0 B6R0.1 C=CC(=O)OCC BB_SC-07096 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.1 CNCC(O)CO BB_SC-04061 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.1 C=C(C)CCO BB_NC-02269 [1,0,0,0,0,0|1,0,1]=3 3 B5R0.1 CC(=O)CCO BB_SC-06926 [1,0,0,0,0,0|1,0,1]=3 4 B5R0.1 CC(C)CC=O BB_NC-02289 [1,0,0,0,0,0|1,0,2]=4 5 B5R0.1 CC(C)CCBr BB_SC-07141 [1,0,0,0,0,0|1,0,1]=3 6 B5R0.1 CC(C)CCI BB_SC-06842 [1,0,0,0,0,0|1,0,1]=3 7 B5R0.1 CC(C)CCS BB_SC-06570 [1,0,0,0,0,0|1,0,1]=3 8 B5R0.1 CC(O)CCO BB_SC-11995 [1,0,0,0,0,0|1,0,1]=3 9 B5R0.1 CCCC(=O)Cl BB_SC-06847 [1,0,0,0,0,0|1,0,1]=3 10 B5R0.1 CCCC(C)O BB_SC-07025 [1,0,0,0,0,0|0,0,1]=2 11 B5R0.1 CCC[N+](=O)[O-] BB_SC-06933 [1,0,0,0,0,0|2,0,0]=3 12 B5R0.1 CCOC(=O)Cl BB_SC-07081 [1,0,0,0,0,0|2,0,1]=4 13 B5R0.1 CN(C)CCCl BB_SC-07254 [1,0,0,0,0,0|2,0,1]=4 14 B5R0.1 CN(C)CCN BB_SC-10968 [1,0,0,0,0,0|2,0,1]=4 15 B5R0.1 CNCC(=O)O BB_NC-02298 [1,0,0,0,0,0|2,0,1]=4 16 B5R0.1 CNCC(N)=O BB_NC-02649 [1,0,0,0,0,0|2,0,1]=4 17 B5R0.1 COCC(=O)Cl BB_SC-11218 [1,0,0,0,0,0|2,0,1]=4 18 B5R0.1 CSCC(C)=O BB_SC-12665 [1,0,0,0,0,0|1,0,1]=3 19 B5R0.1 NC(=O)CCCl BB_SC-07003 [1,0,0,0,0,0|2,0,1]=4 20 B5R0.1 NCCC(=O)O BB_SC-12000 [1,0,0,0,0,0|2,0,1]=4 21 B5R0.1 O=C(Cl)CCBr BB_SC-07207 [1,0,0,0,0,0|2,0,1]=4 22 B5R0.1 O=C(Cl)CCCl BB_SC-06831 [1,0,0,0,0,0|2,0,1]=4 23 B5R0.1 O=C(O)CCBr BB_SC-12703 [1,0,0,0,0,0|2,0,1]=4 24 B5R0.1 O=C(O)CCCl BB_SC-06966 [1,0,0,0,0,0|2,0,1]=4 25 B5R0.2 BrCCCCBr BB_SC-06730 [1,0,0,0,0,0|2,0,1]=4 26 B5R0.2 CCCCC=O BB_NC-02285 [1,0,0,0,0,0|0,0,0]=1 27 B5R0.2 CCCCCN BB_SC-06799 [1,0,0,0,0,0|1,0,1]=3 28 B5R0.2 CCNCCO BB_SC-07158 [1,0,0,0,0,0|1,0,2]=4 29 B5R0.2 CCOCCBr BB_SC-07261 [1,0,0,0,0,0|2,0,1]=4 30 B5R0.2 CNCCC#N BB_SC-07065 [1,0,0,0,0,0|2,0,1]=4 31 B5R0.2 CNCCCN BB_SC-07066 [1,0,0,0,0,0|2,0,1]=4 32 B5R0.2 COCCCN BB_SC-06753 [1,0,0,0,0,0|2,0,1]=4 33 B5R0.2 NCCCCN BB_NC-02221 [1,0,0,0,0,0|2,0,1]=4 34 B5R0.2 O=C=NCCCl BB_SC-04063 [1,0,0,0,0,0|2,0,1]=4 35 B5R0.3 CCC(N)CO BB_SC-06587 [1,0,0,0,0,0|1,0,2]=4 36 B7R0.5 CCOC(=O)C(=O)Cl BB_SC-06434 [0,1,0,0,0,0|2,0,1]=4 37 B7R0.5 CCOC(=O)C(C)=O BB_SC-05733 [0,1,0,0,0,0|2,0,1]=4 38 B7R0.5 CCOC(=O)C(N)=O BB_SC-07128 [0,1,0,0,0,0|2,0,1]=4 39 B7R0.7 CCOC(C)OCC BB_SC-07086 [0,1,0,0,0,0|2,0,1]=4 40 B7R0.12 CNCC(OC)OC BB_SC-05502 [0,1,0,0,0,0|3,0,0]=4 41 B7R1.1 CNC1CCSC1 BB_SC-11874 [0,0,0,1,0,0|3,0,0]=4 42 B7R1.1 OC[C@@H]1CCCN1 BB_SC-12416 [0,0,0,1,0,0|1,0,2]=4 43 B7R1.3 O=C1C=CCCC1 BB_SC-07147 [0,0,0,1,0,0|2,0,1]=4 44 B7R1.3 OC1CCCCC1 BB_SC-07055 [0,0,0,1,0,0|2,0,1]=4 45 B7R1.4 NC1CCOC1=O BB_NC-01193 [0,0,0,1,0,0|2,0,0]=3 46 B7R1.4 NC1CCSC1=O BB_SC-05358 [0,0,0,1,0,0|2,0,0]=3 47 B7R1.4 N[C@@H]1CONC1=O BB_NC-01631 [0,0,0,1,0,0|3,0,0]=4 48 B7R1.4 O=C1OCCC1Br BB_SC-08882 [0,0,0,1,0,0|2,0,0]=3 49 B7R1.22 C\C(=N/O)C1CC1 BB_SC-00309 [0,0,0,1,0,0|1,0,2]=4 50 B7R1.25 CC1(CO)COC1 BB_SC-05506 [0,0,0,1,0,0|1,0,2]=4 51 B4R0.1 CC(=O)CCl BB_SC-12393 [2,0,0,0,0,0|1,0,1]=4 52 B4R0.1 CC(=O)CO BB_SC-06929 [2,0,0,0,0,0|1,0,1]=4 53 B4R0.1 CC(C)C=O BB_SC-11515 [2,0,0,0,0,0|0,0,0]=2 54 B4R0.1 CC(C)CBr BB_SC-12386 [2,0,0,0,0,0|1,0,1]=4 55 B4R0.1 CC(C)CI BB_SC-06912 [2,0,0,0,0,0|1,0,1]=4 56 B4R0.1 CC(N)CN BB_SC-06623 [2,0,0,0,0,0|2,0,0]=4 57 B4R0.1 CC(O)CCl BB_SC-06971 [2,0,0,0,0,0|1,0,1]=4 58 B4R0.1 CC(O)CO BB_SC-07047 [2,0,0,0,0,0|1,0,1]=4 59 B4R0.1 CCC(=O)Cl BB_SC-06942 [2,0,0,0,0,0|1,0,1]=4 60 B4R0.1 CCC(C)=O BB_SC-06989 [2,0,0,0,0,0|0,0,1]=3 61 B4R0.1 CCC(C)N BB_SC-06740 [2,0,0,0,0,0|1,0,0]=3 62 B4R0.1 CCC(C)O BB_SC-07031 [2,0,0,0,0,0|0,0,1]=3 63 B4R0.1 [C@H](C)(O)CN BB_NC-02322 [2,0,0,0,0,0|1,0,1]=4 64 B4R0.2 BrCCCBr BB_SC-06684 [2,0,0,0,0,0|2,0,0]=4 65 B4R0.2 CCCCCl BB_SC-07054 [2,0,0,0,0,0|1,0,0]=3 66 B4R0.2 CCCCI BB_SC-06943 [2,0,0,0,0,0|1,0,0]=3 67 B4R0.2 CCCCN BB_SC-06761 [2,0,0,0,0,0|1,0,0]=3 68 B4R0.2 CNCCN BB_NC-02991 [2,0,0,0,0,0|2,0,0]=4 69 B4R0.2 CNCCO BB_SC-06928 [2,0,0,0,0,0|1,0,1]=4 70 B4R0.2 COCCBr BB_SC-07068 [2,0,0,0,0,0|2,0,0]=4 71 B4R0.2 COCCCl BB_SC-07014 [2,0,0,0,0,0|2,0,0]=4 72 B4R0.2 C\C=C\C=O BB_SC-06898 [2,0,0,0,0,0|0,0,2]=4 73 B4R0.2 NCCCBr BB_SC-06502 [2,0,0,0,0,0|2,0,0]=4 74 B4R0.2 NCCCCl BB_SC-07208 [2,0,0,0,0,0|2,0,0]=4 75 B4R0.2 NCCCN BB_NC-02306 [2,0,0,0,0,0|2,0,0]=4 76 B4R0.2 OCCCBr BB_SC-07264 [2,0,0,0,0,0|1,0,1]=4 77 B6R0.2 CC(=O)CC(C)C BB_SC-12684 [1,1,0,0,0,0|0,0,1]=3 78 B6R0.2 CC(C)CC(=O)Cl BB_SC-06957 [1,1,0,0,0,0|1,0,1]=4 79 B6R0.2 CC(C)CC(=O)O BB_NC-02309 [1,1,0,0,0,0|1,0,1]=4 80 B6R0.2 CC(O)CC(=O)O BB_NC-02216 [1,1,0,0,0,0|1,0,1]=4 81 B6R0.3 CCC(Br)C(=O)O BB_SC-09405 [1,1,0,0,0,0|1,0,1]=4 82 B6R0.4 CC(=O)CCCCl BB_SC-07709 [1,1,0,0,0,0|0,0,1]=3 83 B6R0.4 CC(=O)NCCN BB_SC-10762 [1,1,0,0,0,0|1,0,1]=4 84 B6R0.4 CC(C)OCCCl BB_SC-03437 [1,1,0,0,0,0|1,0,1]=4 85 B6R0.4 CCCCC(=O)Cl BB_SC-06859 [1,1,0,0,0,0|1,0,1]=4 86 B6R0.4 CCCCC(C)=O BB_SC-06917 [1,1,0,0,0,0|0,0,1]=3 87 B6R0.4 CN(C)CCCCl BB_SC-05456 [1,1,0,0,0,0|1,0,1]=4 88 B6R0.4 CN(C)CCCN BB_SC-06473 [1,1,0,0,0,0|1,0,1]=4 89 B6R0.4 CN(C)CCCO BB_SC-06804 [1,1,0,0,0,0|1,0,1]=4 90 B6R0.4 NCCCC(=O)O BB_NC-02785 [1,1,0,0,0,0|1,0,1]=4 91 B6R0.4 O=C(Cl)CCCCl BB_SC-06828 [1,1,0,0,0,0|1,0,1]=4 92 B6R0.5 CCCS(=O)(=O)Cl BB_SC-09421 [1,1,0,0,0,0|2,0,0]=4 93 B6R0.6 BrCCCCCBr BB_SC-06835 [1,1,0,0,0,0|1,0,1]=4 94 B6R0.6 CCCCCCBr BB_SC-06675 [1,1,0,0,0,0|1,0,1]=4 95 B6R0.6 CCCCCCI BB_SC-07033 [1,1,0,0,0,0|1,0,1]=4 96 B6R0.6 CCCCCCN BB_SC-05552 [1,1,0,0,0,0|1,0,1]=4 97 B6R0.6 CCCCN=C=O BB_SC-06541 [1,1,0,0,0,0|0,0,1]=3 98 B6R0.6 CCCCOC=O BB_SC-07045 [1,1,0,0,0,0|0,0,0]=2 99 B6R0.6 CCCNCCC BB_SC-06961 [1,1,0,0,0,0|1,0,1]=4 100 B6R0.6 CCOCCCN BB_SC-06885 [1,1,0,0,0,0|1,0,1]=4 101 B6R0.6 NCCCCCN BB_NC-02202 [1,1,0,0,0,0|1,0,1]=4 102 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O BB_NC-02400 [0,2,0,0,0,0|1,0,0]=3 103 B8R0.5 C\C(=C\C=O)CC(C)C BB_NC-01302 [0,2,0,0,0,0|0,0,1]=3 104 B8R0.19 CCC(=O)CC(C)CC BB_SC-06894 [0,2,0,0,0,0|1,0,1]=4 105 B8R0.23 CC(=O)NC(C)C(=O)O BB_NC-00510 [0,2,0,0,0,0|1,0,1]=4 106 B8R0.23 CC(C)C[C@H](N)C(N)=O BB_NC-02379 [0,2,0,0,0,0|1,0,0]=3 107 B8R0.34 C#CC(C)(O)CC(C)C BB_SC-05533 [0,2,0,0,0,0|1,0,1]=4 108 B8R0.34 CN(C)CC(C)(C)C=O BB_SC-04811 [0,2,0,0,0,0|1,0,0]=3 109 B8R0.8 CCCCC(Br)C(=O)O BB_SC-06728 [0,2,0,0,0,0|1,0,0]=3 110 B8R0.8 CCCCC(N)C(=O)O BB_SC-08743 [0,2,0,0,0,0|1,0,0]=3 111 B8R0.8 CSCCC(N)C(=O)O BB_NC-01175 [0,2,0,0,0,0|1,0,0]=3 112 B8R0.11 CCCCC(C=O)CC BB_NC-02782 [0,2,0,0,0,0|0,0,0]=2 113 B8R0.25 C#CC(C)(O)CCCC BB_SC-02018 [0,2,0,0,0,0|1,0,1]=4 114 B8R0.22 C=CC(OCC)OCC BB_SC-06715 [0,2,0,0,0,0|2,0,0]=4 115 B6R1.2 NC1CCCC1 BB_SC-12557 [1,0,0,1,0,0|1,0,0]=3 116 B6R1.2 O=C1CCCC1 BB_SC-09627 [1,0,0,1,0,0|0,0,1]=3 117 B6R1.2 O=C1CCSC1 BB_SC-08806 [1,0,0,1,0,0|1,0,1]=4 118 B6R1.3 COCC1CO1 BB_SC-09489 [1,0,0,1,0,0|1,0,1]=4 119 B6R1.11 CC(=O)C1CC1 BB_SC-06709 [1,0,0,1,0,0|0,0,1]=3 120 B6R1.11 O=C(Cl)C1CC1 BB_SC-06556 [1,0,0,1,0,0|1,0,1]=4 121 B6R1.11 O=C(O)C1CC1 BB_SC-06673 [1,0,0,1,0,0|1,0,1]=4 122 B6R1.1 C1=COCCC1 BB_SC-07074 [1,0,0,1,0,0|0,0,2]=4 123 B8R1.4 CC1CCCC(=O)C1 BB_SC-06963 [0,1,0,1,0,0|0,0,0]=2 124 B8R1.4 O=C1CCCC(=O)C1 BB_SC-06889 [0,1,0,1,0,0|1,0,1]=4 125 B8R1.2 BrCC1CCCCO1 BB_SC-05411 [0,1,0,1,0,0|1,0,1]=4 126 B8R1.2 CNC1CCCCC1 BB_SC-06964 [0,1,0,1,0,0|1,0,1]=4 127 B8R1.2 CNC1CCSCC1 BB_SC-11440 [0,1,0,1,0,0|2,0,0]=4 128 B8R1.2 ClCC1CCCCO1 BB_SC-05541 [0,1,0,1,0,0|1,0,1]=4 129 B8R1.2 O=CN1CCNCC1 BB_SC-04847 [0,1,0,1,0,0|1,0,0]=3 130 B8R1.3 CC1CNC(C)CN1 BB_NC-02191 [0,1,0,1,0,0|1,0,1]=4 131 B8R1.5 CC1CCCCC1=O BB_SC-06869 [0,1,0,1,0,0|0,0,0]=2 132 B8R1.5 O=C1CCCCC1Cl BB_SC-05549 [0,1,0,1,0,0|1,0,0]=3 133 B8R1.50 CC1CCC(=O)C1=O BB_NC-01986 [0,1,0,1,0,0|0,0,1]=3 134 B8R1.7 NC(=O)C1CCCN1 BB_NC-01913 [0,1,0,1,0,0|1,0,0]=3 135 B8R1.7 O=C(O)C1CCCO1 BB_SC-06862 [0,1,0,1,0,0|1,0,0]=3 136 B8R1.7 O=C(O)C1CSCN1 BB_NC-00047 [0,1,0,1,0,0|2,0,0]=4 137 B8R1.7 O=C(O)C1NCCS1 BB_SC-11907 [0,1,0,1,0,0|2,0,0]=4 138 B8R1.7 S=C(S)N1CCCC1 BB_SC-07227 [0,1,0,1,0,0|1,1,0]=4 139 B8R1.7 S=C([S-])N1CCCC1 BB_SC-09424 [0,1,0,1,0,0|1,1,0]=4 140 B8R1.23 O=C1CC(C(=O)O)C1 BB_SC-07711 [0,1,0,1,0,0|1,0,1]=4 141 B8R1.30 C[C@]1(C(=O)O)C[C@@H]1Br BB_SC-02689 [0,1,0,1,0,0|1,0,0]=3 142 B8R1.8 S=C=NC1CCCC1 BB_SC-05674 [0,1,0,1,0,0|0,1,1]=4