0 B6R0.1 CCN(C)CCO A2Z00049387 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.1 C(CBr)C(=O)N A2Z00070352 [1,0,0,0,0,0|2,0,1]=4 2 B5R0.1 CC(=O)CCN A2Z00069826 [1,0,0,0,0,0|1,0,1]=3 3 B5R0.1 CC(C)CCBr A2Z00093551 [1,0,0,0,0,0|1,0,1]=3 4 B5R0.1 CC(C)C[N+]#[C-] A2Z00050390 [1,0,0,0,0,0|1,0,2]=4 5 B5R0.1 CC(CNN)O A2Z00062183 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.1 CCCC(=O)O A2Z00093490 [1,0,0,0,0,0|1,0,1]=3 7 B5R0.1 CN(C)CCCl A2Z00093594 [1,0,0,0,0,0|2,0,1]=4 8 B5R0.1 CNCC(=O)O A2Z00095987 [1,0,0,0,0,0|2,0,1]=4 9 B5R0.1 COCC(=O)Cl A2Z00094312 [1,0,0,0,0,0|2,0,1]=4 10 B5R0.2 C(CCN)CN A2Z00070215 [1,0,0,0,0,0|2,0,1]=4 11 B5R0.2 CCCCCBr A2Z00093550 [1,0,0,0,0,0|1,0,1]=3 12 B5R0.2 CCCCNC A2Z00093457 [1,0,0,0,0,0|2,0,0]=3 13 B5R0.2 CCNCC=C A2Z00070010 [1,0,0,0,0,0|2,0,0]=3 14 B5R0.2 COCN=C=O A2Z00048845 [1,0,0,0,0,0|2,0,1]=4 15 B5R0.3 C(C(=O)C=O)O A2Z00050060 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.2 CC(CN(C)C)CO A2Z00097647 [0,1,0,0,0,0|1,0,2]=4 17 B7R0.3 CC(CO)NCCO A2Z00049562 [0,1,0,0,0,0|1,0,2]=4 18 B7R0.11 CC(C)(CN)COC A2Z00096012 [0,1,0,0,0,0|2,0,1]=4 19 B7R0.11 CC(C)(COC)C#N A2Z00096011 [0,1,0,0,0,0|2,0,1]=4 20 B7R1.1 C1CC(OC1)CCl A2Z00093513 [0,0,0,1,0,0|2,0,1]=4 21 B7R1.1 C1CC(OC1)CN A2Z00093497 [0,0,0,1,0,0|2,0,1]=4 22 B7R1.1 C1CC(OC1)CO A2Z00093498 [0,0,0,1,0,0|1,0,2]=4 23 B7R1.1 C1CCC(C1)CN A2Z00046187 [0,0,0,1,0,0|1,0,1]=3 24 B7R1.1 CCC1CCCN1 A2Z00094741 [0,0,0,1,0,0|2,0,1]=4 25 B7R1.1 COC1CCNC1 A2Z00074154 [0,0,0,1,0,0|3,0,0]=4 26 B7R1.3 C1CC=CC(=O)C1 A2Z00096058 [0,0,0,1,0,0|2,0,1]=4 27 B7R1.3 C1CCC(CC1)N A2Z00093495 [0,0,0,1,0,0|2,0,1]=4 28 B7R1.3 CC1CCCNC1 A2Z00093496 [0,0,0,1,0,0|1,0,1]=3 29 B7R1.3 CC1CCNCC1 A2Z00093494 [0,0,0,1,0,0|2,0,1]=4 30 B7R1.3 CC1CNCCO1 A2Z00047116 [0,0,0,1,0,0|2,0,1]=4 31 B7R1.3 CC1COCCN1 A2Z00047114 [0,0,0,1,0,0|1,0,2]=4 32 B7R1.4 C1CC(C(C1)O)N A2Z00095968 [0,0,0,1,0,0|1,0,2]=4 33 B4R0.1 CC(=O)CO A2Z00094832 [2,0,0,0,0,0|1,0,1]=4 34 B4R0.1 CC(C)CBr A2Z00038648 [2,0,0,0,0,0|1,0,1]=4 35 B4R0.1 CCC(=O)N A2Z00097941 [2,0,0,0,0,0|1,0,1]=4 36 B4R0.1 C[C@@H](CO)N A2Z00045067 [2,0,0,0,0,0|2,0,0]=4 37 B4R0.2 C(CBr)CBr A2Z00093585 [2,0,0,0,0,0|2,0,0]=4 38 B4R0.2 CCCCBr A2Z00093542 [2,0,0,0,0,0|1,0,0]=3 39 B4R0.2 CCCCN A2Z00093484 [2,0,0,0,0,0|1,0,0]=3 40 B4R0.2 CNCCCl A2Z00094137 [2,0,0,0,0,0|2,0,0]=4 41 B6R0.2 CC(C)NC(C)C A2Z00095976 [1,1,0,0,0,0|1,0,1]=4 42 B6R0.4 C(CC(=O)N)CCl A2Z00070345 [1,1,0,0,0,0|1,0,1]=4 43 B6R0.4 CC(=O)CCCCl A2Z00094593 [1,1,0,0,0,0|0,0,1]=3 44 B6R0.4 CC(=O)OCCBr A2Z00098196 [1,1,0,0,0,0|1,0,1]=4 45 B6R0.4 CC(C)OCCN A2Z00047141 [1,1,0,0,0,0|1,0,1]=4 46 B6R0.4 CCCNC(C)C A2Z00048056 [1,1,0,0,0,0|0,0,1]=3 47 B6R0.4 CN(C)CCCCl A2Z00093595 [1,1,0,0,0,0|1,0,1]=4 48 B6R0.5 CC(C)(C)CCCl A2Z00094836 [1,1,0,0,0,0|1,0,1]=4 49 B6R0.5 CC(C)(C)CNC A2Z00049170 [1,1,0,0,0,0|1,0,1]=4 50 B6R0.5 CS(=O)(=O)CCN A2Z00048059 [1,1,0,0,0,0|2,0,0]=4 51 B6R0.6 CCCCCCBr A2Z00093564 [1,1,0,0,0,0|1,0,1]=4 52 B6R0.6 CCCCCCI A2Z00093584 [1,1,0,0,0,0|1,0,1]=4 53 B6R0.6 CCCCCCO A2Z00093499 [1,1,0,0,0,0|0,0,2]=4 54 B6R0.6 COCCCCN A2Z00047139 [1,1,0,0,0,0|1,0,1]=4 55 B6R0.6 COCCN=C=O A2Z00046536 [1,1,0,0,0,0|1,0,1]=4 56 B6R0.9 CCC(CC)CN A2Z00049557 [1,1,0,0,0,0|1,0,1]=4 57 B8R0.2 CC(C(C(=O)O)Br)OC A2Z00049624 [0,2,0,0,0,0|2,0,0]=4 58 B8R0.5 CCC\C(=C\C(=O)O)\C A2Z00049558 [0,2,0,0,0,0|0,0,1]=3 59 B8R0.23 CC(=O)CC(C(=O)O)N A2Z00050345 [0,2,0,0,0,0|1,0,1]=4 60 B8R0.8 CC(C(=O)O)OCCN A2Z00070299 [0,2,0,0,0,0|1,0,0]=3 61 B8R0.8 CSCCC(C(=O)O)N A2Z00093547 [0,2,0,0,0,0|1,0,0]=3 62 B6R1.2 C1CC(=O)OC1 A2Z00038638 [1,0,0,1,0,0|1,0,1]=4 63 B6R1.2 C1CCC(C1)N A2Z00093486 [1,0,0,1,0,0|1,0,0]=3 64 B6R1.2 C1CCC(C1)O A2Z00093488 [1,0,0,1,0,0|0,0,1]=3 65 B6R1.2 C1CNCC1=O A2Z00050357 [1,0,0,1,0,0|1,0,1]=4 66 B6R1.11 C1CC1C(=O)Cl A2Z00095908 [1,0,0,1,0,0|1,0,1]=4 67 B6R1.1 C1CC=COC1 A2Z00050188 [1,0,0,1,0,0|0,0,2]=4 68 B8R1.4 CC1CCCC(C1)O A2Z00093510 [0,1,0,1,0,0|0,0,2]=4 69 B8R1.4 CC1CCCC(N1)C A2Z00093508 [0,1,0,1,0,0|1,0,1]=4 70 B8R1.2 C1CC(CNC1)CO A2Z00049972 [0,1,0,1,0,0|0,0,2]=4 71 B8R1.2 C1CNCCC1C#N A2Z00094290 [0,1,0,1,0,0|1,0,1]=4 72 B8R1.2 C1COCCC1CO A2Z00094827 [0,1,0,1,0,0|0,0,2]=4 73 B8R1.2 CCC1CCCCN1 A2Z00093507 [0,1,0,1,0,0|1,0,1]=4 74 B8R1.3 CC1CCC(CC1)O A2Z00093509 [0,1,0,1,0,0|1,0,1]=4 75 B8R1.5 CC1CCCCC1=O A2Z00038642 [0,1,0,1,0,0|0,0,0]=2 76 B8R1.22 CC1CCCNCC1 A2Z00096454 [0,1,0,1,0,0|1,0,1]=4 77 B8R1.52 C1CCC(C1)(CN)O A2Z00045043 [0,1,0,1,0,0|1,0,1]=4 78 B8R1.7 C1CNCC1C(=O)O A2Z00096244 [0,1,0,1,0,0|1,0,0]=3 79 B8R1.19 CC1(C(=O)CCN1)C A2Z00050354 [0,1,0,1,0,0|1,0,0]=3 80 B8R1.54 CC(C1CC1)C(=O)O A2Z00047916 [0,1,0,1,0,0|0,0,0]=2 81 B8R1.78 CC1(COC1)C(=O)O A2Z00096242 [0,1,0,1,0,0|1,0,0]=3 82 B8R1.8 C1COC(O1)CC=O A2Z00050352 [0,1,0,1,0,0|2,0,0]=4 83 B8R2.55 C1CCC2(C1)CO2 A2Z00094826 [0,0,0,2,0,0|0,0,2]=4 84 B8R2.38 C1C2C1C(=O)NC2 A2Z00050425 [0,0,0,2,0,0|1,0,0]=3