0  B9R0.45  C(CCCCF)CCCF LS40669 [0,0,0,0,0,0|2,0,2]=4
1  B9R0.45  C(CCCCF)CCCO LS40661 [0,0,0,0,0,0|1,0,2]=3
2  B8R0.4  C(CCCF)CCCF LS40668 [1,0,0,0,0,0|2,0,1]=4
3  B8R0.4  C(CCCO)CCCF LS40660 [1,0,0,0,0,0|1,0,1]=3
4  B8R0.4  C(CCCO)CCCO LS40221 [1,0,0,0,0,0|1,0,1]=3
5  B10R0.4  B(CCCCCCCC)(O)O LS11160 [0,1,0,0,0,0|1,0,2]=4
6  B10R0.71  C(CCCCO)CCCCF LS40662 [0,1,0,0,0,0|0,0,2]=3
7  B10R0.71  CCCCCCCC#CCO LS40218 [0,1,0,0,0,0|0,0,3]=4
8  B10R1.17  C1CNCCC1CCCO LS20465 [0,0,0,1,0,0|1,0,2]=4
9  B7R0.1  C#CCCCCCO LS40112 [2,0,0,0,0,0|0,0,2]=4
10  B7R0.1  C(CCCF)CCF LS40667 [2,0,0,0,0,0|2,0,0]=4
11  B7R0.1  C(CCCF)CCO LS40659 [2,0,0,0,0,0|1,0,0]=3
12  B7R0.1  C(CCCO)CCN LS40173 [2,0,0,0,0,0|1,0,0]=3
13  B7R0.1  C(CCCS)CCO LS40174 [2,0,0,0,0,0|1,0,0]=3
14  B11R0.40  CCCCCCCCC(CO)O LS40490 [0,2,0,0,0,0|0,0,2]=4
15  B11R0.3  C(CCCCCF)CCCCO LS40663 [0,2,0,0,0,0|0,0,2]=4
16  B9R1.8  C1CCNC(C1)CCO LS21152 [1,0,0,1,0,0|1,0,1]=4
17  B9R1.8  C1CN(CCN1)CCO LS20284 [1,0,0,1,0,0|2,0,0]=4
18  B9R1.12  CCOCC1CCCO1 LS41243 [1,0,0,1,0,0|1,0,1]=4