0 B6R1.2 ClC1=NSN=C1 BB_SC-11187 [0,0,0,0,0,0|3,0,1]=4 1 B6R1.2 NC1=NCCC1 BB_SC-10415 [0,0,0,0,0,0|3,0,0]=3 2 B6R1.2 NC1=NCCS1 BB_SC-06601 [0,0,0,0,0,0|4,0,0]=4 3 B6R1.2 NC1CCCC1 BB_SC-12557 [0,0,0,0,0,0|2,0,1]=3 4 B6R1.2 O=C1CCCC1 BB_SC-09627 [0,0,0,0,0,0|1,0,0]=1 5 B6R1.2 O=C1CCSC1 BB_SC-08806 [0,0,0,0,0,0|0,0,0]=0 6 B6R1.2 O=C1NCCO1 BB_SC-06954 [0,0,0,0,0,0|3,0,0]=3 7 B6R1.2 O=C1OC=CO1 BB_SC-06550 [0,0,0,0,0,0|3,0,1]=4 8 B6R1.2 O=C1OCCO1 BB_SC-06807 [0,0,0,0,0,0|3,0,0]=3 9 B6R1.2 S=C1NCCN1 BB_SC-06569 [0,0,0,0,0,0|3,1,0]=4 10 B6R1.2 SC1=NCCS1 BB_SC-06486 [0,0,0,0,0,0|3,1,0]=4 11 B5R1.1 C1=COCC1 BB_SC-06597 [1,0,0,0,0,0|0,1,1]=3 12 B5R1.1 C1=CSC=N1 BB_SC-08800 [1,0,0,0,0,0|1,0,2]=4 13 B7R1.1 CNC1CCSC1 BB_SC-11874 [0,1,0,0,0,0|1,0,1]=3 14 B7R1.1 O=CC1=CSC=C1 BB_SC-09203 [0,1,0,0,0,0|0,0,3]=4 15 B7R1.2 CC1=NNC(=O)C1 BB_SC-06921 [0,1,0,0,0,0|2,0,1]=4 16 B7R1.2 CC1CCC(=O)O1 BB_SC-07058 [0,1,0,0,0,0|2,0,0]=3 17 B7R1.2 C[C@@H]1COC(=O)O1 BB_NC-02716 [0,1,0,0,0,0|3,0,0]=4 18 B7R1.2 NC1=CC(=O)CC1 BB_SC-06410 [0,1,0,0,0,0|1,0,1]=3 19 B7R1.2 NC1=NNC(=O)C1 BB_SC-09099 [0,1,0,0,0,0|2,0,1]=4 20 B7R1.2 O=C1C=C(Cl)CC1 BB_SC-06411 [0,1,0,0,0,0|1,0,1]=3 21 B7R1.2 O=C1C=C(O)CO1 BB_SC-12693 [0,1,0,0,0,0|2,0,1]=4 22 B7R1.2 O=C1CCC(=O)C1 BB_SC-06396 [0,1,0,0,0,0|1,0,0]=2 23 B7R1.2 O=C1CCC(=O)N1 BB_SC-06814 [0,1,0,0,0,0|2,0,0]=3 24 B7R1.2 O=C1CNC(=O)N1 BB_NC-02287 [0,1,0,0,0,0|2,0,1]=4 25 B7R1.2 O=C1CNC(=S)N1 BB_SC-12671 [0,1,0,0,0,0|2,0,1]=4 26 B7R1.2 O=C1CNC(=S)S1 BB_SC-06897 [0,1,0,0,0,0|2,0,1]=4 27 B7R1.2 O=C1CSC(=O)N1 BB_SC-06863 [0,1,0,0,0,0|1,0,1]=3 28 B7R1.2 O=C1CSC(=S)N1 BB_SC-12361 [0,1,0,0,0,0|1,0,1]=3 29 B7R1.4 NC1CCOC1=O BB_NC-01193 [0,1,0,0,0,0|2,0,0]=3 30 B7R1.4 NC1CCSC1=O BB_SC-05358 [0,1,0,0,0,0|2,0,0]=3 31 B7R1.4 NC1CSCC1O BB_NC-00016 [0,1,0,0,0,0|0,0,2]=3 32 B7R1.4 N[C@@H]1CONC1=O BB_NC-01631 [0,1,0,0,0,0|1,1,0]=3 33 B7R1.4 O=C1OCCC1Br BB_SC-08882 [0,1,0,0,0,0|2,0,0]=3 34 B7R1.4 OC1COCC1O BB_NC-00093 [0,1,0,0,0,0|0,1,2]=4 35 B7R1.14 O=S1(=O)C=CCC1 BB_SC-04484 [0,1,0,0,0,0|2,0,1]=4 36 B7R1.14 O=S1(=O)CC=CC1 BB_SC-05410 [0,1,0,0,0,0|2,0,1]=4 37 B7R1.14 O=S1(=O)CCCO1 BB_SC-12403 [0,1,0,0,0,0|3,0,0]=4 38 B7R1.14 O=[S+]1([O-])CCCC1 BB_SC-06657 [0,1,0,0,0,0|2,0,0]=3 39 B5R0.1 C=C(C)CCO BB_NC-02269 [0,0,1,0,0,0|1,1,0]=3 40 B5R0.1 C=COC(C)=O BB_SC-12396 [0,0,1,0,0,0|2,0,1]=4 41 B5R0.1 CC(=O)CCO BB_SC-06926 [0,0,1,0,0,0|0,1,0]=2 42 B5R0.1 CC(C)=CCO BB_NC-02261 [0,0,1,0,0,0|1,1,1]=4 43 B5R0.1 CC(C)CCBr BB_SC-07141 [0,0,1,0,0,0|2,0,1]=4 44 B5R0.1 CC(C)CCI BB_SC-06842 [0,0,1,0,0,0|2,0,1]=4 45 B5R0.1 CC(C)CCS BB_SC-06570 [0,0,1,0,0,0|1,0,1]=3 46 B5R0.1 CC(O)CCO BB_SC-11995 [0,0,1,0,0,0|0,1,2]=4 47 B5R0.1 CCCC(=O)Cl BB_SC-06847 [0,0,1,0,0,0|2,0,0]=3 48 B5R0.1 CCCC(C)O BB_SC-07025 [0,0,1,0,0,0|1,0,2]=4 49 B5R0.1 CCC[N+](=O)[O-] BB_SC-06933 [0,0,1,0,0,0|3,0,0]=4 50 B5R0.1 CCOC(=O)Cl BB_SC-07081 [0,0,1,0,0,0|3,0,0]=4 51 B5R0.1 CN(C)CCCl BB_SC-07254 [0,0,1,0,0,0|3,0,0]=4 52 B5R0.1 CN(C)CCN BB_SC-10968 [0,0,1,0,0,0|3,0,0]=4 53 B5R0.1 CNCC(=O)O BB_NC-02298 [0,0,1,0,0,0|2,0,0]=3 54 B5R0.1 CNCC(N)=O BB_NC-02649 [0,0,1,0,0,0|2,0,0]=3 55 B5R0.1 COCC(=O)Cl BB_SC-11218 [0,0,1,0,0,0|1,1,0]=3 56 B5R0.1 CSCC(C)=O BB_SC-12665 [0,0,1,0,0,0|0,0,0]=1 57 B5R0.1 C\C=C\C(=O)Cl BB_SC-06652 [0,0,1,0,0,0|2,0,1]=4 58 B5R0.1 C\C=C\C(=O)O BB_NC-02305 [0,0,1,0,0,0|2,0,1]=4 59 B5R0.1 N#CCC(=O)O BB_SC-07146 [0,0,1,0,0,0|2,0,1]=4 60 B5R0.1 N#CCC(N)=O BB_SC-06719 [0,0,1,0,0,0|2,0,1]=4 61 B5R0.1 NC(=O)CCCl BB_SC-07003 [0,0,1,0,0,0|2,0,0]=3 62 B5R0.1 NCCC(=O)O BB_SC-12000 [0,0,1,0,0,0|2,0,0]=3 63 B5R0.1 O=C(Cl)CCBr BB_SC-07207 [0,0,1,0,0,0|2,0,0]=3 64 B5R0.1 O=C(Cl)CCCl BB_SC-06831 [0,0,1,0,0,0|2,0,0]=3 65 B5R0.1 O=C(O)CCBr BB_SC-12703 [0,0,1,0,0,0|2,0,0]=3 66 B5R0.1 O=C(O)CCCl BB_SC-06966 [0,0,1,0,0,0|2,0,0]=3 67 B5R0.2 CCCCC=O BB_NC-02285 [0,0,1,0,0,0|1,0,0]=2 68 B5R0.2 CCCCCN BB_SC-06799 [0,0,1,0,0,0|2,0,1]=4 69 B5R0.2 CCNCCO BB_SC-07158 [0,0,1,0,0,0|1,0,2]=4 70 B5R0.2 CCOCCBr BB_SC-07261 [0,0,1,0,0,0|1,1,1]=4 71 B5R0.2 CNCCC#N BB_SC-07065 [0,0,1,0,0,0|2,0,1]=4 72 B5R0.2 CNCCCN BB_SC-07066 [0,0,1,0,0,0|2,0,1]=4 73 B5R0.2 COCCCN BB_SC-06753 [0,0,1,0,0,0|1,1,1]=4 74 B5R0.3 C=CC(=O)OC BB_SC-06906 [0,0,1,0,0,0|2,0,1]=4 75 B5R0.3 CCC(=O)CC BB_SC-06948 [0,0,1,0,0,0|1,0,0]=2 76 B5R0.3 CCC(=O)NO BB_SC-06499 [0,0,1,0,0,0|1,1,0]=3 77 B5R0.3 CCC(N)CO BB_SC-06587 [0,0,1,0,0,0|1,1,1]=4 78 B5R0.3 CNC(=O)NC BB_SC-07191 [0,0,1,0,0,0|3,0,0]=4 79 B5R0.3 COC(=O)CN BB_NC-03070 [0,0,1,0,0,0|2,0,0]=3 80 B5R0.3 COC(=O)CO BB_SC-06427 [0,0,1,0,0,0|1,1,0]=3 81 B5R0.3 COC(=O)CS BB_SC-06606 [0,0,1,0,0,0|1,0,0]=2 82 B5R0.3 COC(=O)NN BB_SC-07168 [0,0,1,0,0,0|3,0,0]=4 83 B5R0.3 O=C(CCl)CCl BB_SC-08807 [0,0,1,0,0,0|2,0,0]=3 84 B7R1.3 CN1CCNCC1 BB_SC-06441 [0,0,0,0,0,1|3,0,0]=4 85 B7R1.3 NN1CCCCC1 BB_SC-04637 [0,0,0,0,0,1|3,0,0]=4 86 B7R1.3 NN1CCOCC1 BB_SC-06464 [0,0,0,0,0,1|2,1,0]=4 87 B7R1.3 O=C1C=CCCC1 BB_SC-07147 [0,0,0,0,0,1|1,0,1]=3 88 B7R1.3 O=C1CCCCN1 BB_SC-06941 [0,0,0,0,0,1|1,0,0]=2 89 B7R1.3 O=C1CCNCC1 BB_SC-06576 [0,0,0,0,0,1|1,0,0]=2 90 B7R1.3 O=C1CCOCC1 BB_SC-11189 [0,0,0,0,0,1|0,1,0]=2 91 B7R1.3 O=C1CCSCC1 BB_SC-06397 [0,0,0,0,0,1|0,0,0]=1 92 B7R1.3 O=C1CNCCN1 BB_SC-04934 [0,0,0,0,0,1|1,0,0]=2 93 B7R1.3 OC1CCCCC1 BB_SC-07055 [0,0,0,0,0,1|1,0,2]=4 94 B7R1.3 OC1CCNCC1 BB_SC-02766 [0,0,0,0,0,1|1,0,2]=4 95 B7R1.3 OC1COCOC1 BB_SC-07035 [0,0,0,0,0,1|0,1,2]=4 96 B7R1.3 SC1=NCCCN1 BB_SC-05375 [0,0,0,0,0,1|2,1,0]=4 97 B4R0.1 CC(=O)CCl BB_SC-12393 [1,0,1,0,0,0|1,0,0]=3 98 B4R0.1 CC(=O)CO BB_SC-06929 [1,0,1,0,0,0|0,1,0]=3 99 B4R0.1 CCC(=O)Cl BB_SC-06942 [1,0,1,0,0,0|1,0,0]=3 100 B4R0.1 CCC(C)=O BB_SC-06989 [1,0,1,0,0,0|0,0,0]=2 101 B4R0.1 CCC(C)N BB_SC-06740 [1,0,1,0,0,0|1,0,1]=4 102 B4R0.1 CCC(C)O BB_SC-07031 [1,0,1,0,0,0|0,0,2]=4 103 B4R0.1 CNC(N)=O BB_SC-07198 [1,0,1,0,0,0|2,0,0]=4 104 B4R0.1 COC(=O)Cl BB_SC-07075 [1,0,1,0,0,0|1,1,0]=4 105 B4R0.1 COC(N)=O BB_SC-06903 [1,0,1,0,0,0|1,1,0]=4 106 B4R0.1 CSC(=N)N BB_SC-07197 [1,0,1,0,0,0|2,0,0]=4 107 B4R0.1 NC(=O)CCl BB_SC-06849 [1,0,1,0,0,0|2,0,0]=4 108 B4R0.1 O=C(Br)CBr BB_SC-06823 [1,0,1,0,0,0|2,0,0]=4 109 B4R0.1 O=C(Cl)CCl BB_SC-06733 [1,0,1,0,0,0|2,0,0]=4 110 B4R0.1 O=C(O)CCl BB_SC-12338 [1,0,1,0,0,0|1,1,0]=4 111 B4R0.1 O=C(O)CI BB_SC-06475 [1,0,1,0,0,0|1,1,0]=4 112 B4R0.2 CC=CCO BB_NC-02275 [1,0,1,0,0,0|0,1,1]=4 113 B4R0.2 CCCCCl BB_SC-07054 [1,0,1,0,0,0|1,0,1]=4 114 B4R0.2 CCCCI BB_SC-06943 [1,0,1,0,0,0|1,0,1]=4 115 B4R0.2 CCCCN BB_SC-06761 [1,0,1,0,0,0|1,0,1]=4 116 B4R0.2 CNCCN BB_NC-02991 [1,0,1,0,0,0|2,0,0]=4 117 B4R0.2 CNCCO BB_SC-06928 [1,0,1,0,0,0|1,0,1]=4 118 B4R0.2 COCCBr BB_SC-07068 [1,0,1,0,0,0|1,1,0]=4 119 B4R0.2 COCCCl BB_SC-07014 [1,0,1,0,0,0|1,1,0]=4 120 B4R0.2 C\C=C\C=O BB_SC-06898 [1,0,1,0,0,0|0,0,2]=4 121 B6R0.1 CCOC(=O)CBr BB_SC-06646 [0,1,1,0,0,0|2,0,0]=4 122 B6R0.1 CCOC(=O)CCl BB_SC-06777 [0,1,1,0,0,0|2,0,0]=4 123 B6R0.1 CCOC(=O)CS BB_SC-07162 [0,1,1,0,0,0|2,0,0]=4 124 B6R0.1 CNCC(=O)NC BB_NC-02631 [0,1,1,0,0,0|1,0,0]=3 125 B6R0.1 COC(=O)CC#N BB_SC-06876 [0,1,1,0,0,0|1,0,1]=4 126 B6R0.1 COC(=O)CCBr BB_SC-11223 [0,1,1,0,0,0|1,0,0]=3 127 B6R0.1 COC(=O)CCN BB_NC-01738 [0,1,1,0,0,0|1,0,0]=3 128 B6R0.2 CC(=O)C=C(C)C BB_NC-02260 [0,1,1,0,0,0|1,0,1]=4 129 B6R0.2 CC(=O)CC(C)C BB_SC-12684 [0,1,1,0,0,0|1,0,0]=3 130 B6R0.2 CC(C)CC(=O)Cl BB_SC-06957 [0,1,1,0,0,0|2,0,0]=4 131 B6R0.2 CC(C)CC(=O)O BB_NC-02309 [0,1,1,0,0,0|2,0,0]=4 132 B6R0.2 CC(O)CC(=O)O BB_NC-02216 [0,1,1,0,0,0|1,1,0]=4 133 B6R0.2 CN(C)CC(=O)O BB_SC-06622 [0,1,1,0,0,0|2,0,0]=4 134 B6R0.3 CCC(Br)C(=O)O BB_SC-09405 [0,1,1,0,0,0|2,0,0]=4 135 B6R0.3 COC(=O)C(C)=O BB_SC-06762 [0,1,1,0,0,0|0,1,1]=4 136 B6R0.3 NC(CO)C(=O)O BB_SC-09461 [0,1,1,0,0,0|1,1,0]=4 137 B6R0.3 N[C@@H](CS)C(=O)O BB_NC-02302 [0,1,1,0,0,0|1,0,0]=3 138 B6R0.4 C=CCCC(=O)O BB_NC-02314 [0,1,1,0,0,0|2,0,0]=4 139 B6R0.4 CC(=O)CCCCl BB_SC-07709 [0,1,1,0,0,0|1,0,0]=3 140 B6R0.4 CC(=O)NCCN BB_SC-10762 [0,1,1,0,0,0|1,0,0]=3 141 B6R0.4 CCCCC(=O)Cl BB_SC-06859 [0,1,1,0,0,0|2,0,0]=4 142 B6R0.4 CCCCC(C)=O BB_SC-06917 [0,1,1,0,0,0|1,0,0]=3 143 B6R0.4 NCCCC(=O)O BB_NC-02785 [0,1,1,0,0,0|2,0,0]=4 144 B6R0.4 O=C(Cl)CCCCl BB_SC-06828 [0,1,1,0,0,0|2,0,0]=4 145 B6R0.5 O=S(=O)([O-])CCS BB_SC-05473 [0,1,1,0,0,0|2,0,0]=4 146 B6R0.6 CCCCN=C=O BB_SC-06541 [0,1,1,0,0,0|1,0,1]=4 147 B6R0.6 CCCCOC=O BB_SC-07045 [0,1,1,0,0,0|1,0,0]=3 148 B6R0.6 NCCSCCO BB_SC-09747 [0,1,1,0,0,0|0,0,2]=4 149 B8R1.2 CNC1CCSCC1 BB_SC-11440 [0,1,0,0,0,1|1,0,1]=4 150 B8R1.2 O=CN1CCNCC1 BB_SC-04847 [0,1,0,0,0,1|2,0,0]=4 151 B8R1.3 CC1CCC(=O)CC1 BB_SC-06867 [0,1,0,0,0,1|1,0,0]=3 152 B8R1.3 O=C1CCC(=O)CC1 BB_SC-06510 [0,1,0,0,0,1|1,0,0]=3 153 B8R1.3 O=C1CNC(=O)CN1 BB_NC-00669 [0,1,0,0,0,1|1,0,1]=4 154 B8R1.4 CC1CCCC(=O)C1 BB_SC-06963 [0,1,0,0,0,1|1,0,0]=3 155 B8R1.4 O=C1CCCC(=O)C1 BB_SC-06889 [0,1,0,0,0,1|1,0,0]=3 156 B8R1.5 CC1CCCCC1=O BB_SC-06869 [0,1,0,0,0,1|1,0,0]=3 157 B8R1.5 O=C1CCCCC1Cl BB_SC-05549 [0,1,0,0,0,1|1,0,0]=3 158 B8R1.7 O=C(O)C1CSCN1 BB_NC-00047 [0,2,0,0,0,0|1,0,1]=4 159 B8R1.50 CC1CCC(=O)C1=O BB_NC-01986 [0,2,0,0,0,0|1,0,1]=4 160 B8R1.50 NN1C(=O)CSC1=S BB_SC-12700 [0,2,0,0,0,0|1,0,1]=4 161 B8R1.50 O=C1CCC(=O)N1Br BB_SC-07072 [0,2,0,0,0,0|2,0,0]=4 162 B8R1.50 O=C1CCC(=O)N1Cl BB_SC-07097 [0,2,0,0,0,0|2,0,0]=4 163 B8R1.50 O=C1COC(=O)C1Cl BB_SC-02413 [0,2,0,0,0,0|0,1,1]=4 164 B8R1.51 NC1CCS(=O)(=O)C1 BB_SC-01160 [0,2,0,0,0,0|2,0,0]=4 165 B8R1.51 NC1CCS(=O)(=O)C1 BB_SC-12371 [0,2,0,0,0,0|2,0,0]=4 166 B8R1.51 O=S1(=O)CCC(O)C1 BB_SC-01162 [0,2,0,0,0,0|2,0,0]=4 167 B6R1.11 CC(=O)C1CC1 BB_SC-06709 [0,0,1,1,0,0|1,0,0]=3 168 B6R1.11 O=C(Cl)C1CC1 BB_SC-06556 [0,0,1,1,0,0|2,0,0]=4 169 B6R1.11 O=C(O)C1CC1 BB_SC-06673 [0,0,1,1,0,0|2,0,0]=4 170 B6R1.1 C1CSCCN1 BB_SC-06531 [0,0,1,1,0,0|1,0,1]=4 171 B4R1.2 NC1CC1 BB_SC-07203 [0,0,0,0,2,0|1,0,1]=4 172 B8R1.22 NC1=NCCCCC1 BB_SC-09557 [0,0,0,0,0,2|2,0,0]=4 173 B8R1.22 O=C1CCCCCN1 BB_SC-06656 [0,0,0,0,0,2|1,0,0]=3 174 B8R1.22 O=C1CCCCCO1 BB_SC-06787 [0,0,0,0,0,2|1,0,0]=3