0  B9R0.45  CCCCCCNCCN 18212 [0,0,0,0,0,0|2,0,0]=2
1  B9R0.45  CCCNCCNCCC 22311 [0,0,0,0,0,0|2,0,0]=2
2  B9R0.45  NCCCCNCCCN 21510 [0,0,0,0,0,0|3,0,0]=3
3  B9R0.45  NCCCCNCCCN 21808 [0,0,0,0,0,0|3,0,0]=3
4  B9R0.45  NCCOCCOCCN 23035 [0,0,0,0,0,0|2,0,0]=2
5  B9R0.45  NCCOCCOCCO 23017 [0,0,0,0,0,0|3,0,0]=3
6  B9R0.45  OCCCCCCCCO 22007 [0,0,0,0,0,0|4,0,0]=4
7  B8R0.4  CCCCCOCCO 11137 [1,0,0,0,0,0|3,0,0]=4
8  B8R0.4  OCCCCCCCO 21818 [1,0,0,0,0,0|3,0,0]=4
9  B10R0.71  NCCCCCCCCCN 21179 [0,1,0,0,0,0|2,0,0]=3
10  B10R0.71  NCCNCCCNCCN 21657 [0,1,0,0,0,0|0,0,0]=1
11  B10R1.17  NCCCC1CCCCC1 20125 [0,0,0,1,0,0|3,0,0]=4
12  B10R1.85  NCCC1CCCCCC1 18716 [0,0,0,1,0,0|3,0,0]=4
13  B7R0.1  BrCCCCCCBr 26744 [2,0,0,0,0,0|2,0,0]=4
14  B7R0.1  CCCCCCCO 30761 [2,0,0,0,0,0|2,0,0]=4
15  B7R0.1  NCCCCCCN 07374 [2,0,0,0,0,0|0,0,0]=2
16  B7R0.1  NCCCCCCO 14317 [2,0,0,0,0,0|1,0,0]=3
17  B7R0.1  NCCSSCCN 05024 [2,0,0,0,0,0|2,0,0]=4
18  B9R0.5  CCOC(=O)CNCCN 09645 [1,1,0,0,0,0|1,0,1]=4
19  B11R0.3  CCCCCCCCNCCN 20838 [0,2,0,0,0,0|2,0,0]=4
20  B9R1.8  ClCCN1CCCCC1 30850 [1,0,0,1,0,0|2,0,0]=4
21  B9R1.8  ClCCN1CCOCC1 30869 [1,0,0,1,0,0|2,0,0]=4
22  B9R1.8  NCCC1CCCCC1 20017 [1,0,0,1,0,0|2,0,0]=4
23  B9R1.8  NCCC1CCCCO1 17957 [1,0,0,1,0,0|2,0,0]=4
24  B9R1.8  NCCC1CCOCC1 17241 [1,0,0,1,0,0|2,0,0]=4
25  B9R1.8  NCCN1CCOCC1 32062 [1,0,0,1,0,0|1,0,0]=3
26  B9R1.8  OCCN1CCCCC1 27966 [1,0,0,1,0,0|2,0,0]=4
27  B9R1.8  OCCN1CCNCC1 26973 [1,0,0,1,0,0|1,0,0]=3
28  B11R1.203  NCCCN1CCCCCC1 19714 [0,1,0,1,0,0|2,0,0]=4