0 B8R0.4 C(CCCF)CCCF LS40668 [0,0,0,0,0,0|3,0,0]=3 1 B8R0.4 C(CCCO)CCCF LS40660 [0,0,0,0,0,0|3,0,0]=3 2 B8R0.4 C(CCCO)CCCO LS40221 [0,0,0,0,0,0|3,0,0]=3 3 B7R0.1 C#CCCCCCO LS40112 [1,0,0,0,0,0|1,0,2]=4 4 B7R0.1 C(CCCF)CCF LS40667 [1,0,0,0,0,0|2,0,0]=3 5 B7R0.1 C(CCCF)CCO LS40659 [1,0,0,0,0,0|2,0,0]=3 6 B7R0.1 C(CCCO)CCN LS40173 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.1 C(CCCS)CCO LS40174 [1,0,0,0,0,0|2,0,0]=3 8 B7R0.1 C=CCCCCCCl LS40295 [1,0,0,0,0,0|1,0,2]=4 9 B9R0.45 C(CCCCF)CCCF LS40669 [0,1,0,0,0,0|2,0,0]=3 10 B9R0.45 C(CCCCF)CCCO LS40661 [0,1,0,0,0,0|2,0,0]=3 11 B9R1.8 C1CCNC(C1)CCO LS21152 [0,0,0,1,0,0|2,0,0]=3 12 B9R1.12 CCCCN1CCCC1 LS20142 [0,0,0,1,0,0|1,0,0]=2 13 B9R1.12 CCOCC1CCCO1 LS41243 [0,0,0,1,0,0|3,0,0]=4 14 B9R1.103 C1CNCCNCCN1 LS40184 [0,0,0,1,0,0|3,0,0]=4 15 B6R0.6 C(CCF)CCF LS40666 [2,0,0,0,0,0|2,0,0]=4 16 B6R0.6 C(CCO)CCF LS40658 [2,0,0,0,0,0|2,0,0]=4 17 B6R0.6 COCCCCCl LS00136 [2,0,0,0,0,0|2,0,0]=4 18 B8R0.7 B(CCCCCC)(O)O LS11158 [1,1,0,0,0,0|2,0,0]=4 19 B10R0.4 B(CCCCCCCC)(O)O LS11160 [0,2,0,0,0,0|2,0,0]=4 20 B10R0.71 C(CCCCO)CCCCF LS40662 [0,2,0,0,0,0|1,0,0]=3 21 B10R0.71 C(CCCl)COCCCCCl LS41698 [0,2,0,0,0,0|0,1,0]=3 22 B10R0.71 CCCCCCCC#CCO LS40218 [0,2,0,0,0,0|1,0,1]=4 23 B8R1.2 C1CCC(CC1)C=O LS40273 [1,0,0,1,0,0|1,0,1]=4 24 B8R1.2 C1CCC(CC1)CN LS40038 [1,0,0,1,0,0|1,0,0]=3 25 B8R1.2 C1CCOC(C1)CO LS20884 [1,0,0,1,0,0|1,1,0]=4 26 B8R1.2 C1CNCCC1CN LS21222 [1,0,0,1,0,0|2,0,0]=4 27 B8R1.2 CCN1CCNCC1 LS20285 [1,0,0,1,0,0|2,0,0]=4 28 B8R1.2 CC[C@@H]1COCCN1 LS30017 [1,0,0,1,0,0|1,1,0]=4 29 B8R1.2 CC[C@H]1COCCN1 LS30018 [1,0,0,1,0,0|1,1,0]=4 30 B8R1.2 CNC1CCCNC1 LS20138 [1,0,0,1,0,0|2,0,0]=4 31 B8R1.2 CSC1CCNCC1 LS20119 [1,0,0,1,0,0|2,0,0]=4 32 B8R1.5 C1CC[C@@H]([C@H](C1)N)N LS30194 [1,0,0,1,0,0|2,0,0]=4 33 B8R1.5 C1CC[C@@H]([C@H](C1)N)O LS30024 [1,0,0,1,0,0|2,0,0]=4 34 B8R1.5 C1CC[C@@H]([C@H](C1)N)O LS30123 [1,0,0,1,0,0|2,0,0]=4 35 B8R1.5 C1CC[C@H]([C@@H](C1)N)N LS30059 [1,0,0,1,0,0|2,0,0]=4 36 B8R1.5 C1CC[C@H]([C@H](C1)N)O LS30029 [1,0,0,1,0,0|2,0,0]=4 37 B8R1.8 C1CCN(C1)CCN LS20889 [1,0,0,1,0,0|2,0,0]=4 38 B10R1.29 CCCCN1CCCC1=O LS40516 [0,1,0,1,0,0|1,0,1]=4 39 B10R1.17 C1CCOC(C1)OCCBr LS40775 [0,1,0,1,0,0|1,1,0]=4 40 B10R1.17 C1CNCCC1CCCO LS20465 [0,1,0,1,0,0|2,0,0]=4 41 B10R1.17 CCCCN1CCOCC1 LS20030 [0,1,0,1,0,0|1,0,0]=3 42 B10R2.7 C1C[C@H]2CNC[C@H]2NC1 LS30169 [0,0,0,2,0,0|2,0,0]=4