0 B6R0.6 C(COCCI)O DA-28616 [0,0,0,0,0,0|2,0,0]=2 1 B6R0.6 CCCOCC=O DA-25689 [0,0,0,0,0,0|2,0,2]=4 2 B6R0.6 CCC[Sn+2]CCC DA-34908 [0,0,0,0,0,0|3,0,0]=3 3 B5R0.2 C(CCBr)CN DA-21372 [1,0,0,0,0,0|2,0,0]=3 4 B5R0.2 CNCCCBr DA-25561 [1,0,0,0,0,0|3,0,0]=4 5 B5R0.2 CNCCCBr DA-42177 [1,0,0,0,0,0|3,0,0]=4 6 B7R0.1 C#CCCNCCO DA-28477 [0,1,0,0,0,0|1,0,0]=2 7 B7R0.1 CCCOCCCN DA-43561 [0,1,0,0,0,0|3,0,0]=4 8 B7R0.1 CCOCC#CCO DA-39467 [0,1,0,0,0,0|2,0,1]=4 9 B7R0.3 C(CNC(=O)CBr)N DA-31826 [0,1,0,0,0,0|2,0,1]=4 10 B7R0.4 CC(C)CCCCCl DA-29531 [0,1,0,0,0,0|3,0,0]=4 11 B7R0.4 CCCNCC(C)C DA-42549 [0,1,0,0,0,0|2,0,0]=3 12 B7R0.7 CN(CCN)CCO DA-27048 [0,1,0,0,0,0|1,0,0]=2 13 B7R1.1 C1CC(NC1)C#N DA-25679 [0,0,0,1,0,0|2,0,1]=4 14 B7R1.1 C1COC(O1)CO DA-30497 [0,0,0,1,0,0|1,0,0]=2 15 B7R1.3 C1C=CC(CO1)O DA-42425 [0,0,0,1,0,0|2,0,1]=4 16 B7R1.4 C1[C@H]([C@H](CN1)O)O DA-34970 [0,0,0,1,0,0|0,0,0]=1 17 B7R1.4 CC1CNCC1N DA-39111 [0,0,0,1,0,0|2,0,0]=3 18 B7R1.7 C1CC1C#CCO DA-48339 [0,0,0,1,0,0|2,0,1]=4 19 B7R1.7 C1CC1CCCO DA-34927 [0,0,0,1,0,0|2,0,0]=3 20 B7R1.8 CC1COC1CI DA-27675 [0,0,0,1,0,0|3,0,0]=4 21 B7R1.9 C#CC1CC1CO DA-44618 [0,0,0,1,0,0|2,0,1]=4 22 B4R0.2 C(CF)CI DA-31704 [2,0,0,0,0,0|2,0,0]=4 23 B4R0.2 CSCCI DA-47993 [2,0,0,0,0,0|2,0,0]=4 24 B6R0.1 C#CCC(CO)O DA-39002 [1,1,0,0,0,0|1,0,1]=4 25 B6R0.1 CC(CCO)C=C DA-23352 [1,1,0,0,0,0|1,0,1]=4 26 B6R0.1 CCC(C)CCCl DA-29559 [1,1,0,0,0,0|2,0,0]=4 27 B6R0.1 CCNC(C)CO DA-27702 [1,1,0,0,0,0|0,0,0]=2 28 B6R0.4 C(CO)NC(=S)N DA-42881 [1,1,0,0,0,0|0,1,1]=4 29 B6R0.4 CC(C)CCCCl DA-29542 [1,1,0,0,0,0|2,0,0]=4 30 B6R0.4 CC(C)NCCCl DA-41865 [1,1,0,0,0,0|1,0,0]=3 31 B8R0.1 CN(CCOC)CC#C DA-43203 [0,2,0,0,0,0|1,0,1]=4 32 B8R0.4 C(CCC#CI)CCO DA-35631 [0,2,0,0,0,0|2,0,0]=4 33 B8R0.6 C=CCNCC(C=C)O DA-47205 [0,2,0,0,0,0|1,0,1]=4 34 B8R0.6 COC(=O)CCCCO DA-32302 [0,2,0,0,0,0|1,0,1]=4 35 B8R0.7 CC(C)CCCCCO DA-36043 [0,2,0,0,0,0|2,0,0]=4 36 B8R0.21 C(CCS(=O)(=O)O)CO DA-39367 [0,2,0,0,0,0|2,0,0]=4 37 B8R0.21 CC(C)(CCCCBr)O DA-36477 [0,2,0,0,0,0|2,0,0]=4 38 B8R0.22 CCN(CCO)CCCl DA-27030 [0,2,0,0,0,0|1,0,0]=3 39 B8R0.30 C(CS(=O)(=O)CCO)N DA-27047 [0,2,0,0,0,0|2,0,0]=4 40 B6R1.1 C1COCCN1 DA-42330 [1,0,0,1,0,0|0,0,0]=2 41 B6R1.3 C1CC1CCI DA-32105 [1,0,0,1,0,0|2,0,0]=4 42 B6R1.6 C1CC(C1)CCl DA-31839 [1,0,0,1,0,0|2,0,0]=4 43 B8R1.2 C1CC=C(OC1)CO DA-24742 [0,1,0,1,0,0|1,0,1]=4 44 B8R1.5 C1COCC(C1=O)O DA-41566 [0,1,0,1,0,0|1,0,1]=4 45 B8R1.5 CC1C(=O)NCCO1 DA-25909 [0,1,0,1,0,0|1,0,1]=4 46 B8R1.10 C1CC(C1)NCCN DA-47821 [0,1,0,1,0,0|2,0,0]=4 47 B8R1.11 CCC1C(CCN1)N DA-26252 [0,1,0,1,0,0|2,0,0]=4 48 B8R1.22 C1COCCNC1=O DA-48241 [0,1,0,1,0,0|1,0,1]=4 49 B8R1.22 CC1CCNCCO1 DA-35898 [0,1,0,1,0,0|1,0,0]=3 50 B8R1.36 C1CC1CNCCO DA-41973 [0,1,0,1,0,0|1,0,0]=3 51 B8R1.1 CC1CCC(O1)CN DA-41589 [0,1,0,1,0,0|2,0,0]=4 52 B8R1.3 CC1CNC(=O)CO1 DA-36000 [0,1,0,1,0,0|1,0,1]=4 53 B8R1.52 CC1(CCCO1)CO DA-41290 [0,1,0,1,0,0|1,0,0]=3 54 B8R1.4 C1C(COCC1O)N DA-45315 [0,1,0,1,0,0|2,0,0]=4 55 B8R1.4 C1CC(CC(C1)O)N DA-24178 [0,1,0,1,0,0|2,0,0]=4 56 B8R1.4 CN1CCC[C@H](C1)N DA-32015 [0,1,0,1,0,0|2,0,0]=4 57 B8R1.4 C[C@@H]1C[C@@H](CNC1)C DA-34969 [0,1,0,1,0,0|2,0,0]=4 58 B8R1.35 CC(C)CNC1CC1 DA-43252 [0,1,0,1,0,0|2,0,0]=4 59 B8R1.35 CC(C)CNC1CC1 DA-48333 [0,1,0,1,0,0|2,0,0]=4 60 B8R1.72 CC1(CCCOC1)O DA-42642 [0,1,0,1,0,0|2,0,0]=4 61 B8R2.22 C1CC2C1CNC2 DA-24125 [0,0,0,2,0,0|2,0,0]=4 62 B8R2.55 C1CC2(CC2)NC1 DA-23155 [0,0,0,2,0,0|2,0,0]=4 63 B8R2.18 C1C2C1CC(C2)O DA-35031 [0,0,0,2,0,0|2,0,0]=4