0 B8R0.4 C(CCCF)CCCF LS40668 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.4 C(CCCO)CCCF LS40660 [0,0,0,0,0,0|1,0,2]=3 2 B8R0.4 C(CCCO)CCCO LS40221 [0,0,0,0,0,0|1,0,2]=3 3 B7R0.1 C#CCCCCCO LS40112 [1,0,0,0,0,0|0,0,3]=4 4 B7R0.1 C(CCCF)CCF LS40667 [1,0,0,0,0,0|2,0,1]=4 5 B7R0.1 C(CCCF)CCO LS40659 [1,0,0,0,0,0|1,0,1]=3 6 B7R0.1 C(CCCO)CCN LS40173 [1,0,0,0,0,0|1,0,1]=3 7 B7R0.1 C(CCCS)CCO LS40174 [1,0,0,0,0,0|1,0,1]=3 8 B9R0.45 C(CCCCF)CCCF LS40669 [0,1,0,0,0,0|1,0,2]=4 9 B9R0.45 C(CCCCF)CCCO LS40661 [0,1,0,0,0,0|0,0,2]=3 10 B9R1.8 C1CCNC(C1)CCO LS21152 [0,0,0,1,0,0|1,0,1]=3 11 B9R1.8 C1CN(CCN1)CCO LS20284 [0,0,0,1,0,0|2,0,1]=4 12 B9R1.12 CCCCN1CCCC1 LS20142 [0,0,0,1,0,0|2,0,1]=4 13 B9R1.12 CCOCC1CCCO1 LS41243 [0,0,0,1,0,0|1,0,2]=4 14 B6R0.6 C(CCF)CCF LS40666 [2,0,0,0,0,0|2,0,0]=4 15 B6R0.6 C(CCO)CCF LS40658 [2,0,0,0,0,0|1,0,0]=3 16 B6R0.6 C=CCCCCO LS40909 [2,0,0,0,0,0|0,0,2]=4 17 B6R0.6 COCCCCCl LS00136 [2,0,0,0,0,0|2,0,0]=4 18 B8R0.1 CCOC(=O)CCCCl LS41645 [1,1,0,0,0,0|2,0,0]=4 19 B8R0.7 B(CCCCCC)(O)O LS11158 [1,1,0,0,0,0|1,0,1]=4 20 B10R0.4 B(CCCCCCCC)(O)O LS11160 [0,2,0,0,0,0|0,0,2]=4 21 B10R0.71 C(CCCCO)CCCCF LS40662 [0,2,0,0,0,0|0,0,2]=4 22 B10R0.71 CCCCCCCC#CCO LS40218 [0,2,0,0,0,0|0,0,2]=4 23 B8R1.2 C1CCC(CC1)CN LS40038 [1,0,0,1,0,0|1,0,1]=4 24 B8R1.2 C1CCOC(C1)CO LS20884 [1,0,0,1,0,0|1,0,0]=3 25 B8R1.2 C1COC[C@@H](N1)CO LS00103 [1,0,0,1,0,0|2,0,0]=4 26 B8R1.2 C1COC[C@H](N1)CO LS00102 [1,0,0,1,0,0|2,0,0]=4 27 B8R1.2 C1CO[C@@H](CN1)CO LS30134 [1,0,0,1,0,0|2,0,0]=4 28 B8R1.2 CC[C@@H]1COCCN1 LS30017 [1,0,0,1,0,0|2,0,0]=4 29 B8R1.2 CC[C@H]1COCCN1 LS30018 [1,0,0,1,0,0|2,0,0]=4 30 B8R1.5 C1CC[C@@H]([C@H](C1)N)O LS30024 [1,0,0,1,0,0|1,0,1]=4 31 B8R1.5 C1CC[C@@H]([C@H](C1)N)O LS30123 [1,0,0,1,0,0|1,0,1]=4 32 B8R1.5 C1CC[C@H]([C@H](C1)N)O LS30029 [1,0,0,1,0,0|1,0,1]=4 33 B8R1.8 C1CCN(C1)CCN LS20889 [1,0,0,1,0,0|2,0,0]=4 34 B8R1.49 C1\C=C/CC\C=C/C1 LS41132 [1,0,0,1,0,0|0,0,2]=4 35 B10R1.29 CCCCN1CCCC1=O LS40516 [0,1,0,1,0,0|2,0,0]=4 36 B10R1.17 C1CNCCC1CCCO LS20465 [0,1,0,1,0,0|0,0,2]=4