0  B9R0.45  CCCCCCCCCO DB03143 [0,0,0,0,0,0|0,0,0]=0
1  B9R0.45  CCCCCCCNC=O DB04105 [0,0,0,0,0,0|1,0,2]=3
2  B9R0.45  CCOCCOCCOC DB03508 [0,0,0,0,0,0|4,0,0]=4
3  B9R0.45  NCCCCCCCCN DB04333 [0,0,0,0,0,0|2,0,0]=2
4  B9R0.45  NCCCCNCCCN DB03566 [0,0,0,0,0,0|3,0,0]=3
5  B9R0.45  OCCOCCOCCO DB02327 [0,0,0,0,0,0|3,0,0]=3
6  B8R0.4  COCCOCCOC DB02935 [1,0,0,0,0,0|3,0,0]=4
7  B10R0.1  [C@@H](C)(CCCCCC)\N=C\O DB02131 [0,1,0,0,0,0|1,0,1]=3
8  B10R0.71  CCCCCCCCCCS DB07611 [0,1,0,0,0,0|0,1,0]=2
9  B10R0.71  CCOCCOCCOCC DB08357 [0,1,0,0,0,0|3,0,0]=4
10  B7R0.1  NCCCCCCN DB03260 [2,0,0,0,0,0|2,0,0]=4
11  B7R0.1  OCCCCCCBr DB04637 [2,0,0,0,0,0|1,0,0]=3
12  B7R0.1  OCCCCCCO DB02210 [2,0,0,0,0,0|1,0,0]=3
13  B9R0.2  CCCCCCCC(=O)O DB04519 [1,1,0,0,0,0|0,0,1]=3
14  B9R0.46  NCCCSC[C@H](N)CO DB04648 [1,1,0,0,0,0|2,0,0]=4
15  B11R0.176  [C@H](S)(CCS)CCCCC(=O)O DB03760 [0,2,0,0,0,0|1,0,1]=4
16  B11R0.40  CCCCCCCCC(=O)OC DB01631 [0,2,0,0,0,0|0,0,1]=3
17  B11R0.42  NCCCCCC[C@H](N)C(=O)O DB04486 [0,2,0,0,0,0|1,0,1]=4
18  B11R0.148  CCCCCCCCCC(=O)O DB03600 [0,2,0,0,0,0|0,0,0]=2
19  B11R0.148  CCCCCCCCCC(C)=O DB08688 [0,2,0,0,0,0|0,0,1]=3
20  B11R0.148  NCCCCCCCNC(N)N DB03639 [0,2,0,0,0,0|2,0,0]=4
21  B11R0.3  CCCCCCCCCCC=O DB04093 [0,2,0,0,0,0|0,0,1]=3
22  B11R0.3  COCCOCCOCCOC DB02078 [0,2,0,0,0,0|2,0,0]=4
23  B11R0.3  OCCCCCCCCNCO DB07897 [0,2,0,0,0,0|0,0,0]=2
24  B11R1.91  O=C(O)CCC1CCCCC1 DB02242 [0,1,0,1,0,0|0,0,1]=3
25  B11R1.28  O=CCCCC1CCNCC1 DB04654 [0,1,0,1,0,0|0,0,2]=4
26  B11R1.40  N[C@H](CO)CC1CCCCC1 DB04387 [0,1,0,1,0,0|0,0,0]=2