0 B8R0.1 CCOC(=O)CCCBr OR14983 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.1 CCOC(=O)CN=C=O OR30501 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.1 CC\C=C\C(=O)OCC OR16435 [0,0,0,0,0,0|1,0,0]=1 3 B7R0.1 CC\C=C\C=C\C=O OR6046 [1,0,0,0,0,0|3,0,0]=4 4 B7R0.3 CCC=CC(=O)OC OR40582 [1,0,0,0,0,0|1,0,0]=2 5 B7R0.3 CC\C=C\C(=O)OC OR6667 [1,0,0,0,0,0|1,0,0]=2 6 B7R0.3 COC(=O)C=CCBr OR10966 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.7 CC#CC(=O)OCC OR14510 [1,0,0,0,0,0|0,0,2]=3 8 B7R0.7 CCCC(=O)OCCl OR16070 [1,0,0,0,0,0|1,0,2]=4 9 B7R0.7 CCNC(=O)CNC OR12098 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.7 CCNC(=O)NCC OR323264 [1,0,0,0,0,0|2,0,1]=4 11 B7R0.7 CCOC(=O)CC#N OR28668 [1,0,0,0,0,0|1,0,2]=4 12 B7R0.7 CCOC(=O)CCCl OR54512 [1,0,0,0,0,0|1,0,2]=4 13 B7R0.7 CCOC(=O)CCN OR26826 [1,0,0,0,0,0|1,0,2]=4 14 B7R0.7 CCOC(=O)COC OR30271 [1,0,0,0,0,0|0,1,1]=3 15 B7R0.7 CCOC(=O)N=C=S OR59819 [1,0,0,0,0,0|1,0,2]=4 16 B7R0.7 CCOC(=O)\C=C/Br OR27617 [1,0,0,0,0,0|1,0,0]=2 17 B7R0.7 [C-]#[N+]CC(=O)OCC OR18110 [1,0,0,0,0,0|1,0,2]=4 18 B9R0.5 CCOC(=O)CCCCBr OR322208 [0,1,0,0,0,0|1,0,2]=4 19 B9R0.5 CCO\C=C\C(=O)OCC OR0463 [0,1,0,0,0,0|0,1,0]=2 20 B9R0.5 CCO\C=C\C(=O)OCC OR17693 [0,1,0,0,0,0|0,1,0]=2 21 B9R0.5 CC\C=C\CC(=O)OCC OR6031 [0,1,0,0,0,0|1,0,0]=2 22 B9R0.5 C\C=C\C=C\C(=O)OCC OR6038 [0,1,0,0,0,0|1,0,0]=2 23 B9R0.34 CCOC(=O)CC(=O)CBr OR4299 [0,1,0,0,0,0|2,0,1]=4 24 B9R0.34 CCOC(=O)CC(=O)CC OR21838 [0,1,0,0,0,0|1,0,1]=3 25 B9R0.34 CCOC(=O)CC(=O)CCl OR28771 [0,1,0,0,0,0|2,0,1]=4 26 B9R0.35 CCOC(=O)C(Cl)OCC OR10840 [0,1,0,0,0,0|2,0,1]=4 27 B9R0.48 CCOC(=O)C=CN(C)C OR16403 [0,1,0,0,0,0|1,0,0]=2 28 B9R0.48 CCOC(=O)CCC(C)=O OR6033 [0,1,0,0,0,0|1,0,2]=4 29 B9R0.48 CCOC(=O)CNC(C)=O OR26838 [0,1,0,0,0,0|2,0,1]=4 30 B9R0.48 CCOC(=O)\C=C\C(=O)O OR59886 [0,1,0,0,0,0|2,0,0]=3 31 B9R1.8 CCOC1=NC=CC=C1 OR40436 [0,0,0,1,0,0|2,0,1]=4 32 B9R1.73 CCOC(=O)C1CNC1 OR317193 [0,0,0,1,0,0|1,0,2]=4 33 B9R1.183 CCOC(=O)C1CC1C OR28709 [0,0,0,1,0,0|1,0,2]=4 34 B6R0.6 CCC\C=C\C=O OR6052 [2,0,0,0,0,0|1,1,0]=4 35 B6R0.6 CCOC=CC#N OR46505 [2,0,0,0,0,0|1,0,1]=4 36 B6R0.6 C\C=C\C=C\CO OR13712 [2,0,0,0,0,0|2,0,0]=4 37 B6R0.1 C#CC(=O)OCC OR28819 [2,0,0,0,0,0|0,0,2]=4 38 B6R0.1 CCOC(=O)C#N OR17890 [2,0,0,0,0,0|1,0,1]=4 39 B6R0.1 CCOC(=O)C=O OR59968 [2,0,0,0,0,0|0,1,0]=3 40 B6R0.1 CCOC(=O)CN OR43634 [2,0,0,0,0,0|1,0,1]=4 41 B6R0.1 CCOC(=O)CS OR17516 [2,0,0,0,0,0|0,0,1]=3 42 B6R0.1 CCOC(=O)NN OR25885 [2,0,0,0,0,0|2,0,0]=4 43 B6R0.1 CCOC(=O)NO OR9111 [2,0,0,0,0,0|1,1,0]=4 44 B6R0.1 CNCC(=O)OC OR26803 [2,0,0,0,0,0|1,0,1]=4 45 B6R0.1 COC(=O)CCS OR28780 [2,0,0,0,0,0|0,0,2]=4 46 B6R0.1 COC(=O)CSC OR9387 [2,0,0,0,0,0|0,0,1]=3 47 B6R0.4 CCC=CC(=O)O OR6566 [2,0,0,0,0,0|1,0,0]=3 48 B6R0.4 CO\C=C\C(C)=O OR52529 [2,0,0,0,0,0|0,1,0]=3 49 B6R0.4 O=C(O)\C=C\CBr OR313099 [2,0,0,0,0,0|2,0,0]=4 50 B8R0.9 COC(=O)\C=C\C(=O)O OR59971 [1,1,0,0,0,0|2,0,0]=4 51 B8R0.9 COC(=O)\C=C\C(C)C OR6465 [1,1,0,0,0,0|1,0,0]=3 52 B8R0.19 CCC(=O)CC(=O)OC OR5113 [1,1,0,0,0,0|0,1,1]=4 53 B8R0.19 CCC(=O)OC(=O)CC OR5320 [1,1,0,0,0,0|2,0,0]=4 54 B8R0.19 CNC(C)=CC(=O)OC OR29585 [1,1,0,0,0,0|1,0,0]=3 55 B8R0.19 COC(=O)CC(=O)OC OR2832 [1,1,0,0,0,0|0,1,1]=4 56 B8R0.5 CCOC(=O)C=C(C)C OR54610 [1,1,0,0,0,0|0,0,0]=2 57 B8R0.5 CCOC(=O)CC(=O)Cl OR5235 [1,1,0,0,0,0|0,1,1]=4 58 B8R0.5 CCOC(=O)CC(=O)O OR54513 [1,1,0,0,0,0|0,1,1]=4 59 B8R0.5 CCOC(=O)CC(=O)[O-] OR16162 [1,1,0,0,0,0|0,1,1]=4 60 B8R0.5 CCOC(=O)CC(N)=O OR59898 [1,1,0,0,0,0|0,1,1]=4 61 B8R0.5 CCOC(=O)C[C@H](C)O OR304080 [1,1,0,0,0,0|0,0,2]=4 62 B8R0.5 CCOC(=O)C[S+](C)C OR5509 [1,1,0,0,0,0|0,0,2]=4 63 B10R0.32 CCOC(=O)C(=O)CC(C)=O OR27077 [0,2,0,0,0,0|1,0,1]=4 64 B10R0.2 CCCC(=O)CC(=O)OCC OR28623 [0,2,0,0,0,0|1,0,1]=4 65 B10R0.2 CCOC(=O)C=C(C)OCC OR23954 [0,2,0,0,0,0|0,1,0]=3 66 B10R0.2 CCOC(=O)CC(=O)COC OR4302 [0,2,0,0,0,0|0,1,1]=4 67 B10R0.2 CCOC(=O)CC(=O)OCC OR1354 [0,2,0,0,0,0|0,1,1]=4 68 B10R0.2 CCOC(=O)\C=C(/N)OCC OR27448 [0,2,0,0,0,0|0,1,0]=3 69 B10R0.19 CCOC(=O)[C@@H](N)CCSC OR26814 [0,2,0,0,0,0|0,0,2]=4 70 B10R0.19 CCO\C=C(/C)C(=O)OCC OR60192 [0,2,0,0,0,0|0,1,0]=3 71 B10R0.26 CCOC(=O)CC(=O)C(C)C OR40236 [0,2,0,0,0,0|1,0,1]=4 72 B8R1.1 CSC1=NC(=O)CS1 OR311155 [1,0,0,1,0,0|2,0,0]=4 73 B8R1.4 NC1=CC(=O)CCC1 OR4645 [1,0,0,1,0,0|2,0,0]=4 74 B8R1.18 CC1=CC(=O)OC1=O OR5508 [1,0,0,1,0,0|1,0,1]=4 75 B8R1.37 CCOC(=O)C1CC1 OR5300 [1,0,0,1,0,0|0,0,2]=4 76 B10R1.10 CCOC1=CC(=O)CCC1 OR5348 [0,1,0,1,0,0|1,1,0]=4 77 B10R1.11 CCOC(=O)C1=CC=CN1 OR29376 [0,1,0,1,0,0|1,0,1]=4 78 B10R1.11 CCOC(=O)C1=CC=CS1 OR5056 [0,1,0,1,0,0|1,0,1]=4 79 B10R1.11 CCOC(=O)C1=CN=CO1 OR3553 [0,1,0,1,0,0|1,0,1]=4 80 B10R1.11 CCOC(=O)C1=CN=CS1 OR5607 [0,1,0,1,0,0|1,0,1]=4 81 B10R1.11 CCOC(=O)C1=CNC=N1 OR5606 [0,1,0,1,0,0|1,0,1]=4 82 B10R1.11 CCOC(=O)C1=CNN=C1 OR13194 [0,1,0,1,0,0|1,0,1]=4 83 B10R1.11 CCOC(=O)C1=COC=C1 OR6328 [0,1,0,1,0,0|0,1,1]=4 84 B10R1.11 CCOC(=O)C1=COC=N1 OR3767 [0,1,0,1,0,0|0,1,1]=4 85 B10R1.11 CCOC(=O)C1=CSC=N1 OR10476 [0,1,0,1,0,0|0,0,1]=3 86 B10R1.11 CCOC(=O)C1=NC=CN1 OR3003 [0,1,0,1,0,0|2,0,0]=4 87 B10R1.11 CCOC(=O)C1=NC=CO1 OR313004 [0,1,0,1,0,0|2,0,0]=4 88 B10R1.11 CCOC(=O)C1=NNC=C1 OR300747 [0,1,0,1,0,0|2,0,0]=4 89 B10R1.11 CCOC(=O)C1=NOC=N1 OR0191 [0,1,0,1,0,0|1,1,0]=4 90 B10R1.137 CCOC(=O)C=C1CCC1 OR200117 [0,1,0,1,0,0|1,0,0]=3 91 B10R1.64 CN(C)\C=C1/CCCC1=O OR24511 [0,1,0,1,0,0|2,0,0]=4