[P+]1([O-])NN(C)[P+]([S-])(Oc2ccccc2)N(C)N1 FASJIS
COc1cccc(C(=O)N[P+]([O-])(N2CC2)N2CC2)c1 FATLIV
O=c1[nH]c[nH+]c2n[nH]cc21 FAXFUF10
CN1C(=O)c2ccccc2NS1(=O)=O FAXVAB
CCCC[n+]1ccccc1 FAXVEF
O=[N+]([O-])c1cc(C(F)(F)F)cc2nc3ccccn3c21 FAXVIJ
CSC([O-])=C(C#N)C#N FAZBAJ
ClC(=C(Cl)[Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl FAZKUM
CC(C)(C)N(F)c1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-] FBATNB
CC(C)=C1C=CN(C)N=CC1=O FECXEQ
O=C1CCC([P+]([O-])(O)O)N1 FEGSEP
C=C1CC1C(N)=O FEHDAX
C=C=C1C(=O)NC1Cc1ccccc1 FEJJEJ
C(C1CC1)[NH+]1CC[NH+](CC2CC2)CC1 FEJKIO
OCCNC(=S)c1ccco1 FELYIE
CC(=O)c1ccc(N(O)C(C)=O)cc1 FELYUQ
O=C([O-])C1C2C=CCCCCC21 FEMGEJ
CC(=NO)c1no[n+]([O-])c1C FENCOQ
CNC(=O)c1noc(C)n1 FENHAH
CN(C)C12SCCN1C(=S)NC2(C)C FENJIR
CCC(C)(NC(=S)N(C)C)C1=NCCS1 FENJOX
O=C1N(CCS)C(=S)NC12CCCC2 FENJUD
CN(C)C(=P)N(C)C FENNUH
CC(C)(C)OC(=O)C1CCCN2C(=O)C(=[N+]=[N-])C(=O)N12 FENYIG
CC(=[NH2+])NC(=S)[S-] FEPWAY
N#CSC(F)(F)C(F)(F)SC#N FEPWOM
O=CN(C=O)C=O FESCAH
NC(=NOC(O)C(Cl)(Cl)Cl)c1ccccc1 FESMIZ
C1N2CN3CN1C[NH+](C2)C3 FETRUR
O=C1C2CC(O)C(O)C2C1N1C(=O)CCC1=O FETWOQ
CN1C(=O)NC(=NCl)C(Cl)(Cl)C1O FEVNUP
O=[N+]([O-])N1CCN([N+](=O)[O-])c2nonc21 FEYLUQ
[O-]C(=S)NNC([O-])=S FEZPOP
CC1=NNc2nc(-c3ccccc3)cc(=O)n2N1 FEZRUX
O=C(c1ccc([N+](=O)[O-])cc1)N1CCCCO1 FIBLIL
COc1c([N+](=O)[O-])ncn1C FICDOK
C[S+2](=O)C12CC(C)(C)CC(C)(C)C1O2 FIFGUW
NC1CC1 FIGYID
O=c1[nH]c(=O)n(C2CC(O)C(CO)O2)cc1C=CBr FIHXID
N#CC1=C(N)C(C#N)(C#N)CC(C#N)(C#N)C1 FIKJAK
S=c1[nH]c(-c2ccccc2)cs1 FIKZOO10
Cc1[nH]c(=O)c(C#N)cc1-c1ccncc1 FILGEM
CC1(C)c2ccccc2[S+2](=O)N1O FILNOD
ClC(Cl)(Cl)C1OP2OC(C(Cl)(Cl)Cl)P1C(C(Cl)(Cl)Cl)O2 FINBIN
[NH3+]C1(C(=O)O)CC(CO)C1 FINPEX
CCOC(=O)C1=C(N)C(C)(O)N=C1C FITGIY
N#CC1C(C#N)C1C#N FITSEG
C[n+]1cnc(N)c2[nH]cnc21 FITTIL
Cc1cn(C)cc(C(C)C(C#N)C(N)=S)c1=O FIVNUT
CCCCNC(=O)Nc1nsc2ccccc21 FIVRAD
CC(=O)c1c([O-])on[n+]1-c1ccc(C)cc1 FIXPIL
CC1CS(=O)(c2ccccc2)=NC(=O)O1 FIYBIY
Cc1ccc(S(=O)(=O)N=[S+2]2C(Cl)=C(Cl)C(Cl)=C2Cl)cc1 FIZGEA
CCOC(=O)N=S1(=O)C(Cl)=C(Cl)C(Cl)=C1Cl FIZGOK
COc1nnc(OC)nn1 FIZJED
[NH3+]C1(C(=O)[O-])CC1 FOBJUB01
CNC(=O)C12CC(C1)CN2C(C)=O FODTUN
C[Si]1(C)C[N+]2=C(CCCC2)O1 FOGBIM
NC(N)=Nc1nc(CSCCC(N)=NS(N)(=O)=O)cs1 FOGVIG01
CCCSc1nc2n(c(=S)n1)CCN2 FOHXEF
Cc1ccc(S(=O)(=O)Cl)cc1 FOHYAC
CCCC1CCOC(C)[S+2]1=O FOJBEL
Cc1ccc(-c2sc(=O)n3c2SCC3=O)cc1 FOJPAV
CC(C)CC1NC(=O)C2CCN2C1=O FONCOA
COC(=O)c1ccc(I)cc1 FORGOI
CC(SC#N)=C(C)[N+](=O)[O-] FORHEZ
ClC12C3C4(Cl)C5(Cl)C(C1(Cl)C4(Cl)Cl)C2(Cl)C(Cl)(Cl)C35Cl FORJIF
CSc1nc(N)n(-c2c(C)cccc2C)n1 FORJUR
CN(C)C(C(=S)[S-])N(C)C FORTAH
[S-][P+](N1CC1)(N1CC1)N1CCN=C1C(Cl)(Cl)Cl FOSDIA
CC1=NC(N)=NC(N)N1 FOVHUT
CC(=O)OC1(C)C2C=C(C)C(=O)C21 FOVJIJ
Cc1[nH+]c2c(OCc3ccccc3)nccn2c1N FOVRAJ
CC1CC(=O)NN=C1c1ccc(-n2cc[nH+]c2)cc1 FOVRUD
CC1(C)N=Nc2c1c1nccn1nc2Cl FOWBEY
COc1ccc(Nc2nn3nnnc3[nH]c2=O)cc1 FOWPOW
O=c1sc(=O)c2sc3c(=O)sc(=O)c3sc12 FOWVES
O=COC1C2CC3C4C(=O)CC(C4C2)C31 FOWZAS
NC(=[NH2+])c1ccccc1 FOYMAH
O=[N+]([O-])c1cc2ccc3c(c2o1)CCCC3 FOYNUC
CN(C)[SiH](Cl)Cl FUCMIZ
c1nc2scnc2s1 FUCMUL
O=[N+]([O-])[O-] FUCTIG01
Cn1cnc2c(ncn2C2OC(CO)C(O)C2O)c1=N FUCWIJ
Nc1nc2[nH]cnc2c(-[n+]2ccccc2)n1 FUCWOP
O=c1c(O)c1O FUDPOJ
C[NH2+]CC#N FUDXUX
CC1(O)C(=O)NC(=O)NC1OO FUFDIT
Nc1nc[nH+]c2c(C3OC(CO)CC3O)n[nH]c21 FUGWIN
CONOC FUHFAP
N#CC(=Cc1ccccc1)[N+](=O)[O-] FUHSEG
NC(=[NH2+])c1nc(N)n(C2OC(CO)C(O)C2O)n1 FULRAF
CCOC(=O)C([N+](=O)[O-])S(=O)(=O)[O-] FUNSIQ
COc1ccc(C(=O)c2ccoc2)cc1 FUNXOB
CC(C)(C)OC(=O)n1n[n+]([O-])c2ccccc21 FUPJUV
CS(=O)(=O)On1nnc2ccccc21 FUPKIK
CON=C(C(=O)n1n[n+]([O-])c2ccccc21)c1csc(N)n1 FUPKOQ
ClC(Cl)=C1SC(C(Cl)(Cl)Cl)OC(C(Cl)(Cl)Cl)S1 FUPTOZ
CC(=O)OC1C(C)(C)C2CC=C(C)C21O FUPZEV
O=CC=C[O-] FUSPEO
CC1(C)NN(c2ccccc2)C1=O FUTCEC
CO[SiH3] FUTZEZ
CC(=O)OC1C2C(OC(C)=O)C3C(OC(C)=O)C1n1n2n13 FUVDOP
CN(C)C(=[OH+])CCCC(=[OH+])N(C)C FUVMUE
CN(C)c1ccc(C(=O)c2ccc(N(C)C)cc2)cc1 FUVNEP
COc1ccc(C=[NH+]O)cc1 FUVXOJ
O=C1OCCN1S(=O)(=O)Nc1ccccc1 FUWMOZ
CC12CP3S[P+]([S-])(C1)SP3C2 FUWTUM
[NH3+]CCC[NH2+]CCSP(=O)([O-])[O-] FUXXAX
COC=C(C#N)S(=O)(=O)C(C#N)=COC FUXZED
CN(C)c1cccc2cccc([NH+](C)C)c21 GADHEY
CC(=O)OC1CC2CC1c1cc([N+](=O)[O-])[n+]([O-])cc12 GAFNUW
CCC(C(=O)O)N(O)C(C)=O GAHPIO
O=S(=O)([O-])[n+]1ccccc1 GAJTEQ
Cc1c2c(n3c1=CCCC3)=C(C)C(=O)O2 GAKGOO
O=[N+]([O-])c1ccc(Cl)c2nonc21 GAKNEL
CC=C1[S+2](=O)CCC[S+2]1=O GAKNIP
CC1=Cc2ccccc2S1(=O)=O GAKPEN
c1scc2c1sc1cscc12 GAKTAN
O=c1cc(O)c1=O GANHUY
O=S1(=O)C(Br)=Cc2ccccc21 GAPMEP
Cc1no[n+]([O-])c1N GAVKOD
Cc1nc(O)c(-c2ccccc2)s1 GAVMEV
CN1CCCO[P+]1([O-])OC(=O)c1ccccc1 GAWWOQ
[NH3+]C1(C(=O)[O-])CC(C(=O)[O-])(S(=O)(=O)c2ccccc2)C1 GEHBOK
NC(=O)C(=O)NSSSNC(=O)C(N)=O GEHPUE
CCOC1=NC23CCCCC2(N=C(OCC)N3Cl)N1Cl GEHXEW
CN(C)C(F)=PC(F)(F)F GEJYOJ
CC(C)(C)NN GEKXEZ
CC1(C#N)CC1(C)C#N GEMCEG
COC1(C#N)CC1(C#N)OC GEMCOQ
CN(C)C1(C#N)CC1(C#N)N(C)C GEMDAD
O=S(=O)([O-])c1[nH]c2ccccc2[nH+]1 GERCUB
Cc1c(CCO)sc[n+]1Cc1cnc(C)nc1N GESCIQ
c1ccc2c(c1)C2 GESNIB
Cc1ccc(S(=O)(=O)N(C)C)cc1 GESSUS
[N-]=[N+]=C1C=C([N+](=O)[O-])C=C([N+](=O)[O-])C1=O GETFIU
N#[N+]c1cc([N+](=O)[O-])c(Cl)c([N+](=O)[O-])c1[O-] GETFOA
[S-][P+]1(Sc2ccccc2)S[P+]([S-])(Sc2ccccc2)S1 GETJOE
O=C1C=CN(c2ccccc2)C1 GEWTAD
O=C(O)Cn1cc[n+](CC(=O)O)c1 GEXGIZ
Cc1c(C(=O)NCCO)[n+]([O-])c2ccccc2[n+]1[O-] GEYWOW
O=[N+]([O-])n1cnc(N=Nc2ncn([N+](=O)[O-])n2)n1 GICTIV01
COC(=O)C12CC(OC1=O)C(Br)(C#N)CC2 GIDJUY
[N-]=[N+]=Nc1ccc2[nH+]c(N)nc(N)c2c1 GIDMEL
NC(=O)NC(=O)Nc1ccn(C2CC(O)C(CO)O2)c(=O)n1 GIDTIW
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(N)cc2)n1 GIFRAO
c1cc2cnc3ccc4ncccc4c3n2c1 GIGCEE
c1cc2sc1CSCCSCCSC2 GIGMUE
COC(=O)C12C3C(=O)C1C32C(=O)OC GIHZEC
O=C1[N-]S(=O)(=O)c2cccc(O)c21 GIJMOB01
O=C1C=Cc2cc(Br)cn21 GIKJIT
CC([NH3+])C(Sc1ccccc1)C(=O)[O-] GIKNOD
O=CC1=COC2OC1OC=C2C=O GIKTUP
ClC1=NC2(Cl)C(Cl)C1(Cl)C1C3CCC(C3)C12 GIMJIV
COC(=O)Cc1cc(=O)nc2sccn21 GINMUL
O=C([O-])C(Cc1ccccc1)C(=O)O GIPHES
CN1CCP2C1(C)P1CCN(C)C21C GIRDOA01
O=c1[nH]c(=O)n2c(=O)[nH]c(=O)n12 GOHVUU
ClC(Cl)(Cl)C1OC(C(Cl)(Cl)Cl)SC(Cl)(C(Cl)(Cl)Cl)S1 GOJCIR
O=[N+]([O-])c1cccnc1Sc1nc[nH]n1 GOJKIZ
Nc1nc2[nH]c[nH+]c2c(=O)[nH]1 GUANCH01
Oc1ccccc1C(=S)N1CCCCC1 HYTPRD01
N#Cc1snc2c1SSSSS2 ISTZCN10
Cc1csc(=S)n1-c1cccc(C)c1C JABGAU
S=c1ssc2cc(Cl)ccc12 JADLIJ
CC1(C)OCC(C2OC(C)(C)OC2C2OC2[N+](=O)[O-])O1 JADXER
CC1(S(C)(=O)=O)OC1c1ccccc1 JAHKOS
COC1=C(c2ccc(Cl)cc2)C1(C)C JAHTOB
ClC12CCCN(CCC1)C2(Cl)Cl JAHYEW
c1ccc2c(c1)P1CCP2CC1 JAKGUX
CNc1ccc(C)cc1N=O JAKJOU
O=[S-](=S)C12CC3CC(CC(C3)C1)C2 JALSOE
CN(C)C(=O)COC(=O)Cc1ccc(OC(=O)c2ccc(NC(N)=[NH2+])cc2)cc1 JAMREU
COC1C(Sc2ncccn2)=C(C(=O)OCc2ccc([N+](=O)[O-])cc2)N2C(=O)C(C(C)O)C12 JANDOR
COP(=O)([O-])C(=NO)c1ccccc1 JANMAM
O=C1C(=Cc2cccc([N+](=O)[O-])c2)N=C2SCCN12 JAPFAH
COC(=NN=C(OC)OC)OC JATBIP
Nc1ncnc2nc(Cl)sc21 JATCOW
NC(N)=[NH+]c1nc(CSCCC(N)=NS(N)(=O)=O)cs1 JATLOF
CN(C)Nc1nc(CSCCC(N)=NS(N)(=O)=O)cs1 JATMEW
CN(C)Sc1ccccc1[N+](=O)[O-] JAVGAO
Cn1c2c(nc(N)[nH]c2=O)n(C2OC(CO)C(O)C2O)c1=O JAWJIA
OC1CNC1 JAWMAV
C=C(C)C=C=C1CC(O)C2OC2C1O JAWVEI
O=P([O-])(c1ncc[nH]1)c1ncc[nH]1 JAWZEM
CC1(C)C2CCC13CS(=O)(=O)N1OC13C(=O)O2 JAZGOG
NC(=S)c1ncn(C2OC(COS(N)(=O)=O)C(O)C2O)n1 JAZVIP10
Nc1nc2c(ncn2C2OC(CO)C(O)C2O)c(S(N)(=O)=O)n1 JAZZOZ10
O=P1(c2ccccc2)Nc2ccccc2N1 JEBFEB01
CC1CN1CC(O)Cn1ccnc1[N+](=O)[O-] JECVES
CNC(=O)ON(C(C)=O)C(=O)NC JECVUI
CCC(N=[N+]=[N-])P1(=O)N(C)C2CCCCC2N1C JECYIZ
CN(C)C(=S)N=c1nc(N(C)C)sc(N(C)C)n1 JEFRAN
COc1nc(N)nc2c1ncn2C JEHCUU01
[NH3+]NS(=O)(=O)c1ccccc1 JEHXOJ
[O-][P+](Cl)(Cl)C1(O)CCCCC1 JELKUG
O=C1c2ccccc2[N+]([O-])=C1c1ncccn1 JELREX
COC(=O)C1=[N+]([O-])c2ccccc2C1=O JELRIB
[NH3+]CC(F)(F)P(=O)([O-])O JEMHIS
FC(F)(F)C1=C(C(F)(F)C(F)(F)F)OCCOC1(F)F JEMWUT
CN[Si](NC)(NC)NC JESFES
CC(O)(P(=O)([O-])O)P(=O)(O)O JETJUN
CC1(C)CC(=O)C(=CNO)C(=O)C1 JEVXIR
O=P1(N(CCCl)CCCl)NC(c2cccnc2)CCO1 JEWFAS
O=c1c(Cl)c2n3c(c(Cl)c(=O)n13)CSC2 JEWPIK
CN(C)c1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1 JEXREJ
O=C(O)Cc1c[nH]c2ccc(O)cc12 JEYBUK
Cc1ccc(S(=O)(=O)N2C(CO)C2CO)cc1 JIDHIN
NCC1=[NH+]c2ccccc2S(=O)(=O)N1 JIFYUS
Cc1noc2nsc(N)c12 JIGCIL
CC(C#CC1=C(Cl)C(=O)C(O)=C(Cl)C1=O)=CCl JIGRAS
CC(=NO)[N+](=O)[O-] JIHVEB
O=c1[nH]c(=O)n(C2CC(O)C(O)CO2)cc1I JIKHUG
O=[N+]([O-])c1n[n-]c2ccc([N+](=O)[O-])cc21 JILWUW
CS(=O)(=O)N(O)c1ccccc1 JINDAL
C[N+]1(C)CCc2c[nH]c3ccc(OS(=O)(=O)[O-])c1c23 JINDOZ
CS(=O)(=O)C=CC#N JIRJID
COc1cccc2c1C(O)[N+](C)(C)C2C JISZAM
CC1(C(F)(F)F)OS(=O)(=O)C=C1N1CCCCC1 JITMII
[O-][n+]1ccc(O)c(O)c1-c1c(O)c(O)cc[n+]1[O-] JIWKOP
COC(N)=C(C#N)N=Cc1ccc(O)cc1 JIXBAT
COc1c2oc(=O)cc-2c(F)c(F)c(F)c1F JIYJAC
CCn1c[nH+]cc1[N+](=O)[O-] JIYREO
[O-]c1ccccn1 JIYTOA
CC(C)(C)N(SN(C(C)(C)C)[Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl JIZWUK
C[Si](C)(CCl)N=C=O JOFDUD
CC1(C2CC2)C2(CC2)C(=O)C1(Cl)Cl KAFXIY
COc1cccc(OC)c1-c1cc(=O)c2ccccc2o1 KAGBOJ
CC1(C)C(=O)N2c3ccccc3SC21C KAKGOS
O=c1[nH]c(=O)n(C2CC(O)C(CO)O2)cc1C1CC1(Br)Br KAMCUW
C[N+]([O-])=C(Cn1cncn1)c1ccc(Cl)cc1 KAMJAJ
N#CC(C#N)=c1ccc(=C(C#N)C#N)c2nsnc21 KANWEB
CC1(C)OC2C(CO)OC(Nc3nc(Cl)nc4c(Cl)nc(Cl)nc34)C2O1 KANZOO
Cn1cc[n+](C)c1C(=S)[S-] KAPCUZ
CC1(C)C2CC3CC2C(C#N)(C3)S1(=O)=O KARYAD
N#CN(Cc1ccccc1)[N+](=O)[O-] KASBAH
COc1ccc(C#CC(=O)O)cc1OC KASBOV
CC1=C2N=C(c3ccccc3)S(=O)(=O)N=C2N(C)N1 KATNAU
O=[N+]([O-])c1cn([N+](=O)[O-])cn1 KAVFUI
CC(=O)OCC1CC2CC(=O)ON2CO1 KAVTEG
CC1=CC(=CC(=S)C(F)(F)C(F)F)SC(C(F)(F)C(F)F)=C1 KECSIU
Clc1nc(C(Cl)(Cl)Cl)nn1C(Cl)(Cl)C(Cl)(Cl)Cl KECSUG
COc1csc(-c2cc(OC)cs2)c1 KEDYAT
COc1oc(Nc2ccccc2)nc1C#N KEFJEK
CC1(C)OP(=O)([O-])C=C1C(N)=O KEJFOU
CCc1nnc([N-]S(=O)(=O)c2ccc(N)cc2)s1 KEMFAJ
O=S(=O)(Cl)N=C1OC2C=CC3C(C2)C13 KENHOA
[O-][n+]1onc2c1ccc1nnnn12 KEPKIZ
CC(C)(C)[N+]([O-])=Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] KESNEB
[N-]=[N+]=Nc1nsnc1N KEWJIF
O=CO KHDFRM11
CSC(=NC(N)=N[N+](=O)[O-])N1CCCC1 KIBDII
Cc1cc(-c2ccccc2)n[n+]([O-])n1 KIBFAC
N#CCCOP(F)F KICCUU
ClC1=C(Cl)C2(Cl)C3CC4C(C3Cl)C1(Cl)C42Cl KICGAE
COC1OCC2O[PH](=O)OC1C2O KICLAJ
ClP1Nc2ccccc2S1 KIGKIU
[O-][N+](c1c(F)c(F)nc(F)c1F)=[N+]([O-])c1c(F)c(F)nc(F)c1F KIKVUV
[O-]C(F)(F)F KIMLEX01
CC(C)(C)SC(C#N)=CN1CC=CCO1 KINKUN
[C-]#[N+]CCCN(CCC[N+]#[C-])CCC[N+]#[C-] KINTUW
CCOC1=NNC(=O)C2C3CC(C4c5ccccc5C43)C12 KINWEJ
[NH3+]C(CC(F)C(=O)[O-])C(=O)O KINWIN
COC(=O)C1ON2OC1c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C2([N+](=O)[O-])[N+](=O)[O-] KIRCAP
CNC(=O)C1(C(=O)OC)CN1Cl KIRCOD
Nc1[nH+]cnc2c1ncn2CCOCP(=O)([O-])O KITREK
N=C(SSC(C(F)(F)F)C(F)(F)F)C(N)=S KIYGAA
Nc1[nH][nH]c(=O)c1[N+](=O)[O-] KOBXOO
c1nc(-n2cnnc2)n[nH]1 KOBYOP
N#CC1=C(Nn2c(-c3ccccn3)nnc2-c2ccccn2)C(=O)C(Cl)=C(Cl)C1=O KOBZEG
N#Cc1ccsc1-n1cccc1C=O KOCWUU
CCC(I)C(=O)N1C(C)CCC1C KODFUE
O=NN1CN([N+](=O)[O-])CCN([N+](=O)[O-])C1 KOFKIZ
CCOC(=O)Nc1ncc(-c2ccccc2)o1 KOFMEX
CC1(Cn2ccnn2)C(C(=O)O)N2C(=O)CC2S1(=O)=O KOFNIC
CC#COS(=O)(=O)c1ccc(C)cc1 KOHVEI
C#COC(=O)c1ccccc1 KOHVIM
Cc1cc(C)n(C(=S)n2nc(C)cc2C)n1 KOJGOF
CN1CC#CCN(C)CC#CC1 KOJKID
Cn1c(N)c(N=O)c(=O)n(C)c1=O KOJZOY
CCOP1(=O)NC(=NC#N)N(C)C1(C)C KOKMIG
ClC(Cl)(Cl)SN=C(c1ccccc1)N(SC(Cl)(Cl)Cl)SC(Cl)(Cl)Cl KOLCUJ
CN(C)C=CC=CC=[N+](C)C MAPMIP03
COSc1ccccc1[N+](=O)[O-] MENBZS01
COC(=O)c1ccccc1[S+2](C)=O METBZC10
CCN(CC)C(=S)[S-] NAESCB01
O=C([O-])C(=O)O NHOXAL06
CC1=C(C)OP(=O)(n2cncn2)O1 PHOSLA10
CC1=C(C)OP(=O)(N=C(N(C)C)N(C)C)O1 PHOSLB10
c1ccc(C2CN3CCSC3=N2)cc1 PIMTAZ01
O=C([O-])c1ccc[nH+]c1C(=O)[O-] QUICNA01
CCOC(=NC(=O)OC)Nc1c[nH]c(=O)[nH]c1=O SABNOY
CCCCCCCSc1ncnc2[nH]cnc21 SACXAV
Cn1c(=O)ccn2c1nc(=O)n(C)c2=O SADXAW
c1nc(-c2cscn2)cs1 SAFFOU
c1csc(-c2nccs2)n1 SAFFUA
[N-]=[N+]=C(C(=O)O)[N+](=O)[O-] SAFKAL
CC(O)C1C(=O)N2C(C(=O)[O-])=C(SCCNC=N)CC12 SAHSOJ
NC=[NH+]CCSc1ccccc1C(=O)[O-] SAHSUP
N#CC12C(=O)C(Cl)=C(Cl)C(=O)C1(C#N)C21c2ccccc2-c2ccccc21 SAKGUG
CC(C)C1N[S+2](=O)C2C(=O)N(C)C(=O)C12 SALVEG
O=S(=O)([N-]C(=S)[S-])c1ccccc1 SAMFUH
C=C1N(C)C(=S)N(C)P1(=S)N(CC)CC SAMXUZ
O=c1cc[nH]c2c1cnn2C1CC(O)C(CO)O1 SANKEX10
CC1C(C(C)(C)C)O[S+2](=O)OC1C(C)(C)C SAVDOI
Nn1ccc(-c2ccccc2)n1 SAWKEG10
c1ccc(CC2=[NH+]CCN2)cc1 SEBPEU01
CN1C(C(=O)Nc2ccccn2)=C([O-])c2ccccc2S1(=O)=O SECDAF
O=c1[nH]cnc2sc3c(c21)CCCC3 SEFRAW
CC(=S)NP(=S)(OC(C)C)OC(C)C SEFYIL
NC(=S)NN=C(C(=O)[O-])c1ccccc1 SEGFIT
Cl[Si]1(Cl)Oc2ccccc2O[Si](Cl)(Cl)Oc2ccccc2O1 SEGJAP
NNS(=O)(=O)c1ccccc1 SEGLAR
NC(=S)NN=C(C(=O)[O-])C(=O)O SEGNEX
ClC(Cl)(Cl)C12CC(I)(C1)C2 SEGWEG
Cc1cc(C)c(O)c(C[N+](C)(C)[O-])c1 SEHBEM
O=C1C2(CC2)C(=C2CCOC2=O)C12CC2 SEJDAM
CC=C=CC1(C)CCCCC1=NO SEKKIC
Nn1nc2ccccc2n1 SEKPED
Nn1cnc2ccccc21 SEKPIH
O[Si](c1ccccc1)(c1ccccc1)c1ccccc1 SELFIY
CC[N+](CC)(CC)C(F)[S-](=O)=O SEMDIX
COC(=O)C(C#N)=C1NN=NN1c1ccccc1 SEMXOX
O=S1(=O)C=C(c2ccccc2)S(=O)(=O)CC1 SETHAA
FC(F)(F)C1(C(F)(F)F)N=C(Nc2ccccc2)SS1 SETLIM
c1n[nH]c2c[nH+]ccc12 SEYVUN
COC(=S)[N-][N+]1=C(N(C)C)C(C)(C)NC1=O SEYWUO
OC1C(Cl)(Cl)C(=C(Cl)Cl)C2(OC2Cl)C1(Cl)Cl SEZMEP
O=C(O)CN(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[N+](=O)[O-] SICNUN
CC(=Nc1ccccc1O)c1cccs1 SICPEZ
c1ccc(-n2nc3nccnc3n2)cc1 SICSEC
N#CC(C#N)=c1cc(I)c(=C(C#N)C#N)cc1I SIDFIU
Cn1nn[n+](C)c1C(N=N[N-]S(C)(=O)=O)C(C)(C)C SIDRUS
CCP1C([NH+](C)C)P(CC)C1[NH+](C)C SINMIL
COP(=O)(OC)C1NC(C(C)C)SC1(C)C SIYLOB
N#CC1(OC2OC(CO)C(O)C(O)C2O)CC(O)C2OC21 SIZJIU
NC(=O)c1csc(C2C=CC(CO)O2)n1 SIZWUT
Cc1cc(NS(=O)(=O)c2ccc(N)cc2)no1 SLFNMB04
CN1NC(C)(C)n2cnc([N+](=O)[O-])c2C1=O SOGVOZ
CC(=N[NH+]=C(N)N)C1=C(C)[N+](=C(N)N)N=C1 SOHXOC
CC(=O)N=c1sc(S(N)(=O)=O)nn1C SOJNEK
CC1(C)C(C#N)N2C(=O)C(Br)(Br)C2[S+2]1=O SOMKIO
CCCN1CCC=C2c3nc(N)sc3CCC21 SONZIE
CC(=O)C=c1sc(=C(C#N)C#N)s1 SOPZEC
O=[N+]([O-])c1ccc(-n2nc(Cl)nc2Cl)cc1 SORBIK
NC(N)=S(=O)=O SURDOX02
O=[N+]([O-])c1cnn(Cn2cc([N+](=O)[O-])cn2)c1 TACGIN
O=C([O-])C1(C(O)c2ccncc2)CC[NH2+]1 TACLEO
O=NN1CCN(N=O)c2nonc21 TAFKIU
BrC1C(Br)C2c3ccccc3C1C(Br)C2(Br)Br TAFXIH
O=[N+]([O-])c1ccccc1SCl TAFZIJ
O=C([O-])c1c[nH]c(=O)[nH]c1=O TAGVIG
CC(C)(C#N)N=NC(N)=O TAHMOE
Nc1cc[n+](Oc2ccc([N+](=O)[O-])cn2)cc1 TAJPUP
O=C([O-])C[n+]1cn(N=C([O-])Cc2ccccc2)cn1 TAJSUS
[S-]c1nnns1 TAJVUV
O=C(Sc1nnns1)c1ccccc1 TAJWAC
ClC(Cl)=C1C(=C(Cl)Cl)C(Cl)(Cl)C1(Cl)Cl TAKHES
O=S1(=O)[N-]C(=S)c2ccccc21 TAMMAV
N#CC1([N+](=O)[O-])C=C1c1ccccc1 TANHAR
CC1(O)c2ccccc2-[n+]2noc([O-])c21 TAPJUP
N#CC(C#N)c1ccc(N)cc1 TAPSAE
N#CCP(CC#N)CC#N TCYMPH02
CC12C(=O)C(=O)C3(C)C1(C)C23C TMTCHD01
CNNc1ncnc2ncccc21 VABLIT
COC1OC(C=O)C2OC(C)(C)OC12 VABROF
CC(=O)CCn1nc([N+](=O)[O-])nc1N1CC1 VACRUM
Cc1ccc(S(=O)(=O)N2SC(C#N)=C(C#N)S2)cc1 VAJFAN
COC(=S)[S-] VALTEH
O=[S-](=O)C(F)(F)SC(F)(F)[N+]12CCC(CC1)CC2 VALWOU
Nc1ccnn2c1nnc2C1OC(CO)C(O)C1O VAPZOB10
Cc1cc2oc(=O)c(C)cc2o1 VASDOI
CSc1c2c3c(n1C)C(=O)C(=O)C(Cl)=C3NCC2 VATKAC
COP1(=O)CC([N+](=O)[O-])=C(C)C1=[NH+][O-] VAWDUS
NS(=O)(=O)c1ncn(C2OC(CO)C(O)C2O)n1 VAWMOV
CC(NC(C)(C)C(C)(C)Br)=C([N+](=O)[O-])[N+](=O)[O-] VAWWAR
CCOCc1c[nH+]c(C)nc1N VAYKUB
COc1cc(C(=O)c2ncc[nH]2)ccc1O VAZHUZ
CSC(=S)C1=C(SC)SC1(SC)SC VECSAX
Cn1cnc2c1C(N)=NS(=O)(=O)N2C VEDTED
C[Si](C)(C)c1[nH]ncc1[N+](=O)[O-] VEHCOA
O=S1(=O)C=C(CCl)OC(N2CCOCC2)=N1 VEHZOX
COC(=O)C(Cl)(C(=O)OC)c1sc(Cl)c(Cl)c1Cl VEJWOW
CC(=O)[n+]1ccc(N(C)C)cc1 VEKMON
C=C1C2C3C(=C)C4C1C4C(=C)C23 VENYUI
O=[N+]([O-])c1nc(-c2nc([N+](=O)[O-])c([N+](=O)[O-])[nH]2)[nH]c1[N+](=O)[O-] VETWAS
CC12CP(=O)(c3ccccc3)CC1C2(Cl)Cl VEVDIJ
CC(C)Nc1[nH+]c2ccc(F)cc2n2cnnc12 VEWZOM
N#Cc1ccc2oc3ccccc3c2n1 VEXKOY
ON=C(c1ccccc1)c1ccccn1 VEXMOA
C[Si]1(O)CCC[Si](C)(O)O1 VEYBIK
ON=CC(Cl)=NO VEYWAX
O=P1(CCl)COc2ccccc21 VEZBUX
Cn1c(=O)nc(N)n1C1OC(CO)C(O)C1O VICGAP
Nc1nc2c(ncn2C2CC(O)C(CO)O2)c([S+2](N)=O)n1 VICGET
CC1(C)C2CCC1(C(Cl)=S=O)C(=O)C2 VICKIB
c1coc(CNc2nc[nH+]c3nc[nH]c32)c1 VICPOM
CC1=N[NH2+]C(C)(C)C1 VIDKUO
c1ccc2c(c1)[nH]c1c3ccccc3sc21 VIFFEV
CC(C)(O)C(C)(C)n1cc2c(n1)nc[nH]c2=O VIGPEG
c1ccc2nc3c(nc2c1)C1C2C3C12 VIGTUA
CC1(C)N=C(c2ccccc2)SC1=S=O VIHHID
CC1C(C)C1(C(=O)O)[N+](=O)[O-] VIKVIU
O=C1C2C3C4C2C(Br)([N+](=O)[O-])C2C4CC3C12 VIKYAP
[O-][Cl+3]([O-])([O-])[O-] VIMHII
Cc1c[nH+]c2nc(O)c(C)cn2c1=O VIPXAT
CC1(C(=O)C=[N+]=[N-])C(=O)C2CCCCC21 VIRBON
O=C1OCC1=Cc1ccccc1 VIWCOT
Cn1cnc2sncc(=O)c21 VIXRID
CN1[S+2](=O)C(F)(F)[S+2]1=O VIXXOP
COC(=O)C1(Br)OC2C1OC1OC(C)(C)OC21 VIYPAU
CC1(C)CC(=O)n2c3ccccc3nc2N1 VOBLAZ
O=S1(=O)Cc2ccccc2CN1 VOBWOY
O=C(O)CC1(c2ccccc2)CC1(Br)Br VOFBOH
ClC1(Cl)CC1(CBr)c1ccccc1 VOFCAU
CC(O)=[OH+] VOJGEG
Nc1cccc[n+]1C[PH](=O)[O-] VOJJIN
O=C(N[O-])C(=O)N[O-] VUWXUG
CC(=O)c1oc2ccccc2c1N VUXGOK
NS(=O)(=O)Cc1noc2ccccc21 VUXPUZ
CCOC(=O)c1cc2occc2[nH]1 VUXREL
[C-]#[N+]c1ccc([N+]#[C-])cc1 ZZZIZA01
O=S(=O)(SSS(=O)(=O)c1ccccc1)c1ccccc1 ZZZMVU10
O=C1CCC(=O)N1I ZZZVCQ01
c1cocn1 AR14A
O=CC(=O)O CA04A
C=COC=O CE05A
C=O CO01A
C=CCC=O CO08A
ClC1CCC1 HL08A
C=NC IM02A
C=[NH+]C NC10A
C=[NH2+] NC13A
N NH10A
CC[NH+](C)[O-] NH20A
CC[NH2+][O-] NH22A
CCNO NH23A
C=CO OH10A
S SR01A
CSS SR05A
Sc1ccccc1 SR07A
C[O-] AN05A
C[S-] AN06A
C=C[S-] AN08A
c1nn[n-]n1 AN11A
C=C[NH-] AN12A
FC1CC1 HL11A
C=CF HL13A
CN=O NO03A
CC(C)=[N+]=[N-] NX02A
CC(C)=[OH+] OC02A
O=[PH3] PO02A
CNP(C)(=O)[O-] PO05A
P PR01A
CP PR02A
CPCl PR03A
CC(C)=P PR04A
C[SiH3] SI02A
C[SiH2]O SI03A
CS(=O)(=O)NC(=O)c1ccccc1 SO07A
O=S(=O)(O)O SO12A
C[N-]S(C)(=O)=O SO15A
CC(C)=S=O SO16A
C[S-](=O)=S SO18A
O.[Br-] BRMW1
O.O.O.[Ca+2] CA2PW3
O.[Cl-] CLMW1
O.[Cu+] CU1PW1
O.O.O.[Cu+2] CU2PW3
O.O.O.[Fe+2] FE2PW3
O.O.O.[Fe+3] FE3PW3
O.[F-] FMW1
O.[OH3+] H3OPW1
O.[K+] KPW1
[Li+].O LIPW1
O.O.O.[Mg+2] MG2PW3
O.[Na+] NAPW
[OH-].O OHMW1
O.O.O.[Zn+2] ZN2PW3
CC1NCNS1 ERULE_01
C1CSNN1 ERULE_02
CP[Si](C)(C)C ERULE_03
ClC1CSSN1 ERULE_04
[pH]1[pH][pH]1 ERULE_05
CN(C)F ERULE_06
C1C2CNCN12 ERULE_07
CN1CCN1 ERULE_08