0 B5R0.1 CC(=O)N=S=O SBB059583 [0,0,0,0,0,0|2,1,1]=4 1 B5R0.1 CC(C)=CCBr SBB061690 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.1 CC(C)CCBr SBB061181 [0,0,0,0,0,0|2,0,1]=3 3 B5R0.1 CC(C)CCO SBB060162 [0,0,0,0,0,0|1,1,1]=3 4 B5R0.1 CC(C)CNN SBB042741 [0,0,0,0,0,0|3,0,0]=3 5 B5R0.1 CC(C)N=C=O SBB046976 [0,0,0,0,0,0|0,1,0]=1 6 B5R0.1 CC(C)N=C=S SBB056455 [0,0,0,0,0,0|0,0,0]=0 7 B5R0.1 CC(C)SC#N SBB060088 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.1 CN(C)CCBr SBB073020 [0,0,0,0,0,0|3,0,1]=4 9 B5R0.1 CN(C)CCN SBB007533 [0,0,0,0,0,0|3,0,1]=4 10 B5R0.1 [NH+](C)(C)CCCl SBB057087 [0,0,0,0,0,0|3,0,1]=4 11 B4R0.1 CC(Br)CBr SBB060202 [1,0,0,0,0,0|2,0,1]=4 12 B4R0.1 CC(Br)CCl SBB061477 [1,0,0,0,0,0|2,0,1]=4 13 B4R0.1 CC(C)CBr SBB059932 [1,0,0,0,0,0|1,0,1]=3 14 B4R0.1 CC(C)NN SBB002129 [1,0,0,0,0,0|1,0,1]=3 15 B4R0.1 CC(Cl)CCl SBB059979 [1,0,0,0,0,0|2,0,1]=4 16 B4R0.1 CCC(C)Br SBB059931 [1,0,0,0,0,0|2,0,1]=4 17 B4R0.2 CCCCBr SBB059930 [1,0,0,0,0,0|2,0,1]=4 18 B4R0.2 C\C=C\CC SBB059879 [1,0,0,0,0,0|2,0,1]=4 19 B4R0.2 [NH2+](CC)CC SBB059849 [1,0,0,0,0,0|1,0,2]=4 20 B6R0.1 CCC(C)N=C=S SBB021425 [0,1,0,0,0,0|0,0,0]=1 21 B6R0.1 CCCC(C)CO SBB061282 [0,1,0,0,0,0|2,0,1]=4 22 B6R0.1 CCNC(C)CO SBB046531 [0,1,0,0,0,0|1,0,2]=4 23 B6R0.1 CNC(C)CCO SBB046542 [0,1,0,0,0,0|1,1,1]=4 24 B6R0.1 CNCC(C)OC SBB049894 [0,1,0,0,0,0|3,0,0]=4 25 B6R0.2 CC(=O)CC(C)C SBB060384 [0,1,0,0,0,0|1,1,1]=4 26 B6R0.2 CC(C)CB(O)O SBB062832 [0,1,0,0,0,0|2,1,0]=4 27 B6R0.2 CC(C)CC(=O)Cl SBB040623 [0,1,0,0,0,0|1,1,1]=4 28 B6R0.2 CC(C)CC(C)Br SBB007950 [0,1,0,0,0,0|2,0,1]=4 29 B6R0.2 CC(C)CC(C)O SBB061337 [0,1,0,0,0,0|1,1,1]=4 30 B6R0.2 CC(C)CC(N)=O SBB028167 [0,1,0,0,0,0|1,1,1]=4 31 B6R0.2 CC(C)NC(C)C SBB059763 [0,1,0,0,0,0|1,0,2]=4 32 B6R0.3 C#CC(O)C(C)C SBB009138 [0,1,0,0,0,0|2,0,1]=4 33 B6R0.3 CC(C)C(=O)NN SBB030401 [0,1,0,0,0,0|3,0,0]=4 34 B6R0.3 CC(C)\C(N)=N/O SBB028172 [0,1,0,0,0,0|2,1,0]=4 35 B6R0.3 CCC(C)C(C)C SBB061452 [0,1,0,0,0,0|2,0,1]=4 36 B6R0.3 COC(=O)C(C)C SBB061111 [0,1,0,0,0,0|3,0,0]=4 37 B6R0.4 C=COCC(C)C SBB060157 [0,1,0,0,0,0|2,0,1]=4 38 B6R0.4 CC(C)CN=C=S SBB017613 [0,1,0,0,0,0|0,0,0]=1 39 B6R0.4 CC(C)COC=O SBB061244 [0,1,0,0,0,0|1,1,1]=4 40 B6R0.4 CC(C)NCCN SBB048119 [0,1,0,0,0,0|1,0,2]=4 41 B6R0.4 CC(C)NCCO SBB056428 [0,1,0,0,0,0|0,1,2]=4 42 B6R0.4 CC(C)OCCN SBB301616 [0,1,0,0,0,0|2,0,1]=4 43 B6R0.5 CC#CC(C)(C)O SBB009136 [0,1,0,0,0,0|2,0,1]=4 44 B6R0.5 CC(C)(C)CCCl SBB059953 [0,1,0,0,0,0|2,0,1]=4 45 B6R0.5 CC(C)(C)CCN SBB059532 [0,1,0,0,0,0|2,0,1]=4 46 B6R0.5 CC(C)(C)N=C=O SBB067148 [0,1,0,0,0,0|0,1,0]=2 47 B6R0.5 CC(C)(C)N=C=S SBB066555 [0,1,0,0,0,0|0,0,0]=1 48 B6R0.5 CC(C)(C)ON=O SBB007659 [0,1,0,0,0,0|2,1,0]=4 49 B6R0.5 CCCC(C)(C)N SBB052122 [0,1,0,0,0,0|2,0,1]=4 50 B6R0.5 CCNC(C)(C)C SBB052124 [0,1,0,0,0,0|1,0,2]=4 51 B6R1.3 S=C=NC1CC1 SBB017403 [0,0,0,1,0,0|0,0,0]=1 52 B3R0.1 CCCBr SBB040931 [2,0,0,0,0,0|1,0,1]=4 53 B3R0.2 CC(C)Br SBB060452 [2,0,0,0,0,0|1,0,0]=3 54 B5R0.3 CCC(C)CBr SBB007669 [1,1,0,0,0,0|1,0,1]=4 55 B5R0.4 CC(C)(C)NO SBB056490 [1,1,0,0,0,0|0,1,1]=4 56 B5R0.4 CC(C)(N)C#N SBB043968 [1,1,0,0,0,0|1,0,1]=4 57 B5R0.4 NNC(C)(C)C SBB005864 [1,1,0,0,0,0|1,0,1]=4 58 B5R0.5 CC(=S)N(C)C SBB007924 [1,1,0,0,0,0|1,0,1]=4 59 B5R0.5 CC(C)C(=N)N SBB056456 [1,1,0,0,0,0|1,0,1]=4 60 B5R0.5 CC(C)C(=O)Cl SBB060269 [1,1,0,0,0,0|0,1,1]=4 61 B5R0.5 CN(C)C(=S)Cl SBB085540 [1,1,0,0,0,0|1,0,1]=4 62 B5R0.2 C=CCN=C=O SBB048102 [1,1,0,0,0,0|0,1,1]=4 63 B5R0.2 C=CCN=C=S SBB060631 [1,1,0,0,0,0|0,0,1]=3 64 B5R0.2 CCCN=C=S SBB060984 [1,1,0,0,0,0|0,0,0]=2 65 B5R0.2 O=C=NCCCl SBB054898 [1,1,0,0,0,0|0,1,0]=3 66 B7R0.2 CC(C)NC(=S)NN SBB017632 [0,2,0,0,0,0|0,0,2]=4 67 B7R0.3 CCC(C)CN=C=S SBB085743 [0,2,0,0,0,0|0,0,0]=2 68 B7R0.3 S=C=NCC(Br)CBr SBB019321 [0,2,0,0,0,0|1,0,0]=3 69 B7R0.7 CCOC(=O)N=C=S SBB066610 [0,2,0,0,0,0|1,0,1]=4 70 B7R0.7 COCC(C)N=C=S SBB059494 [0,2,0,0,0,0|0,0,0]=2 71 B7R0.6 CC(C)=NNC(N)=S SBB066571 [0,2,0,0,0,0|0,0,2]=4 72 B5R1.3 BrCC1CC1 SBB054967 [1,0,0,1,0,0|1,0,1]=4 73 B5R1.3 NCC1CC1 SBB047771 [1,0,0,1,0,0|1,0,1]=4 74 B5R1.3 OCC1CC1 SBB059473 [1,0,0,1,0,0|0,1,1]=4 75 B7R1.2 CC1CNC(=S)N1 SBB055856 [0,1,0,1,0,0|0,0,2]=4