0 B6R0.2 C(C(=O)N)[N+](=O)[O-] A2Z00096710 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.2 C(C(=O)O)C(=O)O A2Z00038640 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.2 CC(=C[N+](=O)[O-])C A2Z00094964 [0,0,0,0,0,0|2,0,2]=4 3 B6R0.2 CC(C)NC(C)C A2Z00095976 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.1 C(C#N)C(=O)N A2Z00096074 [1,0,0,0,0,0|2,0,1]=4 5 B5R0.1 C(C#N)C(=O)O A2Z00093469 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.1 C(CBr)C(=O)N A2Z00070352 [1,0,0,0,0,0|2,0,0]=3 7 B5R0.1 CC(=O)CCN A2Z00069826 [1,0,0,0,0,0|1,0,0]=2 8 B5R0.1 CC(C)CCBr A2Z00093551 [1,0,0,0,0,0|1,0,1]=3 9 B5R0.1 CC(C)C[N+]#[C-] A2Z00050390 [1,0,0,0,0,0|1,0,1]=3 10 B5R0.1 CC(CNN)O A2Z00062183 [1,0,0,0,0,0|3,0,0]=4 11 B5R0.1 CCCC(=O)O A2Z00093490 [1,0,0,0,0,0|1,0,0]=2 12 B5R0.1 CN(C)CCCl A2Z00093594 [1,0,0,0,0,0|2,0,1]=4 13 B5R0.1 CNCC(=O)O A2Z00095987 [1,0,0,0,0,0|2,0,0]=3 14 B5R0.1 COCC(=O)Cl A2Z00094312 [1,0,0,0,0,0|2,0,0]=3 15 B5R0.1 CSCC(=N)N A2Z00074300 [1,0,0,0,0,0|3,0,0]=4 16 B7R0.2 CC(=O)CC(=O)OC A2Z00093511 [0,1,0,0,0,0|1,0,1]=3 17 B7R0.2 CC(C)NC(=O)CCl A2Z00099276 [0,1,0,0,0,0|1,0,0]=2 18 B7R0.2 CC(CN(C)C)CO A2Z00097647 [0,1,0,0,0,0|2,0,0]=3 19 B7R0.2 CC(CO)NC(=O)C A2Z00047992 [0,1,0,0,0,0|1,0,0]=2 20 B7R0.2 CCC(CC(=O)O)N A2Z00050458 [0,1,0,0,0,0|2,0,0]=3 21 B7R0.2 COC(=O)CC(=O)Cl A2Z00050191 [0,1,0,0,0,0|2,0,1]=4 22 B7R0.9 CC(C)(C)NC(=O)N A2Z00097411 [0,1,0,0,0,0|2,0,0]=3 23 B7R0.9 CC(C)(CN(C)C)O A2Z00048057 [0,1,0,0,0,0|2,0,0]=3 24 B7R0.9 CC(C)NS(=O)(=O)Cl A2Z00048836 [0,1,0,0,0,0|3,0,0]=4 25 B7R0.16 BN(C(C)C)C(C)C A2Z00095533 [0,1,0,0,0,0|2,0,1]=4 26 B7R0.16 CC(C)C(=C)C(=O)O A2Z00049593 [0,1,0,0,0,0|1,0,1]=3 27 B7R1.2 C1CC(=O)OC1O A2Z00096558 [0,0,0,1,0,0|2,0,0]=3 28 B7R1.2 CC1=CC(=O)CC1 A2Z00096078 [0,0,0,1,0,0|0,0,2]=3 29 B7R1.2 CC1CNC(=O)O1 A2Z00096651 [0,0,0,1,0,0|2,0,0]=3 30 B5R0.5 CC(=O)N(C)N A2Z00094878 [0,0,0,0,1,0|2,0,0]=3 31 B5R0.5 CC(C(=O)C)Cl A2Z00093500 [0,0,0,0,1,0|1,0,0]=2 32 B5R0.5 CC(C(=O)N)Cl A2Z00098040 [0,0,0,0,1,0|2,0,0]=3 33 B5R0.5 CN(C)C(=O)Cl A2Z00096010 [0,0,0,0,1,0|2,0,0]=3 34 B7R0.6 CC(=O)\C=C\N(C)C A2Z00096534 [0,0,0,0,0,1|1,0,1]=3 35 B7R0.6 CC(C)COC(=O)Cl A2Z00093541 [0,0,0,0,0,1|1,0,0]=2 36 B7R0.6 CC(C)SCC(=O)O A2Z00055812 [0,0,0,0,0,1|1,0,0]=2 37 B7R0.6 CN(C)CCC(=O)O A2Z00094718 [0,0,0,0,0,1|2,0,0]=3 38 B4R0.1 C(C(=O)Cl)Cl A2Z00093506 [2,0,0,0,0,0|2,0,0]=4 39 B4R0.1 CC(=O)CO A2Z00094832 [2,0,0,0,0,0|1,0,0]=3 40 B4R0.1 CC(C)CBr A2Z00038648 [2,0,0,0,0,0|1,0,0]=3 41 B4R0.1 CCC(=O)N A2Z00097941 [2,0,0,0,0,0|1,0,0]=3 42 B4R0.1 COC(=O)Cl A2Z00093492 [2,0,0,0,0,0|2,0,0]=4 43 B4R0.1 C[C@@H](CO)N A2Z00045067 [2,0,0,0,0,0|1,0,1]=4 44 B4R0.2 CCCCBr A2Z00093542 [2,0,0,0,0,0|1,0,1]=4 45 B4R0.2 CCCCN A2Z00093484 [2,0,0,0,0,0|1,0,1]=4 46 B4R0.2 CNCCCl A2Z00094137 [2,0,0,0,0,0|2,0,0]=4 47 B6R0.1 CCC(C)N=C=O A2Z00046535 [1,1,0,0,0,0|1,0,1]=4 48 B6R0.1 CCOC(=O)C#N A2Z00096059 [1,1,0,0,0,0|1,0,1]=4 49 B6R0.1 CCOC(=O)CBr A2Z00093566 [1,1,0,0,0,0|1,0,0]=3 50 B6R0.1 CCOC(=O)NN A2Z00096080 [1,1,0,0,0,0|2,0,0]=4 51 B6R0.1 CNC(=O)CON A2Z00070422 [1,1,0,0,0,0|2,0,0]=4 52 B6R0.1 COC(=O)CCS A2Z00096087 [1,1,0,0,0,0|1,0,0]=3 53 B6R0.1 COC(=O)C[N+]#[C-] A2Z00096250 [1,1,0,0,0,0|1,0,1]=4 54 B6R0.3 C(C(C(=O)N)N)O A2Z00085566 [1,1,0,0,0,0|2,0,0]=4 55 B6R0.3 C(C(C(=O)O)N)O A2Z00096658 [1,1,0,0,0,0|2,0,0]=4 56 B6R0.3 CC(C)C(C#N)N A2Z00094740 [1,1,0,0,0,0|1,0,1]=4 57 B6R0.4 C(CC(=O)N)CCl A2Z00070345 [1,1,0,0,0,0|1,0,0]=3 58 B6R0.4 CC(=O)CCCCl A2Z00094593 [1,1,0,0,0,0|0,0,0]=2 59 B6R0.4 CC(=O)OCC#C A2Z00096305 [1,1,0,0,0,0|0,0,2]=4 60 B6R0.4 CC(=O)OCCBr A2Z00098196 [1,1,0,0,0,0|1,0,0]=3 61 B6R0.4 CC(=O)\C=C\OC A2Z00096533 [1,1,0,0,0,0|0,0,2]=4 62 B6R0.4 CC(C)CN=C=O A2Z00046534 [1,1,0,0,0,0|0,0,1]=3 63 B6R0.4 CC(C)OCCN A2Z00047141 [1,1,0,0,0,0|1,0,1]=4 64 B6R0.4 CCCNC(C)C A2Z00048056 [1,1,0,0,0,0|0,0,1]=3 65 B6R0.4 CN(C)CCCCl A2Z00093595 [1,1,0,0,0,0|1,0,1]=4 66 B6R0.5 CC(C)(C)CCCl A2Z00094836 [1,1,0,0,0,0|1,0,1]=4 67 B6R0.5 CC(C)(C)CNC A2Z00049170 [1,1,0,0,0,0|1,0,0]=3 68 B6R0.5 CS(=O)(=O)CCN A2Z00048059 [1,1,0,0,0,0|2,0,0]=4 69 B6R0.7 CC(C)(C(=O)N)Br A2Z00070347 [0,1,0,0,1,0|1,0,0]=3 70 B6R0.7 CC(C)C(C)(C)N A2Z00047867 [0,1,0,0,1,0|1,0,1]=4 71 B6R0.7 CC(C)S(=O)(=O)N A2Z00094821 [0,1,0,0,1,0|2,0,0]=4 72 B8R0.23 CC(C)C(CC(=O)O)O A2Z00049174 [0,1,0,0,0,1|1,0,0]=3 73 B8R0.29 CC(C)(CCN(C)C)O A2Z00095038 [0,1,0,0,0,1|2,0,0]=4 74 B8R0.2 CC(C(C(=O)O)Br)OC A2Z00049624 [0,2,0,0,0,0|1,0,0]=3 75 B8R0.5 CC(C)NC(=O)CC#N A2Z00098320 [0,2,0,0,0,0|1,0,0]=3 76 B8R0.5 CC(C)NC(=O)CCBr A2Z00098002 [0,2,0,0,0,0|1,0,0]=3 77 B8R0.16 C(C(CN)CO)C(=O)O A2Z00050494 [0,2,0,0,0,0|1,0,0]=3 78 B8R0.16 CC(=O)CC(OC)OC A2Z00096091 [0,2,0,0,0,0|0,0,0]=2 79 B8R0.16 CCN(CC)CC(=O)N A2Z00038591 [0,2,0,0,0,0|2,0,0]=4 80 B8R0.19 CCC(C)NC(=O)CCl A2Z00067385 [0,2,0,0,0,0|1,0,0]=3 81 B8R0.19 CCC(CC(=O)OC)N A2Z00050344 [0,2,0,0,0,0|1,0,0]=3 82 B8R0.19 COC(=O)CC(CN)N A2Z00050464 [0,2,0,0,0,0|1,0,0]=3 83 B8R0.24 CC(C)(C)NC(=O)CCl A2Z00083442 [0,2,0,0,0,0|1,0,0]=3 84 B8R0.24 CC(C)(C)OC(=O)CBr A2Z00096128 [0,2,0,0,0,0|1,0,0]=3 85 B8R0.34 CC(C)(C[N+](=O)[O-])C#N A2Z00094131 [0,2,0,0,0,0|2,0,0]=4 86 B6R1.2 C1CC(=N)NC1 A2Z00096075 [1,0,0,1,0,0|2,0,0]=4 87 B6R1.2 C1CC(=O)C=C1 A2Z00096072 [1,0,0,1,0,0|0,0,2]=4 88 B6R1.2 C1CC(=O)OC1 A2Z00038638 [1,0,0,1,0,0|1,0,0]=3 89 B6R1.2 C1CCC(C1)N A2Z00093486 [1,0,0,1,0,0|1,0,1]=4 90 B6R1.2 C1CCC(C1)O A2Z00093488 [1,0,0,1,0,0|0,0,2]=4 91 B6R1.2 C1CNCC1=O A2Z00050357 [1,0,0,1,0,0|1,0,0]=3 92 B6R1.2 C1COC(=O)N1 A2Z00096076 [1,0,0,1,0,0|2,0,0]=4 93 B6R1.3 C1CC1N=C=O A2Z00046533 [1,0,0,1,0,0|1,0,1]=4 94 B6R1.11 C1CC1C(=O)Cl A2Z00095908 [1,0,0,1,0,0|1,0,0]=3 95 B8R1.3 CC1CCC(CC1)O A2Z00093509 [0,0,0,1,0,1|0,0,2]=4 96 B8R1.35 C1CC1NCC(=O)N A2Z00049171 [0,0,0,1,0,1|1,0,0]=3 97 B8R1.51 CC1(CC(=O)OC1)C A2Z00096652 [0,0,0,1,0,1|0,0,0]=2 98 B8R1.51 CC1(CCC(=O)C1)C A2Z00096352 [0,0,0,1,0,1|0,0,0]=2 99 B8R1.51 CC1(CCC(C1)N)C A2Z00096353 [0,0,0,1,0,1|1,0,1]=4 100 B8R1.51 CC1(CCC(C1)O)C A2Z00050412 [0,0,0,1,0,1|0,0,2]=4 101 B8R1.1 C1C(CNC1=O)CN A2Z00096245 [0,1,0,1,0,0|1,0,0]=3 102 B8R1.1 C1C(CNC1=O)CO A2Z00050383 [0,1,0,1,0,0|1,0,0]=3 103 B8R1.4 C1CNC(=O)CC1=O A2Z00096248 [0,1,0,1,0,0|1,0,1]=4 104 B8R1.4 CC1CCCC(C1)O A2Z00093510 [0,1,0,1,0,0|0,0,2]=4 105 B8R1.18 CC1=NN(C(=O)C1)C A2Z00096083 [0,1,0,1,0,0|1,0,1]=4 106 B8R1.34 C1C(CO1)CC(=O)O A2Z00096243 [0,1,0,1,0,0|1,0,0]=3 107 B8R1.40 C1CC1NC(=O)CN A2Z00044968 [0,1,0,1,0,0|1,0,0]=3 108 B8R1.54 CC(C1CC1)C(=O)O A2Z00047916 [0,1,0,1,0,0|1,0,0]=3 109 B8R2.38 C1C2C1C(=O)NC2 A2Z00050425 [0,0,0,2,0,0|1,0,0]=3 110 B8R0.28 CC(C)CNCC(C)C A2Z00093471 [0,0,0,0,0,2|1,0,1]=4