0 B8R0.6 CCCCCC(=O)CC BB_SC-06904 [0,0,0,0,0,0|0,0,0]=0 1 B8R0.6 COC(=O)CCN=C=O BB_NC-02138 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.6 COCCNC(=O)CN BB_SC-03476 [0,0,0,0,0,0|3,0,0]=3 3 B7R0.1 C=CCCCCCC BB_SC-07258 [1,0,0,0,0,0|0,0,3]=4 4 B7R0.1 CCCCCCCI BB_SC-09408 [1,0,0,0,0,0|1,0,1]=3 5 B7R0.1 CCCCCN=C=S BB_NC-02794 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.1 NCCCCCCN BB_NC-02277 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.3 CCCCC(=O)CC BB_SC-07061 [1,0,0,0,0,0|0,0,0]=1 8 B7R0.3 CCCCC(=O)NN BB_SC-00088 [1,0,0,0,0,0|2,0,0]=3 9 B7R0.3 COC(=O)CCCCl BB_SC-07247 [1,0,0,0,0,0|2,0,0]=3 10 B7R0.3 NNC(=O)CCCO BB_SC-03913 [1,0,0,0,0,0|3,0,0]=4 11 B7R0.4 CCCCCC(C)=O BB_SC-06722 [1,0,0,0,0,0|0,0,0]=1 12 B7R0.4 CCCCOC(=O)Cl BB_SC-06779 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.4 CCC\C=C\C(=O)O BB_NC-02008 [1,0,0,0,0,0|1,0,2]=4 14 B7R0.4 NCCCCC(=O)O BB_NC-02189 [1,0,0,0,0,0|2,0,0]=3 15 B9R0.1 COC(=O)CCNC(C)C BB_SC-11685 [0,1,0,0,0,0|2,0,0]=3 16 B9R0.8 [C@H](N)(CCSC)C(=O)OC BB_NC-01736 [0,1,0,0,0,0|2,0,0]=3 17 B9R0.34 CCOC(=O)CC(=O)CCl BB_SC-06776 [0,1,0,0,0,0|2,0,1]=4 18 B9R0.34 COCC(=O)CC(=O)OC BB_SC-05537 [0,1,0,0,0,0|2,0,1]=4 19 B9R0.46 CCCCCCC(=O)OC BB_SC-07042 [0,1,0,0,0,0|1,0,0]=2 20 B9R0.47 C=C(C)C(=O)OCCCC BB_SC-07032 [0,1,0,0,0,0|1,0,1]=3 21 B9R1.1 CCN1CCC(=O)CC1 BB_SC-06999 [0,0,0,1,0,0|1,0,0]=2 22 B9R1.5 O=C1NCCCCC1Br BB_SC-09874 [0,0,0,1,0,0|2,0,0]=3 23 B9R1.11 CNC(=O)[C@@H]1CCCN1 BB_NC-02418 [0,0,0,1,0,0|2,0,0]=3 24 B9R1.11 COC(=O)[C@@H]1CCCN1 BB_NC-02036 [0,0,0,1,0,0|2,0,0]=3 25 B9R1.11 NCC(=O)N1CCCC1 BB_SC-09765 [0,0,0,1,0,0|2,0,0]=3 26 B9R1.11 NNC(=O)C1CCCO1 BB_SC-06202 [0,0,0,1,0,0|3,0,0]=4 27 B9R1.11 N\C(=N/O)C1CCCC1 BB_SC-12305 [0,0,0,1,0,0|3,0,0]=4 28 B9R1.50 O=C1CCCCCCC1 BB_SC-06800 [0,0,0,1,0,0|0,0,0]=1 29 B6R0.6 BrCCCCCBr BB_SC-06835 [2,0,0,0,0,0|2,0,0]=4 30 B6R0.6 CCCCCCBr BB_SC-06675 [2,0,0,0,0,0|1,0,0]=3 31 B6R0.6 CCCCCCI BB_SC-07033 [2,0,0,0,0,0|1,0,0]=3 32 B6R0.6 CCCCCCN BB_SC-05552 [2,0,0,0,0,0|1,0,0]=3 33 B6R0.6 CCCCN=C=O BB_SC-06541 [2,0,0,0,0,0|1,0,1]=4 34 B6R0.6 CCCCOC=O BB_SC-07045 [2,0,0,0,0,0|1,0,0]=3 35 B6R0.6 CCCNCCC BB_SC-06961 [2,0,0,0,0,0|1,0,0]=3 36 B6R0.6 CCOCCCN BB_SC-06885 [2,0,0,0,0,0|2,0,0]=4 37 B6R0.6 NCCCCCN BB_NC-02202 [2,0,0,0,0,0|2,0,0]=4 38 B6R0.1 CCOC(=O)CBr BB_SC-06646 [2,0,0,0,0,0|2,0,0]=4 39 B6R0.1 CCOC(=O)CCl BB_SC-06777 [2,0,0,0,0,0|2,0,0]=4 40 B6R0.1 CCOC(=O)CS BB_SC-07162 [2,0,0,0,0,0|2,0,0]=4 41 B6R0.1 CNCC(=O)NC BB_NC-02631 [2,0,0,0,0,0|2,0,0]=4 42 B6R0.1 COC(=O)CCBr BB_SC-11223 [2,0,0,0,0,0|2,0,0]=4 43 B6R0.1 COC(=O)CCN BB_NC-01738 [2,0,0,0,0,0|2,0,0]=4 44 B6R0.4 CC(=O)CCCCl BB_SC-07709 [2,0,0,0,0,0|1,0,0]=3 45 B6R0.4 CC(=O)NCCN BB_SC-10762 [2,0,0,0,0,0|2,0,0]=4 46 B6R0.4 CCCCC(=O)Cl BB_SC-06859 [2,0,0,0,0,0|1,0,0]=3 47 B6R0.4 CCCCC(C)=O BB_SC-06917 [2,0,0,0,0,0|0,0,0]=2 48 B6R0.4 NCCCC(=O)O BB_NC-02785 [2,0,0,0,0,0|2,0,0]=4 49 B6R0.4 O=C(Cl)CCCCl BB_SC-06828 [2,0,0,0,0,0|2,0,0]=4 50 B8R0.4 CCCCCCCCCl BB_SC-07057 [1,1,0,0,0,0|0,0,1]=3 51 B8R0.4 CCCCCCCCI BB_SC-06637 [1,1,0,0,0,0|0,0,1]=3 52 B8R0.4 CCCCNCCCC BB_SC-07063 [1,1,0,0,0,0|0,0,1]=3 53 B8R0.7 CCCCCCC(C)=O BB_SC-06900 [1,1,0,0,0,0|0,0,2]=4 54 B8R0.8 CNCCC(=O)N(C)C BB_SC-05314 [1,1,0,0,0,0|2,0,0]=4 55 B8R0.9 CC(C)CNC(=O)CN BB_SC-07829 [1,1,0,0,0,0|2,0,0]=4 56 B8R0.9 COC(=O)CCC(C)=O BB_SC-07229 [1,1,0,0,0,0|1,0,1]=4 57 B8R0.11 CCCCC(C=O)CC BB_NC-02782 [1,1,0,0,0,0|0,0,1]=3 58 B8R0.19 CCC(=O)CC(C)CC BB_SC-06894 [1,1,0,0,0,0|0,0,0]=2 59 B8R0.5 CCOC(=O)CC(C)=O BB_SC-07092 [1,1,0,0,0,0|1,0,1]=4 60 B8R0.28 CC(=O)CCC=C(C)C BB_NC-00183 [1,1,0,0,0,0|0,0,2]=4 61 B8R0.28 CN(C)CCCC(=O)O BB_SC-09188 [1,1,0,0,0,0|2,0,0]=4 62 B10R0.3 CCOC(=O)CCCC(C)=O BB_SC-05486 [0,2,0,0,0,0|0,0,1]=3 63 B10R0.59 COC(=O)CCCC(=O)OC BB_SC-07153 [0,2,0,0,0,0|1,0,1]=4 64 B10R0.60 CCC(C)CCCC(C)(C)O BB_NC-01292 [0,2,0,0,0,0|1,0,1]=4 65 B10R0.2 CCCC(=O)CC(=O)OCC BB_SC-11237 [0,2,0,0,0,0|0,0,1]=3 66 B10R0.2 CCOC(=O)CC(=O)OCC BB_SC-07073 [0,2,0,0,0,0|1,0,1]=4 67 B10R0.6 COCCOC(=O)CC(C)=O BB_SC-06888 [0,2,0,0,0,0|2,0,0]=4 68 B10R0.24 CCCCCC(CC)N=C=S BB_SC-01847 [0,2,0,0,0,0|0,1,1]=4 69 B10R0.83 [C@H](N)(CCCCN)C(=O)OC BB_NC-00526 [0,2,0,0,0,0|1,0,0]=3 70 B10R0.74 CCCCCCCC(=O)OC BB_SC-07043 [0,2,0,0,0,0|1,0,0]=3 71 B8R1.2 CCN1CCNCC1 BB_SC-06854 [1,0,0,1,0,0|2,0,0]=4 72 B8R1.2 CNC1CCCCC1 BB_SC-06964 [1,0,0,1,0,0|1,0,1]=4 73 B8R1.2 CNC1CCSCC1 BB_SC-11440 [1,0,0,1,0,0|2,0,0]=4 74 B8R1.22 CN1CCCNCC1 BB_SC-09562 [1,0,0,1,0,0|2,0,0]=4 75 B8R1.3 CC1CCC(=O)CC1 BB_SC-06867 [1,0,0,1,0,0|0,0,0]=2 76 B8R1.3 O=C1CCC(=O)CC1 BB_SC-06510 [1,0,0,1,0,0|1,0,1]=4 77 B8R1.50 CC1CCC(=O)C1=O BB_NC-01986 [1,0,0,1,0,0|1,0,1]=4 78 B8R1.4 CC1CCCC(=O)C1 BB_SC-06963 [1,0,0,1,0,0|0,0,0]=2 79 B8R1.4 O=C1CCCC(=O)C1 BB_SC-06889 [1,0,0,1,0,0|1,0,1]=4 80 B8R1.7 NC(=O)C1CCCN1 BB_NC-01913 [1,0,0,1,0,0|2,0,0]=4 81 B8R1.7 O=C(O)C1CCCO1 BB_SC-06862 [1,0,0,1,0,0|2,0,0]=4 82 B10R1.13 CC(C)N1CCC(=O)CC1 BB_SC-06442 [0,1,0,1,0,0|1,0,0]=3 83 B10R1.11 NCCC(=O)N1CCCC1 BB_SC-08028 [0,1,0,1,0,0|1,0,0]=3 84 B10R1.377 OCCC1(O)CCCCC1 BB_NC-00114 [0,1,0,1,0,0|0,0,2]=4 85 B10R1.15 CNC(=O)C1CCCCN1 BB_SC-07849 [0,1,0,1,0,0|1,0,0]=3 86 B10R1.95 CCNC1CCS(=O)(=O)C1 BB_SC-01470 [0,1,0,1,0,0|2,0,0]=4 87 B10R1.149 COC(=O)C1CCCC1=O BB_SC-01711 [0,1,0,1,0,0|1,0,1]=4