0 B6R0.5 C=CCS(=O)(=O)Cl X4704 [0,0,0,0,0,0|2,0,1]=3 1 B6R0.5 CC(C)(O)CCCl 0206AB [0,0,0,0,0,0|4,0,0]=4 2 B6R0.5 CCNS(=O)(=O)O 4020AE [0,0,0,0,0,0|2,0,0]=2 3 B6R0.5 CCOS(=O)(=O)[O-] 6863AF [0,0,0,0,0,0|2,0,1]=3 4 B6R0.5 CS(=O)(=O)CCBr 5490AJ [0,0,0,0,0,0|2,0,0]=2 5 B6R0.5 O=P(O)(O)CCBr 7025AC [0,0,0,0,0,0|2,0,1]=3 6 B6R0.5 O=S(=O)(Cl)CCBr 5489AJ [0,0,0,0,0,0|2,0,0]=2 7 B5R0.1 CC(O)CON 3604AB [1,0,0,0,0,0|3,0,0]=4 8 B5R0.1 NC(=O)CCO 8063AJ [1,0,0,0,0,0|3,0,0]=4 9 B5R0.1 O=C(O)CCF 6350AB [1,0,0,0,0,0|2,0,0]=3 10 B5R0.4 CCS(=O)(=O)F 0529AQ [1,0,0,0,0,0|1,0,0]=2 11 B5R0.4 CNS(=O)(=O)O 5637AB [1,0,0,0,0,0|1,0,0]=2 12 B7R0.8 CC(C)(O)CCCN 6321AJ [0,1,0,0,0,0|3,0,0]=4 13 B7R0.8 COCCS(=O)(=O)Cl V6335 [0,1,0,0,0,0|2,0,0]=3 14 B7R0.8 CS(=O)(=O)CCCCl 7889AB [0,1,0,0,0,0|2,0,0]=3 15 B7R0.8 CS(=O)(=O)NCCCl V4403 [0,1,0,0,0,0|2,0,0]=3 16 B7R0.8 CS(=O)(=O)NCCN V7900 [0,1,0,0,0,0|1,0,0]=2 17 B7R0.8 O=P(O)(O)CCCBr 4063AL [0,1,0,0,0,0|2,0,1]=4 18 B7R0.9 CC(C)NS(=O)(=O)Cl 2239AB [0,1,0,0,0,0|3,0,0]=4 19 B7R0.9 CS(=O)(=O)CC(N)=O 5300AJ [0,1,0,0,0,0|1,0,1]=3 20 B7R0.9 O=C(Cl)CS(=O)(=O)Cl 6818AF [0,1,0,0,0,0|2,0,1]=4 21 B7R0.11 CCS(=O)(=O)CCN 5582AD [0,1,0,0,0,0|1,0,0]=2 22 B7R0.11 CCS(=O)(=O)CCO 4648AE [0,1,0,0,0,0|2,0,0]=3 23 B7R0.11 COC(C)(C)CCN 3408AD [0,1,0,0,0,0|3,0,0]=4 24 B7R0.14 O=S(=O)([O-])C(O)CCl 7352AL [0,1,0,0,0,0|1,0,1]=3 25 B7R0.14 O=S(=O)([O-])C(O)CCl 7353AL [0,1,0,0,0,0|1,0,1]=3 26 B7R1.14 O=S1(=O)C=CCC1 Z8082 [0,0,0,1,0,0|2,0,0]=3 27 B7R1.14 O=S1(=O)CCCN1 W7199 [0,0,0,1,0,0|2,0,0]=3 28 B7R1.16 O=S1(=O)CC(Br)C1 A897 [0,0,0,1,0,0|2,0,0]=3 29 B7R1.26 NS(=O)(=O)C1CC1 1189AQ [0,0,0,1,0,0|2,0,0]=3 30 B4R0.1 CCC(=O)Br C859 [2,0,0,0,0,0|2,0,0]=4 31 B4R0.1 NCC(=O)O 7986AL [2,0,0,0,0,0|1,0,0]=3 32 B4R0.1 NCC(=O)[O-] P522 [2,0,0,0,0,0|1,0,1]=4 33 B4R0.2 NCCON 6473AB [2,0,0,0,0,0|1,1,0]=4 34 B4R0.2 NCCON 7871AA [2,0,0,0,0,0|1,1,0]=4 35 B4R0.3 O=S(=O)(O)O 8257AL [2,0,0,0,0,0|1,0,0]=3 36 B4R0.3 O=S(=O)(O)O K629 [2,0,0,0,0,0|1,0,0]=3 37 B4R0.3 O=S(=O)([O-])[O-] 5193AF [2,0,0,0,0,0|1,0,1]=4 38 B4R0.3 O=S(=O)([O-])[O-] 5389AF [2,0,0,0,0,0|1,0,1]=4 39 B4R0.3 O=S(=O)([O-])[O-] 5390AF [2,0,0,0,0,0|1,0,1]=4 40 B4R0.3 O=S(=O)([O-])[O-] 5394AF [2,0,0,0,0,0|1,0,1]=4 41 B4R0.3 O=S(=O)([O-])[O-] 8944AF [2,0,0,0,0,0|1,0,1]=4 42 B4R0.3 O=S(=O)([O-])[O-] Z3641 [2,0,0,0,0,0|1,0,1]=4 43 B4R0.3 O=[Re](=O)(=O)O 8740AF [2,0,0,0,0,0|2,0,0]=4 44 B6R0.1 COC(=O)CCN 5700AB [1,1,0,0,0,0|1,0,0]=3 45 B6R0.2 C[C@H](Br)CC(=O)O V0016 [1,1,0,0,0,0|2,0,0]=4 46 B6R0.2 NC(=O)CC(=O)O 1571AB [1,1,0,0,0,0|1,0,1]=4 47 B6R0.3 CC(CS)C(=O)O Y3236 [1,1,0,0,0,0|2,0,0]=4 48 B6R0.3 CC[C@@H](C)C(=O)O 1204AL [1,1,0,0,0,0|2,0,0]=4 49 B6R0.3 CC[C@@H](Cl)C(=O)O 4152AL [1,1,0,0,0,0|2,0,0]=4 50 B6R0.3 CC[C@H](Cl)C(=O)O Z6043 [1,1,0,0,0,0|2,0,0]=4 51 B6R0.3 C[C@@H](CN)C(=O)O 5862AB [1,1,0,0,0,0|1,0,0]=3 52 B6R0.3 NC[C@H](N)C(=O)O 0179AB [1,1,0,0,0,0|1,0,0]=3 53 B6R0.3 N[C@@H](CCl)C(=O)O Z5908 [1,1,0,0,0,0|2,0,0]=4 54 B6R0.3 N[C@@H](CO)C(=O)O Z6084 [1,1,0,0,0,0|2,0,0]=4 55 B6R0.3 N[C@H](CCl)C(=O)O 5119AB [1,1,0,0,0,0|2,0,0]=4 56 B6R0.3 O=C(O)C(Br)CF 0454AQ [1,1,0,0,0,0|2,0,0]=4 57 B6R0.3 O=C(O)C(Cl)CO 0455AQ [1,1,0,0,0,0|2,0,0]=4 58 B6R0.3 O=C(O)C(O)CCl 2399AL [1,1,0,0,0,0|2,0,0]=4 59 B6R0.4 CC(=O)SCCN 5884AD [1,1,0,0,0,0|2,0,0]=4 60 B6R0.7 CC(C)S(=O)(=O)[O-] 7069AF [1,1,0,0,0,0|0,0,1]=3 61 B6R0.7 CC(C)S(C)(=O)=O 8108AL [1,1,0,0,0,0|1,0,0]=3 62 B6R0.7 CC(N)P(=O)(O)O 9663AJ [1,1,0,0,0,0|1,0,1]=4 63 B6R0.7 NS(=O)(=O)C(F)F V6274 [1,1,0,0,0,0|2,0,0]=4 64 B6R0.8 C=CS(=O)(=O)NC 2577AB [1,1,0,0,0,0|2,0,0]=4 65 B8R0.21 COCCCS(=O)(=O)O 5909AJ [0,2,0,0,0,0|1,0,0]=3 66 B8R0.21 N#CCCCS(=O)(=O)[O-] 7338AJ [0,2,0,0,0,0|0,0,2]=4 67 B8R0.21 O=S(=O)(Cl)NCCCCl 4744AJ [0,2,0,0,0,0|2,0,0]=4 68 B8R0.24 CNC(=O)CS(C)(=O)=O 7284AJ [0,2,0,0,0,0|1,0,1]=4 69 B8R0.24 CS(=O)(=O)C\C(N)=N\O 3807AE [0,2,0,0,0,0|1,0,1]=4 70 B8R0.24 O=S(=O)([O-])CC(Br)CBr 7088AB [0,2,0,0,0,0|1,0,1]=4 71 B8R0.12 CC(C)S(=O)(=O)CCN 3529AB [0,2,0,0,0,0|1,0,0]=3 72 B8R0.12 CN(C)S(=O)(=O)CCN 0672AP [0,2,0,0,0,0|1,0,0]=3 73 B8R0.12 CN(C)S(=O)(=O)CCN 5520AC [0,2,0,0,0,0|1,0,0]=3 74 B8R0.12 CN(C)S(=O)(=O)CCO Z5300 [0,2,0,0,0,0|2,0,0]=4 75 B6R1.5 NC1CC(O)C1 3558AA [1,0,0,1,0,0|2,0,0]=4 76 B6R1.5 NC1CC(O)C1 Z3827 [1,0,0,1,0,0|2,0,0]=4 77 B6R1.10 O=S1(=O)CCC1 V6677 [1,0,0,1,0,0|1,0,0]=3 78 B6R1.11 O=C(O)C1CN1 7766AB [1,0,0,1,0,0|1,0,0]=3 79 B8R1.51 NC1C=CS(=O)(=O)C1 5679AE [0,1,0,1,0,0|1,0,0]=3 80 B8R1.51 O=S1(=O)C=CC(Br)C1 V6451 [0,1,0,1,0,0|2,0,0]=4 81 B8R1.51 O=S1(=O)CC(Br)CO1 9883AA [0,1,0,1,0,0|1,0,0]=3 82 B8R1.55 CS(=O)(=O)C1CNC1 Z6913 [0,1,0,1,0,0|1,0,0]=3