0 B5R0.3 C(C(=O)C=O)O A2Z00050060 [0,0,0,0,0,0|0,2,2]=4 1 B5R0.3 CCN(CC)N A2Z00049169 [0,0,0,0,0,0|4,0,0]=4 2 B4R0.1 CC(=O)CO A2Z00094832 [1,0,0,0,0,0|0,1,1]=3 3 B4R0.1 CC(C)CBr A2Z00038648 [1,0,0,0,0,0|2,0,0]=3 4 B4R0.1 C[C@@H](CO)N A2Z00045067 [1,0,0,0,0,0|1,0,0]=2 5 B4R0.2 C(CBr)CBr A2Z00093585 [1,0,0,0,0,0|2,0,0]=3 6 B4R0.2 C(CON)O A2Z00048270 [1,0,0,0,0,0|2,0,0]=3 7 B4R0.2 C(CS)C#N A2Z00070143 [1,0,0,0,0,0|1,0,1]=3 8 B4R0.2 CCCCBr A2Z00093542 [1,0,0,0,0,0|2,0,0]=3 9 B4R0.2 CCCCN A2Z00093484 [1,0,0,0,0,0|2,0,0]=3 10 B4R0.2 CNCCCl A2Z00094137 [1,0,0,0,0,0|3,0,0]=4 11 B6R0.1 CCN(C)CCO A2Z00049387 [0,1,0,0,0,0|3,0,0]=4 12 B6R0.3 C(C(C(=O)N)N)O A2Z00085566 [0,1,0,0,0,0|1,1,1]=4 13 B6R0.3 C(C(C(=O)O)N)O A2Z00096658 [0,1,0,0,0,0|1,1,1]=4 14 B6R0.3 CC(C)C(=O)CO A2Z00049695 [0,1,0,0,0,0|1,1,1]=4 15 B6R0.3 CC(CO)[N+](=O)[O-] A2Z00048273 [0,1,0,0,0,0|2,1,0]=4 16 B6R0.8 CC(C)(CN)CO A2Z00097428 [0,1,0,0,0,0|2,0,0]=3 17 B6R0.9 CCC(CC)CN A2Z00049557 [0,1,0,0,0,0|3,0,0]=4 18 B6R1.2 C1CCC(C1)N A2Z00093486 [0,0,0,1,0,0|3,0,0]=4 19 B6R1.2 C1CCC(C1)O A2Z00093488 [0,0,0,1,0,0|2,1,0]=4 20 B3R0.1 C#CCO A2Z00096413 [2,0,0,0,0,0|0,0,2]=4 21 B3R0.1 C(CS)N A2Z00095999 [2,0,0,0,0,0|1,0,0]=3 22 B3R0.1 CCCBr A2Z00093521 [2,0,0,0,0,0|1,0,0]=3 23 B3R0.1 CCCN A2Z00093482 [2,0,0,0,0,0|1,0,0]=3 24 B3R0.2 CC(C)Br A2Z00093522 [2,0,0,0,0,0|1,0,0]=3 25 B3R0.2 CC(C)N A2Z00093481 [2,0,0,0,0,0|1,0,0]=3 26 B3R0.2 CN(C)N A2Z00049168 [2,0,0,0,0,0|2,0,0]=4 27 B5R0.1 CC(C)CCBr A2Z00093551 [1,1,0,0,0,0|2,0,0]=4 28 B5R0.1 CC(C)C[N+]#[C-] A2Z00050390 [1,1,0,0,0,0|2,0,0]=4 29 B5R0.1 CC(CNN)O A2Z00062183 [1,1,0,0,0,0|1,1,0]=4 30 B5R0.4 CC(C)(CN)O A2Z00045066 [1,1,0,0,0,0|1,1,0]=4 31 B5R0.2 C(CCN)CN A2Z00070215 [1,1,0,0,0,0|2,0,0]=4 32 B5R0.2 C(CO)N=[N+]=[N-] A2Z00096040 [1,1,0,0,0,0|2,0,0]=4 33 B5R0.2 CCCCCBr A2Z00093550 [1,1,0,0,0,0|2,0,0]=4 34 B5R0.2 CCCCNC A2Z00093457 [1,1,0,0,0,0|2,0,0]=4 35 B7R0.2 CC(CN(C)C)CO A2Z00097647 [0,2,0,0,0,0|2,0,0]=4 36 B7R0.2 CCC(CC(=O)O)N A2Z00050458 [0,2,0,0,0,0|2,0,0]=4 37 B7R0.3 CC(CO)NCCO A2Z00049562 [0,2,0,0,0,0|1,1,0]=4 38 B7R0.10 COC(=O)C(CS)N A2Z00096121 [0,2,0,0,0,0|1,0,1]=4 39 B7R0.11 CC(C)(CC#N)CO A2Z00096173 [0,2,0,0,0,0|2,0,0]=4 40 B7R0.11 CC(C)(CN)COC A2Z00096012 [0,2,0,0,0,0|2,0,0]=4 41 B7R0.18 C(C(CO)(CO)N)O A2Z00070220 [0,2,0,0,0,0|0,2,0]=4 42 B5R1.2 C1C(=O)CO1 A2Z00096164 [1,0,0,1,0,0|0,1,1]=4 43 B5R1.2 C1C(CN1)O A2Z00050204 [1,0,0,1,0,0|1,1,0]=4 44 B5R1.2 C1C(CO1)O A2Z00096297 [1,0,0,1,0,0|0,1,0]=3 45 B5R1.3 C1C(O1)CCl A2Z00093491 [1,0,0,1,0,0|1,1,0]=4 46 B5R1.1 C1CCNC1 A2Z00093483 [1,0,0,1,0,0|2,0,0]=4 47 B5R1.1 C1COC=C1 A2Z00050496 [1,0,0,1,0,0|1,0,1]=4 48 B7R1.1 C1CC(OC1)CO A2Z00093498 [0,1,0,1,0,0|1,1,0]=4 49 B7R1.3 CC1COCCN1 A2Z00047114 [0,1,0,1,0,0|2,0,0]=4 50 B7R1.4 C1CC(C(C1)O)N A2Z00095968 [0,1,0,1,0,0|2,0,0]=4