0 B5R0.2 BrCCCCBr BB_SC-06730 [0,0,0,0,0,0|4,0,0]=4 1 B5R0.2 CCCCC=O BB_NC-02285 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.2 CCCCCN BB_SC-06799 [0,0,0,0,0,0|3,0,0]=3 3 B5R0.2 CCNCCO BB_SC-07158 [0,0,0,0,0,0|3,0,0]=3 4 B5R0.2 CCOCCBr BB_SC-07261 [0,0,0,0,0,0|2,1,0]=3 5 B5R0.2 CNCCCN BB_SC-07066 [0,0,0,0,0,0|4,0,0]=4 6 B5R0.2 COCCCN BB_SC-06753 [0,0,0,0,0,0|4,0,0]=4 7 B5R0.2 NCCCCN BB_NC-02221 [0,0,0,0,0,0|4,0,0]=4 8 B4R0.2 BrCCCBr BB_SC-06684 [1,0,0,0,0,0|3,0,0]=4 9 B4R0.2 CC=CCO BB_NC-02275 [1,0,0,0,0,0|2,0,1]=4 10 B4R0.2 CCCCCl BB_SC-07054 [1,0,0,0,0,0|2,0,0]=3 11 B4R0.2 CCCCI BB_SC-06943 [1,0,0,0,0,0|2,0,0]=3 12 B4R0.2 CCCCN BB_SC-06761 [1,0,0,0,0,0|2,0,0]=3 13 B4R0.2 CCN=C=S BB_SC-06545 [1,0,0,0,0,0|2,0,1]=4 14 B4R0.2 CNCCN BB_NC-02991 [1,0,0,0,0,0|3,0,0]=4 15 B4R0.2 CNCCO BB_SC-06928 [1,0,0,0,0,0|3,0,0]=4 16 B4R0.2 COCCBr BB_SC-07068 [1,0,0,0,0,0|2,1,0]=4 17 B4R0.2 COCCCl BB_SC-07014 [1,0,0,0,0,0|2,1,0]=4 18 B4R0.2 N#CSCCl BB_SC-05540 [1,0,0,0,0,0|2,0,1]=4 19 B4R0.2 NCCCBr BB_SC-06502 [1,0,0,0,0,0|3,0,0]=4 20 B4R0.2 NCCCCl BB_SC-07208 [1,0,0,0,0,0|3,0,0]=4 21 B4R0.2 NCCCN BB_NC-02306 [1,0,0,0,0,0|3,0,0]=4 22 B4R0.2 OCCCBr BB_SC-07264 [1,0,0,0,0,0|3,0,0]=4 23 B6R0.1 CCOC(=O)CBr BB_SC-06646 [0,1,0,0,0,0|2,1,0]=4 24 B6R0.1 CCOC(=O)CCl BB_SC-06777 [0,1,0,0,0,0|2,1,0]=4 25 B6R0.1 CCOC(=O)CS BB_SC-07162 [0,1,0,0,0,0|2,1,0]=4 26 B6R0.4 CC(C)OCCCl BB_SC-03437 [0,1,0,0,0,0|2,1,0]=4 27 B6R0.4 CCCCC(C)=O BB_SC-06917 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.6 BrCCCCCBr BB_SC-06835 [0,1,0,0,0,0|3,0,0]=4 29 B6R0.6 CCCCCCBr BB_SC-06675 [0,1,0,0,0,0|2,0,0]=3 30 B6R0.6 CCCCCCI BB_SC-07033 [0,1,0,0,0,0|2,0,0]=3 31 B6R0.6 CCCCCCN BB_SC-05552 [0,1,0,0,0,0|2,0,0]=3 32 B6R0.6 CCCNCCC BB_SC-06961 [0,1,0,0,0,0|2,0,0]=3 33 B6R0.6 CCOCCCN BB_SC-06885 [0,1,0,0,0,0|1,1,0]=3 34 B6R0.6 NCCCCCN BB_NC-02202 [0,1,0,0,0,0|3,0,0]=4 35 B6R0.6 NCCNCCN BB_SC-05557 [0,1,0,0,0,0|3,0,0]=4 36 B6R0.6 NCCNCCO BB_SC-05591 [0,1,0,0,0,0|3,0,0]=4 37 B6R0.6 NCCOCCO BB_SC-07134 [0,1,0,0,0,0|2,1,0]=4 38 B6R0.6 NCCSCCO BB_SC-09747 [0,1,0,0,0,0|2,0,0]=3 39 B6R1.1 C1=COCCC1 BB_SC-07074 [0,0,0,1,0,0|1,1,1]=4 40 B6R1.1 C1CSCCN1 BB_SC-06531 [0,0,0,1,0,0|2,0,0]=3 41 B6R1.2 NC1CCCC1 BB_SC-12557 [0,0,0,1,0,0|3,0,0]=4 42 B6R1.2 O=C1CCSC1 BB_SC-08806 [0,0,0,1,0,0|2,0,1]=4 43 B3R0.1 BrCCBr BB_SC-07189 [2,0,0,0,0,0|2,0,0]=4 44 B3R0.1 CCCI BB_SC-06937 [2,0,0,0,0,0|1,0,0]=3 45 B3R0.1 ClCCBr BB_SC-06512 [2,0,0,0,0,0|2,0,0]=4 46 B3R0.1 NCCBr BB_SC-12695 [2,0,0,0,0,0|2,0,0]=4 47 B3R0.1 NCCCl BB_SC-07224 [2,0,0,0,0,0|2,0,0]=4 48 B3R0.1 OCCBr BB_SC-07017 [2,0,0,0,0,0|2,0,0]=4 49 B3R0.1 OCCCl BB_SC-07062 [2,0,0,0,0,0|2,0,0]=4 50 B3R0.1 OCCF BB_SC-00430 [2,0,0,0,0,0|2,0,0]=4 51 B3R0.1 OCCI BB_SC-04664 [2,0,0,0,0,0|2,0,0]=4 52 B3R0.1 SCCS BB_SC-06621 [2,0,0,0,0,0|2,0,0]=4 53 B5R0.1 CC(C)CCBr BB_SC-07141 [1,1,0,0,0,0|2,0,0]=4 54 B5R0.1 CC(C)CCI BB_SC-06842 [1,1,0,0,0,0|2,0,0]=4 55 B5R0.1 CC(C)CCS BB_SC-06570 [1,1,0,0,0,0|2,0,0]=4 56 B5R0.1 CC(O)CCO BB_SC-11995 [1,1,0,0,0,0|2,0,0]=4 57 B5R0.1 CCCC(C)O BB_SC-07025 [1,1,0,0,0,0|1,0,0]=3 58 B5R0.1 CSCC(C)=O BB_SC-12665 [1,1,0,0,0,0|1,0,1]=4 59 B5R0.3 CCC(=O)CC BB_SC-06948 [1,1,0,0,0,0|1,0,0]=3 60 B5R0.3 CCC(N)CO BB_SC-06587 [1,1,0,0,0,0|2,0,0]=4 61 B7R0.3 CCCCC(=O)CC BB_SC-07061 [0,2,0,0,0,0|2,0,0]=4 62 B7R0.5 [C@@H](C)(O)C(=O)OCC BB_NC-02266 [0,2,0,0,0,0|1,1,0]=4 63 B7R0.7 CCCC(=O)CCC BB_SC-06946 [0,2,0,0,0,0|2,0,0]=4 64 B7R0.7 CCOC(C)OCC BB_SC-07086 [0,2,0,0,0,0|0,2,0]=4 65 B7R0.4 CCCCCC(C)=O BB_SC-06722 [0,2,0,0,0,0|2,0,0]=4 66 B7R0.1 C=CCCCCCC BB_SC-07258 [0,2,0,0,0,0|2,0,0]=4 67 B7R0.1 CCCCCCCI BB_SC-09408 [0,2,0,0,0,0|2,0,0]=4 68 B7R0.1 NCCCCCCN BB_NC-02277 [0,2,0,0,0,0|2,0,0]=4 69 B7R0.1 NCCSSCCN BB_SC-00059 [0,2,0,0,0,0|0,0,0]=2 70 B5R1.3 BrCC1CC1 BB_SC-04711 [1,0,0,1,0,0|2,0,0]=4 71 B5R1.3 CCC1CO1 BB_SC-07230 [1,0,0,1,0,0|1,1,0]=4 72 B5R1.3 NCC1CC1 BB_SC-04639 [1,0,0,1,0,0|2,0,0]=4 73 B7R1.1 CNC1CCSC1 BB_SC-11874 [0,1,0,1,0,0|1,0,0]=3 74 B7R1.1 OC[C@@H]1CCCN1 BB_SC-12416 [0,1,0,1,0,0|2,0,0]=4 75 B7R1.2 CC1CCC(=O)O1 BB_SC-07058 [0,1,0,1,0,0|1,1,0]=4 76 B7R1.3 CN1CCNCC1 BB_SC-06441 [0,1,0,1,0,0|2,0,0]=4 77 B7R1.3 NN1CCCCC1 BB_SC-04637 [0,1,0,1,0,0|2,0,0]=4 78 B7R1.3 O=C1CCCCN1 BB_SC-06941 [0,1,0,1,0,0|2,0,0]=4 79 B7R1.3 O=C1CCSCC1 BB_SC-06397 [0,1,0,1,0,0|1,0,1]=4 80 B7R1.3 OC1CCCCC1 BB_SC-07055 [0,1,0,1,0,0|2,0,0]=4 81 B7R1.3 OC1CCNCC1 BB_SC-02766 [0,1,0,1,0,0|2,0,0]=4 82 B7R1.4 NC1CCSC1=O BB_SC-05358 [0,1,0,1,0,0|2,0,0]=4 83 B7R1.4 NC1CSCC1O BB_NC-00016 [0,1,0,1,0,0|2,0,0]=4 84 B7R1.7 CCCCC1CO1 BB_SC-05509 [0,1,0,1,0,0|2,0,0]=4 85 B7R1.24 C1CCCNCC1 BB_SC-12394 [0,1,0,1,0,0|2,0,0]=4 86 B7R1.24 C1CNCCNC1 BB_SC-11240 [0,1,0,1,0,0|2,0,0]=4