0 B6R0.1 C=CC(=O)OCC BB_SC-07096 [0,0,0,0,0,0|3,0,0]=3 1 B6R0.1 CCOC(=O)CBr BB_SC-06646 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.1 CCOC(=O)CCl BB_SC-06777 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.1 CCOC(=O)CS BB_SC-07162 [0,0,0,0,0,0|2,1,1]=4 4 B6R0.1 CCOC(=O)NN BB_SC-07159 [0,0,0,0,0,0|4,0,0]=4 5 B5R0.1 C=C(C)CCO BB_NC-02269 [1,0,0,0,0,0|1,0,1]=3 6 B5R0.1 C=COC(C)=O BB_SC-12396 [1,0,0,0,0,0|1,0,2]=4 7 B5R0.1 CC(=O)CCO BB_SC-06926 [1,0,0,0,0,0|1,0,1]=3 8 B5R0.1 CC(C)=CCO BB_NC-02261 [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|0,0,3]=4 11 B5R0.1 CCC[N+](=O)[O-] BB_SC-06933 [1,0,0,0,0,0|2,0,1]=4 12 B5R0.1 CCOC(=O)Cl BB_SC-07081 [1,0,0,0,0,0|2,0,0]=3 13 B5R0.1 CNCC(=O)O BB_NC-02298 [1,0,0,0,0,0|2,0,1]=4 14 B5R0.1 CNCC(N)=O BB_NC-02649 [1,0,0,0,0,0|2,0,1]=4 15 B5R0.1 COCC(=O)Cl BB_SC-11218 [1,0,0,0,0,0|2,0,1]=4 16 B5R0.1 CSCC(C)=O BB_SC-12665 [1,0,0,0,0,0|1,0,1]=3 17 B5R0.1 C\C=C\C(=O)Cl BB_SC-06652 [1,0,0,0,0,0|1,0,1]=3 18 B5R0.1 C\C=C\C(=O)O BB_NC-02305 [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 CCCCC=O BB_NC-02285 [1,0,0,0,0,0|0,0,2]=3 26 B5R0.3 C=CC(=O)OC BB_SC-06906 [1,0,0,0,0,0|3,0,0]=4 27 B5R0.3 CCC(=O)CC BB_SC-06948 [1,0,0,0,0,0|2,0,1]=4 28 B5R0.3 CCC(=O)NO BB_SC-06499 [1,0,0,0,0,0|2,0,1]=4 29 B7R0.5 C=C(C)C(=O)OCC BB_SC-06809 [0,1,0,0,0,0|3,0,0]=4 30 B7R0.5 CCOC(=O)C(=O)Cl BB_SC-06434 [0,1,0,0,0,0|2,0,0]=3 31 B7R0.5 CCOC(=O)C(C)=O BB_SC-05733 [0,1,0,0,0,0|2,0,0]=3 32 B7R0.5 CCOC(=O)C(N)=O BB_SC-07128 [0,1,0,0,0,0|2,0,0]=3 33 B7R0.7 C\C=C\C(=O)OCC BB_NC-02193 [0,1,0,0,0,0|3,0,0]=4 34 B7R1.1 O=CC1=CC=CN1 BB_SC-04628 [0,0,0,1,0,0|1,0,2]=4 35 B7R1.1 O=CC1=CC=CS1 BB_SC-11213 [0,0,0,1,0,0|1,0,2]=4 36 B7R1.1 O=CC1=CNC=N1 BB_SC-12411 [0,0,0,1,0,0|2,0,1]=4 37 B7R1.1 O=CC1=CSC=C1 BB_SC-09203 [0,0,0,1,0,0|1,0,2]=4 38 B7R1.2 CC1=CC(C)=NN1 BB_SC-02785 [0,0,0,1,0,0|2,0,1]=4 39 B7R1.2 CC1=CNC(C)=N1 BB_SC-07154 [0,0,0,1,0,0|2,0,1]=4 40 B7R1.2 CN1C=C(Br)C=N1 BB_SC-06366 [0,0,0,1,0,0|3,0,0]=4 41 B7R1.2 CN1C=C(I)C=N1 BB_SC-12417 [0,0,0,1,0,0|3,0,0]=4 42 B7R1.3 CC1=CC=NC=C1 BB_SC-07024 [0,0,0,1,0,0|2,0,1]=4 43 B7R1.3 O=C1C=CCCC1 BB_SC-07147 [0,0,0,1,0,0|2,0,1]=4 44 B7R1.22 C\C(=N/O)C1CC1 BB_SC-00309 [0,0,0,1,0,0|1,0,2]=4 45 B4R0.1 C=C(C)C#N BB_SC-06810 [2,0,0,0,0,0|1,0,1]=4 46 B4R0.1 CC(=O)CCl BB_SC-12393 [2,0,0,0,0,0|1,0,0]=3 47 B4R0.1 CC(=O)CO BB_SC-06929 [2,0,0,0,0,0|1,0,0]=3 48 B4R0.1 CC(C)C=O BB_SC-11515 [2,0,0,0,0,0|0,0,1]=3 49 B4R0.1 CCC(=O)Cl BB_SC-06942 [2,0,0,0,0,0|1,0,0]=3 50 B4R0.1 CCC(C)=O BB_SC-06989 [2,0,0,0,0,0|0,0,0]=2 51 B4R0.1 CCC(C)N BB_SC-06740 [2,0,0,0,0,0|1,0,1]=4 52 B4R0.1 CCC(C)O BB_SC-07031 [2,0,0,0,0,0|0,0,2]=4 53 B4R0.1 CNC(N)=O BB_SC-07198 [2,0,0,0,0,0|2,0,0]=4 54 B4R0.1 COC(=O)Cl BB_SC-07075 [2,0,0,0,0,0|2,0,0]=4 55 B4R0.1 COC(N)=O BB_SC-06903 [2,0,0,0,0,0|2,0,0]=4 56 B4R0.1 NC(=O)CCl BB_SC-06849 [2,0,0,0,0,0|2,0,0]=4 57 B4R0.1 O=C(Br)CBr BB_SC-06823 [2,0,0,0,0,0|2,0,0]=4 58 B4R0.1 O=C(Cl)CCl BB_SC-06733 [2,0,0,0,0,0|2,0,0]=4 59 B4R0.1 O=C(O)CCl BB_SC-12338 [2,0,0,0,0,0|2,0,0]=4 60 B4R0.1 O=C(O)CI BB_SC-06475 [2,0,0,0,0,0|2,0,0]=4 61 B4R0.2 CC=CCO BB_NC-02275 [2,0,0,0,0,0|1,0,0]=3 62 B4R0.2 C\C=C\C#N BB_SC-12445 [2,0,0,0,0,0|1,0,1]=4 63 B4R0.2 C\C=C\C=O BB_SC-06898 [2,0,0,0,0,0|0,0,0]=2 64 B6R0.2 CC(=O)C=C(C)C BB_NC-02260 [1,1,0,0,0,0|0,0,1]=3 65 B6R0.2 CC(=O)CC(C)C BB_SC-12684 [1,1,0,0,0,0|0,0,1]=3 66 B6R0.2 CC(C)=CC(=O)Cl BB_SC-07152 [1,1,0,0,0,0|1,0,1]=4 67 B6R0.2 CC(C)CC(=O)Cl BB_SC-06957 [1,1,0,0,0,0|1,0,1]=4 68 B6R0.2 CC(C)CC(=O)O BB_NC-02309 [1,1,0,0,0,0|1,0,1]=4 69 B6R0.2 CC(O)CC(=O)O BB_NC-02216 [1,1,0,0,0,0|1,0,1]=4 70 B6R0.3 CCC(Br)C(=O)O BB_SC-09405 [1,1,0,0,0,0|1,0,1]=4 71 B6R0.3 COC(=O)C(C)=O BB_SC-06762 [1,1,0,0,0,0|1,0,0]=3 72 B6R0.3 C\C=C(/C)C(=O)O BB_NC-02228 [1,1,0,0,0,0|1,0,1]=4 73 B6R0.4 CC(=O)CCCCl BB_SC-07709 [1,1,0,0,0,0|0,0,1]=3 74 B6R0.4 CC(=O)NCCN BB_SC-10762 [1,1,0,0,0,0|1,0,0]=3 75 B6R0.4 CCCCC(=O)Cl BB_SC-06859 [1,1,0,0,0,0|1,0,1]=4 76 B6R0.4 CCCCC(C)=O BB_SC-06917 [1,1,0,0,0,0|0,0,1]=3 77 B6R0.4 CC\C=C\C(=O)O BB_NC-02316 [1,1,0,0,0,0|1,0,0]=3 78 B6R0.4 NCCCC(=O)O BB_NC-02785 [1,1,0,0,0,0|1,0,1]=4 79 B6R0.4 O=C(Cl)CCCCl BB_SC-06828 [1,1,0,0,0,0|1,0,1]=4 80 B6R0.6 CCCCOC=O BB_SC-07045 [1,1,0,0,0,0|0,0,2]=4 81 B8R0.5 CCOC(=O)CC(=O)O BB_SC-06245 [0,2,0,0,0,0|2,0,0]=4 82 B8R0.5 CCOC(=O)CC(C)=O BB_SC-07092 [0,2,0,0,0,0|2,0,0]=4 83 B8R0.5 C\C(=C\C=O)CC(C)C BB_NC-01302 [0,2,0,0,0,0|0,0,1]=3 84 B8R0.11 CCCCC(C=O)CC BB_NC-02782 [0,2,0,0,0,0|0,0,2]=4 85 B6R1.2 NC1=NCCC1 BB_SC-10415 [1,0,0,1,0,0|2,0,0]=4 86 B6R1.2 O=C1CCCC1 BB_SC-09627 [1,0,0,1,0,0|0,0,1]=3 87 B6R1.2 O=C1CCSC1 BB_SC-08806 [1,0,0,1,0,0|1,0,1]=4 88 B6R1.2 O=C1NCCO1 BB_SC-06954 [1,0,0,1,0,0|2,0,0]=4 89 B6R1.2 O=C1OCCO1 BB_SC-06807 [1,0,0,1,0,0|2,0,0]=4 90 B6R1.11 CC(=O)C1CC1 BB_SC-06709 [1,0,0,1,0,0|0,0,1]=3 91 B6R1.11 O=C(Cl)C1CC1 BB_SC-06556 [1,0,0,1,0,0|1,0,1]=4 92 B6R1.11 O=C(O)C1CC1 BB_SC-06673 [1,0,0,1,0,0|1,0,1]=4 93 B6R1.1 C1=COCCC1 BB_SC-07074 [1,0,0,1,0,0|0,0,2]=4 94 B8R1.1 CC1=CC=C(C=O)N1 BB_SC-08168 [0,1,0,1,0,0|1,0,1]=4 95 B8R1.1 CC1=CC=C(C=O)O1 BB_SC-08898 [0,1,0,1,0,0|1,0,1]=4 96 B8R1.1 CC1=CC=C(CN)O1 BB_SC-07231 [0,1,0,1,0,0|2,0,0]=4 97 B8R1.1 CCC1=NC(C)=CN1 BB_SC-05574 [0,1,0,1,0,0|1,0,0]=3 98 B8R1.1 CN1C=C(CN)C=N1 BB_SC-03708 [0,1,0,1,0,0|2,0,0]=4 99 B8R1.1 CN1C=C(CO)C=N1 BB_SC-09036 [0,1,0,1,0,0|2,0,0]=4 100 B8R1.4 CC1=CC=NC(C)=C1 BB_SC-06947 [0,1,0,1,0,0|1,0,1]=4 101 B8R1.4 CC1CCCC(=O)C1 BB_SC-06963 [0,1,0,1,0,0|0,0,2]=4 102 B8R1.4 O=C1CCCC(=O)C1 BB_SC-06889 [0,1,0,1,0,0|1,0,1]=4 103 B8R1.18 CC1=CC(=O)OC1=O BB_SC-06526 [0,1,0,1,0,0|1,0,1]=4 104 B8R1.2 O=CN1CCNCC1 BB_SC-04847 [0,1,0,1,0,0|1,0,1]=4 105 B8R1.5 CC1CCCCC1=O BB_SC-06869 [0,1,0,1,0,0|0,0,2]=4 106 B8R1.50 CC1CCC(=O)C1=O BB_NC-01986 [0,1,0,1,0,0|1,0,1]=4 107 B8R1.50 O=C1CCC(=O)N1Br BB_SC-07072 [0,1,0,1,0,0|2,0,0]=4 108 B8R1.50 O=C1CCC(=O)N1Cl BB_SC-07097 [0,1,0,1,0,0|2,0,0]=4 109 B8R1.50 O=C1OCC(O)=C1Br BB_SC-05637 [0,1,0,1,0,0|2,0,0]=4 110 B8R1.7 NC(=O)C1CCCN1 BB_NC-01913 [0,1,0,1,0,0|1,0,1]=4 111 B8R1.7 O=C(O)C1CCCO1 BB_SC-06862 [0,1,0,1,0,0|1,0,1]=4 112 B8R1.19 O=S1(=O)CCC=C1Br BB_SC-08532 [0,1,0,1,0,0|2,0,0]=4 113 B8R1.19 O=S1(=O)CCC=C1Cl BB_SC-09968 [0,1,0,1,0,0|2,0,0]=4 114 B8R1.11 CC1=C(C=O)SC=C1 BB_SC-02989 [0,1,0,1,0,0|1,0,1]=4 115 B8R1.11 CC1=C(CO)NC=N1 BB_SC-01730 [0,1,0,1,0,0|2,0,0]=4 116 B8R1.11 CN1C=CC=C1C=O BB_SC-05503 [0,1,0,1,0,0|0,0,2]=4 117 B8R1.11 CN1N=CC=C1C=O BB_SC-10382 [0,1,0,1,0,0|1,0,1]=4 118 B8R1.11 N#CC1=C(N)CCC1 BB_SC-03329 [0,1,0,1,0,0|1,0,1]=4