0 B4R1.2 NC1CC1 BB_SC-07203 [0,0,0,0,0,0|2,0,0]=2 1 B5R1.3 BrCC1CC1 BB_SC-04711 [0,1,0,0,0,0|1,0,0]=2 2 B5R1.3 C(=O)C1CC1 BB_SC-11514 [0,1,0,0,0,0|1,0,1]=3 3 B5R1.3 CCC1CO1 BB_SC-07230 [0,1,0,0,0,0|0,0,0]=1 4 B5R1.3 ClCC1CO1 BB_SC-06806 [0,1,0,0,0,0|0,0,0]=1 5 B5R1.3 ClC[C@@H]1CO1 BB_SC-10326 [0,1,0,0,0,0|0,0,0]=1 6 B5R1.3 ClC[C@H]1CO1 BB_SC-09935 [0,1,0,0,0,0|0,0,0]=1 7 B5R1.3 NCC1CC1 BB_SC-04639 [0,1,0,0,0,0|1,0,0]=2 8 B3R0.1 BrCCBr BB_SC-07189 [0,0,1,0,0,0|2,0,0]=3 9 B3R0.1 C#CCN BB_SC-08803 [0,0,1,0,0,0|1,0,2]=4 10 B3R0.1 C#CCO BB_SC-06540 [0,0,1,0,0,0|0,0,2]=3 11 B3R0.1 CCCI BB_SC-06937 [0,0,1,0,0,0|1,0,0]=2 12 B3R0.1 CN=C=S BB_SC-05863 [0,0,1,0,0,0|1,1,1]=4 13 B3R0.1 CNC=O BB_SC-06939 [0,0,1,0,0,0|1,0,2]=4 14 B3R0.1 ClCCBr BB_SC-06512 [0,0,1,0,0,0|2,0,0]=3 15 B3R0.1 N#CCCl BB_SC-10991 [0,0,1,0,0,0|2,0,1]=4 16 B3R0.1 N#CCN BB_SC-06479 [0,0,1,0,0,0|2,0,1]=4 17 B3R0.1 NCCBr BB_SC-12695 [0,0,1,0,0,0|2,0,0]=3 18 B3R0.1 NCCCl BB_SC-07224 [0,0,1,0,0,0|2,0,0]=3 19 B3R0.1 OCCBr BB_SC-07017 [0,0,1,0,0,0|1,0,0]=2 20 B3R0.1 OCCCl BB_SC-07062 [0,0,1,0,0,0|1,0,0]=2 21 B3R0.1 OCCF BB_SC-00430 [0,0,1,0,0,0|1,0,0]=2 22 B3R0.1 OCCI BB_SC-04664 [0,0,1,0,0,0|1,0,0]=2 23 B3R0.1 SCCS BB_SC-06621 [0,0,1,0,0,0|1,1,0]=3 24 B3R0.2 CC(=N)N BB_SC-06819 [0,0,1,0,0,0|2,0,1]=4 25 B3R0.2 CC(C)Br BB_SC-06848 [0,0,1,0,0,0|1,0,0]=2 26 B3R0.2 CC(C)I BB_SC-06934 [0,0,1,0,0,0|1,0,0]=2 27 B2R0.1 CCI BB_SC-11853 [1,0,1,0,0,0|1,0,0]=3 28 B2R0.1 CNN BB_SC-12360 [1,0,1,0,0,0|2,0,0]=4 29 B2R0.1 CON BB_SC-06505 [1,0,1,0,0,0|1,0,0]=3 30 B2R0.1 ICI BB_SC-06852 [1,0,1,0,0,0|2,0,0]=4 31 B4R0.1 C#CC(C)O BB_SC-06602 [0,1,1,0,0,0|0,0,2]=4 32 B4R0.1 CC(=O)CCl BB_SC-12393 [0,1,1,0,0,0|1,0,1]=4 33 B4R0.1 CC(=O)CO BB_SC-06929 [0,1,1,0,0,0|0,0,1]=3 34 B4R0.1 CC(C)C=O BB_SC-11515 [0,1,1,0,0,0|0,0,2]=4 35 B4R0.1 CC(C)CBr BB_SC-12386 [0,1,1,0,0,0|1,0,0]=3 36 B4R0.1 CC(C)CI BB_SC-06912 [0,1,1,0,0,0|1,0,0]=3 37 B4R0.1 CC(N)CN BB_SC-06623 [0,1,1,0,0,0|1,0,0]=3 38 B4R0.1 CC(O)CCl BB_SC-06971 [0,1,1,0,0,0|1,0,0]=3 39 B4R0.1 CC(O)CO BB_SC-07047 [0,1,1,0,0,0|0,0,0]=2 40 B4R0.1 CCC(=O)Cl BB_SC-06942 [0,1,1,0,0,0|0,0,2]=4 41 B4R0.1 CCC(C)=O BB_SC-06989 [0,1,1,0,0,0|1,0,0]=3 42 B4R0.1 CCC(C)N BB_SC-06740 [0,1,1,0,0,0|1,0,0]=3 43 B4R0.1 CCC(C)O BB_SC-07031 [0,1,1,0,0,0|0,0,0]=2 44 B4R0.1 COC(=N)N BB_SC-07172 [0,1,1,0,0,0|1,0,1]=4 45 B4R0.1 COC(=O)Cl BB_SC-07075 [0,1,1,0,0,0|1,0,1]=4 46 B4R0.1 COC(N)=O BB_SC-06903 [0,1,1,0,0,0|1,0,1]=4 47 B4R0.1 C\C(N)=N\O BB_SC-09052 [0,1,1,0,0,0|1,0,1]=4 48 B4R0.1 O=C(O)CCl BB_SC-12338 [0,1,1,0,0,0|1,0,1]=4 49 B4R0.1 O=C(O)CI BB_SC-06475 [0,1,1,0,0,0|1,0,1]=4 50 B4R0.1 [C@H](C)(O)CN BB_NC-02322 [0,1,1,0,0,0|1,0,0]=3 51 B4R0.2 BrCCCBr BB_SC-06684 [0,1,1,0,0,0|1,0,0]=3 52 B4R0.2 CC=CCO BB_NC-02275 [0,1,1,0,0,0|0,0,1]=3 53 B4R0.2 CCCCCl BB_SC-07054 [0,1,1,0,0,0|1,0,0]=3 54 B4R0.2 CCCCI BB_SC-06943 [0,1,1,0,0,0|1,0,0]=3 55 B4R0.2 CCCCN BB_SC-06761 [0,1,1,0,0,0|1,0,0]=3 56 B4R0.2 CCN=C=S BB_SC-06545 [0,1,1,0,0,0|0,1,1]=4 57 B4R0.2 CNCCN BB_NC-02991 [0,1,1,0,0,0|1,0,0]=3 58 B4R0.2 CNCCO BB_SC-06928 [0,1,1,0,0,0|0,0,0]=2 59 B4R0.2 COCCBr BB_SC-07068 [0,1,1,0,0,0|0,0,0]=2 60 B4R0.2 COCCCl BB_SC-07014 [0,1,1,0,0,0|0,0,0]=2 61 B4R0.2 N#CCCBr BB_SC-09411 [0,1,1,0,0,0|1,0,1]=4 62 B4R0.2 N#CCCO BB_SC-02742 [0,1,1,0,0,0|0,0,1]=3 63 B4R0.2 NCCCBr BB_SC-06502 [0,1,1,0,0,0|1,0,0]=3 64 B4R0.2 NCCCCl BB_SC-07208 [0,1,1,0,0,0|1,0,0]=3 65 B4R0.2 NCCCN BB_NC-02306 [0,1,1,0,0,0|1,0,0]=3 66 B4R0.2 NNCCO BB_SC-09930 [0,1,1,0,0,0|1,0,0]=3 67 B4R0.2 OCCCBr BB_SC-07264 [0,1,1,0,0,0|0,0,0]=2 68 B4R0.3 CC(C)(C)[O-] BB_SC-07079 [0,1,1,0,0,0|0,0,1]=3 69 B6R1.3 COCC1CO1 BB_SC-09489 [0,2,0,0,0,0|0,0,0]=2 70 B6R1.3 S=C=NC1CC1 BB_SC-05675 [0,2,0,0,0,0|1,0,1]=4 71 B6R1.11 CC(=O)C1CC1 BB_SC-06709 [0,2,0,0,0,0|1,0,0]=3 72 B6R1.11 O=C(Cl)C1CC1 BB_SC-06556 [0,2,0,0,0,0|1,0,1]=4 73 B6R1.11 O=C(O)C1CC1 BB_SC-06673 [0,2,0,0,0,0|1,0,1]=4 74 B6R1.2 NC1CCCC1 BB_SC-12557 [0,0,0,0,0,2|2,0,0]=4 75 B6R1.2 O=C1NCCO1 BB_SC-06954 [0,0,0,0,0,2|1,0,1]=4 76 B6R1.2 O=C1OCCO1 BB_SC-06807 [0,0,0,0,0,2|1,0,1]=4