0 B8R0.4 C=C\C=C\CCCCC 102639 [0,0,0,0,0,0|1,0,3]=4 1 B8R0.4 CCCCCCCCF 102297 [0,0,0,0,0,0|1,0,0]=1 2 B8R0.4 CCC\C=C\CCCC 102651 [0,0,0,0,0,0|1,0,2]=3 3 B8R0.4 COCOCCCCCl 102435 [0,0,0,0,0,0|3,0,0]=3 4 B8R0.4 NCCCOCCCN 21383 [0,0,0,0,0,0|3,0,0]=3 5 B7R0.1 CCCCC\C=C\I 102635 [1,0,0,0,0,0|1,0,2]=4 6 B7R0.1 C\C=C/CCCCC 102713 [1,0,0,0,0,0|0,0,2]=3 7 B7R0.1 C\C=C/CCCCO 102708 [1,0,0,0,0,0|0,0,2]=3 8 B9R0.2 CCCCCC\C=C(\C)I 102863 [0,1,0,0,0,0|1,0,2]=4 9 B9R0.2 CCCCC\C=C/C(C)C 100783 [0,1,0,0,0,0|1,0,2]=4 10 B9R0.2 CCCCC\C=C\C(C)C 100780 [0,1,0,0,0,0|1,0,2]=4 11 B9R0.2 O=C(O)CCCCCCBr 102846 [0,1,0,0,0,0|1,0,1]=3 12 B9R0.5 CCCCCC(C)CC=O 21557 [0,1,0,0,0,0|0,0,2]=3 13 B9R0.18 C=C(CCCC)CCCC 102634 [0,1,0,0,0,0|1,0,1]=3 14 B9R0.18 CCCCC(=O)COCC 103118 [0,1,0,0,0,0|2,0,1]=4 15 B9R0.45 C#CCCCCOCOC 102449 [0,1,0,0,0,0|1,0,2]=4 16 B9R0.45 C=C\C=C/CCCCCC 102636 [0,1,0,0,0,0|1,0,2]=4 17 B9R0.45 CCCCCC\C=C\OC 103080 [0,1,0,0,0,0|0,0,2]=3 18 B9R0.45 CCCC\C=C/CCCC 102626 [0,1,0,0,0,0|1,0,1]=3 19 B9R0.45 FCCCCCCCCF 102291 [0,1,0,0,0,0|1,0,0]=2 20 B9R0.45 OCCCCCCCCBr 102270 [0,1,0,0,0,0|0,0,0]=1 21 B9R0.46 CCCCCCC(=O)NN 841 [0,1,0,0,0,0|2,0,1]=4 22 B9R1.103 C1CNCCNCCN1 21543 [0,0,0,1,0,0|3,0,0]=4 23 B9R1.103 C1CNCCNCCN1 21585 [0,0,0,1,0,0|3,0,0]=4 24 B9R1.103 C1CNCCNCCN1 21695 [0,0,0,1,0,0|3,0,0]=4 25 B9R1.103 C1CNCCSCCN1 21568 [0,0,0,1,0,0|2,1,0]=4 26 B9R1.103 C1CNCCSCCN1 21599 [0,0,0,1,0,0|2,1,0]=4 27 B6R0.6 CCC#CCCC 102645 [2,0,0,0,0,0|0,0,2]=4 28 B6R0.6 C\C=C/CCCO 102707 [2,0,0,0,0,0|0,0,2]=4 29 B8R0.6 CCCCCC(O)CF 100185 [1,1,0,0,0,0|1,0,0]=3 30 B8R0.6 COC(=O)CCCCO 102453 [1,1,0,0,0,0|1,0,1]=4 31 B8R0.7 C=C(C)COCCCC 102301 [1,1,0,0,0,0|1,0,1]=4 32 B10R0.3 C=C(C)CCCC(C)CCBr 12189 [0,2,0,0,0,0|1,0,1]=4 33 B10R0.3 C=C(C)CCCC(C)CCO 12188 [0,2,0,0,0,0|0,0,1]=3 34 B10R0.3 CC(C)CCCC(C)CCO 12191 [0,2,0,0,0,0|0,0,0]=2 35 B10R0.4 CCCCCCCC[S@@+](C)[O-] 18403 [0,2,0,0,0,0|0,0,1]=3 36 B10R0.4 CCCCCC\C=C\C(C)O 102646 [0,2,0,0,0,0|0,0,1]=3 37 B10R0.55 O=C(O)CCCCC(F)CBr 102155 [0,2,0,0,0,0|1,0,1]=4 38 B10R0.74 CCCCCC\C=C(\I)CC 102638 [0,2,0,0,0,0|1,0,1]=4 39 B10R0.91 CCCC\C=C(\Br)CCCC 102630 [0,2,0,0,0,0|1,0,1]=4 40 B10R0.156 CCCCCC(C)(C)CC#N 21558 [0,2,0,0,0,0|1,0,1]=4 41 B10R0.116 CCCCP(C)(=O)CCCC 103103 [0,2,0,0,0,0|2,0,0]=4 42 B10R0.116 CCCC[P+](C)(C)CCCC 103050 [0,2,0,0,0,0|2,0,0]=4 43 B10R0.71 CCCCCCCC#CCO 19498 [0,2,0,0,0,0|0,0,0]=2 44 B10R0.71 CCCCCC\C=C\CCO 102648 [0,2,0,0,0,0|0,0,0]=2 45 B10R0.71 COCOCCCCCCCl 102441 [0,2,0,0,0,0|1,0,0]=3 46 B10R0.71 N#CCCCCCCCCO 102452 [0,2,0,0,0,0|0,0,0]=2 47 B10R0.71 NCCSCCCSCCN 21675 [0,2,0,0,0,0|2,0,0]=4 48 B10R0.71 NCCSCCCSCCN 21739 [0,2,0,0,0,0|2,0,0]=4 49 B8R1.2 ON=C1CCCCC1 19847 [1,0,0,1,0,0|1,0,1]=4 50 B8R1.5 NC1CCCCC1O 19764 [1,0,0,1,0,0|1,0,0]=3 51 B8R1.5 O[C@@H]1CCCC[C@H]1Cl 19437 [1,0,0,1,0,0|1,0,0]=3 52 B8R1.5 O[C@@H]1CCCC[C@H]1O 19322 [1,0,0,1,0,0|1,0,0]=3 53 B8R1.5 O[C@H]1CCCC[C@@H]1O 19323 [1,0,0,1,0,0|1,0,0]=3 54 B8R1.5 O[C@H]1CCCC[C@H]1O 19324 [1,0,0,1,0,0|1,0,0]=3 55 B10R1.61 CC(C)C1CCCCC1O 777 [0,1,0,1,0,0|0,0,0]=2 56 B10R1.61 CC(C)[C@H]1CCCC[C@@H]1O 778 [0,1,0,1,0,0|0,0,0]=2 57 B10R1.79 [NH2+]1CC(O)C[NH2+]CC(O)C1 846 [0,1,0,1,0,0|2,0,0]=4 58 B10R1.185 C1CNCCNCCNC1 21542 [0,1,0,1,0,0|2,0,0]=4 59 B10R1.185 C1CNCCSCCNC1 21560 [0,1,0,1,0,0|1,1,0]=4 60 B10R2.483 C1CC[N+]2(C1)CCCC2 15499 [0,0,0,2,0,0|2,0,0]=4