0 B5R0.3 CCN(CC)N A2Z00049169 [0,0,0,0,0,0|3,0,0]=3 1 B5R0.3 COC(=O)CI A2Z00098171 [0,0,0,0,0,0|3,0,1]=4 2 B4R0.1 CC(=O)CO A2Z00094832 [1,0,0,0,0,0|2,0,1]=4 3 B4R0.1 CC(C)CBr A2Z00038648 [1,0,0,0,0,0|1,0,0]=2 4 B4R0.1 CCC(=O)N A2Z00097941 [1,0,0,0,0,0|1,0,1]=3 5 B4R0.1 C[C@@H](CO)N A2Z00045067 [1,0,0,0,0,0|1,0,0]=2 6 B4R0.2 C(C#N)ON A2Z00070420 [1,0,0,0,0,0|2,0,1]=4 7 B4R0.2 C(CBr)CBr A2Z00093585 [1,0,0,0,0,0|2,0,0]=3 8 B4R0.2 C(CON)O A2Z00048270 [1,0,0,0,0,0|2,0,0]=3 9 B4R0.2 C(CS)C#N A2Z00070143 [1,0,0,0,0,0|1,0,2]=4 10 B4R0.2 CCCCBr A2Z00093542 [1,0,0,0,0,0|1,0,0]=2 11 B4R0.2 CCCCN A2Z00093484 [1,0,0,0,0,0|0,0,0]=1 12 B4R0.2 CNCCCl A2Z00094137 [1,0,0,0,0,0|2,0,0]=3 13 B4R0.2 COCON A2Z00070421 [1,0,0,0,0,0|2,0,0]=3 14 B6R0.1 CCC(C)N=C=O A2Z00046535 [0,1,0,0,0,0|1,0,1]=3 15 B6R0.1 CCN(C)CCO A2Z00049387 [0,1,0,0,0,0|2,0,0]=3 16 B6R0.1 CCOC(=O)CBr A2Z00093566 [0,1,0,0,0,0|2,0,1]=4 17 B6R0.1 CCOC(=O)NN A2Z00096080 [0,1,0,0,0,0|2,0,1]=4 18 B6R0.1 CNC(=O)CON A2Z00070422 [0,1,0,0,0,0|2,0,1]=4 19 B6R0.3 C(C(C(=O)N)N)O A2Z00085566 [0,1,0,0,0,0|2,0,1]=4 20 B6R0.3 CC(C(=O)NC)N A2Z00049855 [0,1,0,0,0,0|2,0,1]=4 21 B6R0.3 CC(C)C(=O)CO A2Z00049695 [0,1,0,0,0,0|2,0,1]=4 22 B6R0.3 CC(C)C(C#N)N A2Z00094740 [0,1,0,0,0,0|1,0,2]=4 23 B6R0.3 CC(CO)[N+](=O)[O-] A2Z00048273 [0,1,0,0,0,0|3,0,0]=4 24 B6R0.8 CC(C)(CN)C#N A2Z00049740 [0,1,0,0,0,0|1,0,1]=3 25 B6R0.8 CC(C)(CN)CO A2Z00097428 [0,1,0,0,0,0|1,0,0]=2 26 B6R0.9 CCC(CC)CN A2Z00049557 [0,1,0,0,0,0|0,0,0]=1 27 B6R1.2 C1CCC(C1)N A2Z00093486 [0,0,0,1,0,0|2,0,0]=3 28 B6R1.2 C1CCC(C1)O A2Z00093488 [0,0,0,1,0,0|2,0,0]=3 29 B6R1.2 C1CNCC1=O A2Z00050357 [0,0,0,1,0,0|1,0,1]=3 30 B3R0.1 C(CS)N A2Z00095999 [2,0,0,0,0,0|1,0,0]=3 31 B3R0.1 CCCBr A2Z00093521 [2,0,0,0,0,0|1,0,0]=3 32 B3R0.1 CCCN A2Z00093482 [2,0,0,0,0,0|0,0,0]=2 33 B3R0.2 CC(C)Br A2Z00093522 [2,0,0,0,0,0|1,0,0]=3 34 B3R0.2 CC(C)N A2Z00093481 [2,0,0,0,0,0|0,0,0]=2 35 B3R0.2 CN(C)N A2Z00049168 [2,0,0,0,0,0|1,0,0]=3 36 B5R0.1 C(CBr)C(=O)N A2Z00070352 [1,1,0,0,0,0|1,0,1]=4 37 B5R0.1 CC(=O)CCN A2Z00069826 [1,1,0,0,0,0|1,0,1]=4 38 B5R0.1 CC(C)CCBr A2Z00093551 [1,1,0,0,0,0|0,0,0]=2 39 B5R0.1 CC(C)C[N+]#[C-] A2Z00050390 [1,1,0,0,0,0|0,0,1]=3 40 B5R0.1 CC(CNN)O A2Z00062183 [1,1,0,0,0,0|1,0,0]=3 41 B5R0.1 CN(C)CCCl A2Z00093594 [1,1,0,0,0,0|1,0,0]=3 42 B5R0.1 CSCC(=N)N A2Z00074300 [1,1,0,0,0,0|1,0,1]=4 43 B5R0.4 CC(C)(C#N)Br A2Z00049743 [1,1,0,0,0,0|0,0,2]=4 44 B5R0.4 CC(C)(C#N)N A2Z00095432 [1,1,0,0,0,0|0,0,2]=4 45 B5R0.4 CC(C)(CN)O A2Z00045066 [1,1,0,0,0,0|0,0,0]=2 46 B5R0.4 CCS(=O)(=O)C A2Z00068674 [1,1,0,0,0,0|2,0,0]=4 47 B5R0.4 CCS(=O)(=O)N A2Z00094833 [1,1,0,0,0,0|2,0,0]=4 48 B5R0.5 CC(=O)N(C)N A2Z00094878 [1,1,0,0,0,0|1,0,1]=4 49 B5R0.5 CC(C(=O)C)Cl A2Z00093500 [1,1,0,0,0,0|1,0,1]=4 50 B5R0.5 CC(C(=O)N)Cl A2Z00098040 [1,1,0,0,0,0|1,0,1]=4 51 B5R0.2 C(CCN)CN A2Z00070215 [1,1,0,0,0,0|0,0,0]=2 52 B5R0.2 CCCCCBr A2Z00093550 [1,1,0,0,0,0|1,0,0]=3 53 B5R0.2 CCCCNC A2Z00093457 [1,1,0,0,0,0|0,0,0]=2 54 B5R0.2 CCNCC=C A2Z00070010 [1,1,0,0,0,0|1,0,1]=4 55 B7R0.2 CC(CN(C)C)CO A2Z00097647 [0,2,0,0,0,0|1,0,0]=3 56 B7R0.2 CC(CO)NC(=O)C A2Z00047992 [0,2,0,0,0,0|1,0,1]=4 57 B7R0.2 CCC(CC(=O)O)N A2Z00050458 [0,2,0,0,0,0|2,0,0]=4 58 B7R0.3 CC(CO)NCCO A2Z00049562 [0,2,0,0,0,0|1,0,0]=3 59 B7R0.5 CC(C)C(CCN)O A2Z00049172 [0,2,0,0,0,0|1,0,0]=3 60 B7R0.11 CC(C)(CC#N)CO A2Z00096173 [0,2,0,0,0,0|1,0,1]=4 61 B7R0.11 CC(C)(CN)COC A2Z00096012 [0,2,0,0,0,0|0,0,0]=2 62 B7R0.11 CC(C)(COC)C#N A2Z00096011 [0,2,0,0,0,0|0,0,2]=4 63 B7R0.13 CC(C)(CN)C(=O)N A2Z00094796 [0,2,0,0,0,0|1,0,1]=4 64 B7R0.13 CC(C)(CN)N(C)C A2Z00039776 [0,2,0,0,0,0|1,0,0]=3 65 B7R0.15 CC(C(OC)OC)O A2Z00096673 [0,2,0,0,0,0|2,0,0]=4 66 B7R0.18 C(C(CO)(CO)N)O A2Z00070220 [0,2,0,0,0,0|2,0,0]=4 67 B5R1.2 C1C(CN1)O A2Z00050204 [1,0,0,1,0,0|1,0,0]=3 68 B5R1.2 C1C(CO1)O A2Z00096297 [1,0,0,1,0,0|2,0,0]=4 69 B5R1.3 C1C(O1)CCl A2Z00093491 [1,0,0,1,0,0|2,0,0]=4 70 B5R1.1 C1CCNC1 A2Z00093483 [1,0,0,1,0,0|0,0,0]=2 71 B7R1.1 C1CC(OC1)CCl A2Z00093513 [0,1,0,1,0,0|1,0,0]=3 72 B7R1.1 C1CC(OC1)CN A2Z00093497 [0,1,0,1,0,0|0,0,0]=2 73 B7R1.1 C1CC(OC1)CO A2Z00093498 [0,1,0,1,0,0|1,0,0]=3 74 B7R1.1 C1CCC(C1)CN A2Z00046187 [0,1,0,1,0,0|0,0,0]=2 75 B7R1.1 CCC1CCCN1 A2Z00094741 [0,1,0,1,0,0|1,0,0]=3 76 B7R1.1 COC1CCNC1 A2Z00074154 [0,1,0,1,0,0|0,0,0]=2 77 B7R1.2 CC1CNC(=O)O1 A2Z00096651 [0,1,0,1,0,0|1,0,1]=4 78 B7R1.3 C1CC(=O)CNC1 A2Z00096272 [0,1,0,1,0,0|1,0,1]=4 79 B7R1.3 C1CCC(CC1)N A2Z00093495 [0,1,0,1,0,0|2,0,0]=4 80 B7R1.3 CC1CCCNC1 A2Z00093496 [0,1,0,1,0,0|0,0,0]=2 81 B7R1.3 CC1CCNCC1 A2Z00093494 [0,1,0,1,0,0|0,0,0]=2 82 B7R1.3 CC1CNCCO1 A2Z00047116 [0,1,0,1,0,0|0,0,0]=2 83 B7R1.3 CC1COCCN1 A2Z00047114 [0,1,0,1,0,0|1,0,0]=3 84 B7R1.4 C1CC(C(C1)O)N A2Z00095968 [0,1,0,1,0,0|1,0,0]=3 85 B7R1.6 C1CC(C1)N=C=O A2Z00049542 [0,1,0,1,0,0|1,0,1]=4 86 B7R1.14 C1CNCC1(F)F A2Z00096290 [0,1,0,1,0,0|1,0,0]=3 87 B7R2.13 C1C2C1CNC2 A2Z00050358 [0,0,0,2,0,0|0,0,0]=2