0 B9R1.33 CC1=C(C=NO1)/C=N/O Z4303022155 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.33 CC1=C(C=NO1)CCN Z2310699406 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.33 CC1=C(N=CO1)CCN Z4133751936 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.33 CNCC1=C(C=CS1)C Z85956636 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.33 CNCC1=C(N=CS1)C Z385446916 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.33 CNCC1=C(OC=C1)C Z818732086 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.33 CNCC1=CC=CN1C Z57778741 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.33 CNCC1=CSN=C1C Z4996662980 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.8 CNCC1=COC=C1 Z385447092 [1,0,0,0,0,0|2,0,0]=3 9 B8R1.8 CNCC1=CSC=C1 Z57206125 [1,0,0,0,0,0|2,1,0]=4 10 B8R1.8 CNCC1=NOC=C1 Z802903302 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.8 NCCC1=COC=C1 Z2310701825 [1,0,0,0,0,0|3,0,0]=4 12 B8R1.8 OCCC1=COC=C1 Z1179944659 [1,0,0,0,0,0|3,0,0]=4 13 B8R1.11 CC1=C(C=CO1)C#N Z1079178988 [1,0,0,0,0,0|2,0,0]=3 14 B8R1.11 CC1=C(C=CO1)C=O Z1079442526 [1,0,0,0,0,0|1,1,0]=3 15 B8R1.11 CC1=C(C=CO1)CN Z803145352 [1,0,0,0,0,0|2,0,0]=3 16 B8R1.11 CC1=C(C=CO1)CO Z397587324 [1,0,0,0,0,0|1,1,0]=3 17 B8R1.11 CC1=C(C=CS1)C=O Z1255365611 [1,0,0,0,0,0|1,2,0]=4 18 B8R1.11 CC1=C(C=CS1)CN Z3034293414 [1,0,0,0,0,0|2,1,0]=4 19 B8R1.11 CC1=C(C=NO1)C=O Z826536276 [1,0,0,0,0,0|2,1,0]=4 20 B8R1.11 CC1=C(C=NO1)CN Z2895200737 [1,0,0,0,0,0|3,0,0]=4 21 B8R1.11 CC1=C(N=CO1)C=O Z1198279989 [1,0,0,0,0,0|2,1,0]=4 22 B8R1.11 CNC1=CC=NN1C Z1259162018 [1,0,0,0,0,0|3,0,0]=4 23 B8R1.11 CSC1=CNN=C1N Z802600050 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.11 CSC1=NC=CN1C Z18499760 [1,0,0,0,0,0|3,0,0]=4 25 B8R1.11 O=CC1=C(OC=C1)Br Z1255361306 [1,0,0,0,0,0|2,1,0]=4 26 B10R1.130 CSCC1=CN(N=C1C)C Z2274110711 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.149 CC1=C(C=CO1)C(=O)CCl Z1386913713 [0,1,0,0,0,0|3,0,0]=4 28 B10R1.149 CC1=C(C=CO1)C(=O)NN Z56827318 [0,1,0,0,0,0|3,0,0]=4 29 B10R1.149 COC(=O)C1=C(NC=C1)C Z1198183693 [0,1,0,0,0,0|2,1,0]=4 30 B10R1.149 COC(=O)C1=C(ON=C1)C Z231867432 [0,1,0,0,0,0|2,1,0]=4 31 B10R1.187 CNCC1=C(ON=C1C)C Z102767808 [0,1,0,0,0,0|3,0,0]=4 32 B10R2.7 C1=C2CSCCC2=NN1 Z5030692136 [0,0,0,1,0,0|3,0,0]=4 33 B10R2.7 C1=CC2=C(N1)CCCC2 Z274765016 [0,0,0,1,0,0|3,0,0]=4 34 B10R2.7 C1=CC2=C(S1)CCNC2 Z271099584 [0,0,0,1,0,0|2,1,0]=4 35 B10R1.4 CCNC1=C(C=CC=C1)C Z104477886 [0,0,0,0,0,1|3,0,0]=4 36 B10R1.4 CCNC1=C(C=CC=N1)C Z968907586 [0,0,0,0,0,1|3,0,0]=4 37 B10R1.4 CCNC1=C(C=CN=C1)C Z1946684572 [0,0,0,0,0,1|3,0,0]=4 38 B10R1.4 CCSC1=C(C=CC=C1)Br Z149386616 [0,0,0,0,0,1|3,0,0]=4 39 B10R1.4 CCSC1=C(C=CC=C1)N Z316174690 [0,0,0,0,0,1|3,0,0]=4 40 B10R1.4 CCSC1=C(C=CC=C1)O Z905204460 [0,0,0,0,0,1|3,0,0]=4 41 B10R1.4 CCSC1=CC=CNC1=O Z1509297963 [0,0,0,0,0,1|3,0,0]=4 42 B10R1.4 CNCC1=C(C=CC=C1)C Z56948272 [0,0,0,0,0,1|3,0,0]=4 43 B10R1.4 CSCC1=C(C=CC=C1)N Z732207148 [0,0,0,0,0,1|3,0,0]=4 44 B10R1.10 CCNC1=CC(=CC=C1)C Z56785946 [0,0,0,0,0,1|3,0,0]=4 45 B10R1.10 CCOC1=NC(=CC=C1)C Z1198168604 [0,0,0,0,0,1|2,1,0]=4 46 B10R1.10 CCSC1=CC(=CC=C1)Br Z1090207966 [0,0,0,0,0,1|3,0,0]=4 47 B10R1.10 CCSC1=CC(=CC=C1)N Z600393424 [0,0,0,0,0,1|3,0,0]=4 48 B10R1.10 CCSC1=CC(=NC=C1)Cl Z1157653444 [0,0,0,0,0,1|3,0,0]=4 49 B10R1.10 CCSC1=CC=CC(=O)N1 Z3004833863 [0,0,0,0,0,1|3,0,0]=4 50 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [0,0,0,0,0,1|3,0,0]=4 51 B10R1.10 CNCC1=NC(=CC=C1)C Z1255523287 [0,0,0,0,0,1|3,0,0]=4 52 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [0,0,0,0,0,1|3,0,0]=4 53 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [0,0,0,0,0,1|3,0,0]=4 54 B10R1.10 CSCC1=CC(=NC=C1)N Z991494168 [0,0,0,0,0,1|3,0,0]=4 55 B7R1.1 CNC1=NOC=C1 Z2489381644 [2,0,0,0,0,0|2,0,0]=4 56 B7R1.1 N#CC1=COC=C1 Z1079178908 [2,0,0,0,0,0|2,0,0]=4 57 B7R1.1 NCC1=COC=C1 Z406680098 [2,0,0,0,0,0|2,0,0]=4 58 B7R1.1 O=CC1=COC=C1 Z1065630348 [2,0,0,0,0,0|1,1,0]=4 59 B7R1.1 OCC1=COC=C1 Z397587426 [2,0,0,0,0,0|1,1,0]=4 60 B7R1.4 CC1=C(C=CS1)Br Z1201624904 [2,0,0,0,0,0|1,1,0]=4 61 B7R1.4 CC1=C(C=NO1)I Z1269175158 [2,0,0,0,0,0|2,0,0]=4 62 B7R1.4 CC1=C(C=NO1)N Z1465461252 [2,0,0,0,0,0|2,0,0]=4 63 B7R1.4 CC1=C(ON=C1)N Z815305382 [2,0,0,0,0,0|2,0,0]=4 64 B7R1.4 CC1=CC=NN1C Z826535916 [2,0,0,0,0,0|2,0,0]=4 65 B7R1.4 CC1=CNC=C1C Z1198162792 [2,0,0,0,0,0|2,0,0]=4 66 B7R1.4 CN1C=COC1=O Z2732441923 [2,0,0,0,0,0|2,0,0]=4 67 B9R1.12 CCNCC1=COC=C1 Z385447452 [1,1,0,0,0,0|2,0,0]=4 68 B9R1.12 OCCCC1=COC=C1 Z1198265634 [1,1,0,0,0,0|2,0,0]=4 69 B9R1.13 CC(N)CC1=COC=C1 Z1098234443 [1,1,0,0,0,0|2,0,0]=4 70 B9R1.14 CCC1=C(OC=C1)C=O Z1511886468 [1,1,0,0,0,0|1,0,1]=4 71 B9R1.14 CCC1=C(SC=C1)CN Z815289796 [1,1,0,0,0,0|1,1,0]=4 72 B9R1.22 CC1=CC(=C(O1)C)C#N Z1079179026 [1,1,0,0,0,0|2,0,0]=4 73 B9R1.22 CC1=CC(=C(O1)C)C=O Z57500361 [1,1,0,0,0,0|1,1,0]=4 74 B9R1.22 CC1=CC(=C(O1)C)CO Z397587274 [1,1,0,0,0,0|1,1,0]=4 75 B9R1.22 CSC1=C(N=C(S1)N)C Z317061820 [1,1,0,0,0,0|2,0,0]=4 76 B9R1.27 CC1=NOC(=C1CS)C Z56347078 [1,1,0,0,0,0|2,0,0]=4 77 B9R1.27 CCC1=C(NC=C1C)C Z1203730732 [1,1,0,0,0,0|2,0,0]=4 78 B9R1.27 CCC1=C(ON=C1O)C Z2009977600 [1,1,0,0,0,0|2,0,0]=4 79 B9R1.27 CNC1=C(ON=C1C)C Z1198183563 [1,1,0,0,0,0|2,0,0]=4 80 B9R1.41 CC(=O)C1=C(ON=C1)C Z406694052 [1,1,0,0,0,0|2,0,0]=4 81 B9R1.41 CC1=C(C=CO1)C(=N)N Z1198218315 [1,1,0,0,0,0|2,0,0]=4 82 B9R1.41 CC1=C(C=CO1)C(=O)O Z104479606 [1,1,0,0,0,0|1,1,0]=4 83 B11R1.13 CSCC1=C(C(=CC=C1)N)C Z732207424 [0,1,0,0,0,1|2,0,0]=4 84 B11R1.189 CSCC1=CC(=CC=C1)CN Z732208422 [0,1,0,0,0,1|2,0,0]=4 85 B11R1.199 CCNC(=O)C1=C(OC=C1)C Z100648134 [0,2,0,0,0,0|2,0,0]=4 86 B11R1.465 CC1=NOC(=C1SCCN)C Z4925891165 [0,2,0,0,0,0|2,0,0]=4 87 B11R1.89 CC1=C(C=CO1)C(=O)N(C)C Z135504760 [0,2,0,0,0,0|2,0,0]=4 88 B11R1.225 CNC(=O)C1=C(OC(=C1)C)C Z68248613 [0,2,0,0,0,0|2,0,0]=4 89 B11R1.137 CCS(=O)(=O)C1=C(OC=C1)C Z1720603241 [0,2,0,0,0,0|1,0,1]=4 90 B9R1.35 CC1=CC=C(S1)C(=O)O Z104494884 [0,0,1,1,0,0|2,0,0]=4 91 B11R2.20 C1=CC2=C(CCSC2)N=C1 Z3492694447 [0,0,0,1,0,1|2,0,0]=4 92 B11R2.15 NCC1=CC2=C(S1)C=CO2 Z4439014643 [0,1,0,1,0,0|1,0,1]=4