0  B9R0.2  CCCCCCCC(=O)O DB04519 [0,0,0,0,0,0|1,0,1]=2
1  B8R0.4  CCCCCCCCO DB12452 [1,0,0,0,0,0|0,0,0]=1
2  B8R0.4  COCCOCCOC DB02935 [1,0,0,0,0,0|3,0,0]=4
3  B8R0.7  CCCCCCC(=O)O DB02938 [1,0,0,0,0,0|1,0,1]=3
4  B8R0.7  CCCCCCC(N)=O DB02641 [1,0,0,0,0,0|1,0,2]=4
5  B8R0.7  NCCCCCC(=O)O DB00513 [1,0,0,0,0,0|2,0,1]=4
6  B10R0.75  CNCCCC[C@H](N)C(=O)O DB01714 [0,1,0,0,0,0|2,0,1]=4
7  B10R0.75  [C@H](O)(CCCCCC)C(=O)O DB07907 [0,1,0,0,0,0|1,0,1]=3
8  B10R0.97  CC(O)CCOCCC(C)O DB14079 [0,1,0,0,0,0|1,0,0]=2
9  B10R1.16  [C@H]1(CCCC)CC[S@](=O)C1 DB02871 [0,0,0,1,0,0|1,0,1]=3
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  B9R0.45  CCCCCCCCCO DB03143 [1,1,0,0,0,0|0,0,0]=2
14  B9R0.45  CCCCCCCNC=O DB04105 [1,1,0,0,0,0|0,0,2]=4
15  B9R0.45  CCOCCOCCOC DB03508 [1,1,0,0,0,0|2,0,0]=4
16  B9R0.45  NCCCCCCCCN DB04333 [1,1,0,0,0,0|1,0,0]=3
17  B9R0.45  NCCCCNCCCN DB03566 [1,1,0,0,0,0|2,0,0]=4
18  B9R0.45  OCCOCCOCCO DB02327 [1,1,0,0,0,0|2,0,0]=4
19  B9R0.46  CCCCCCC(C)NN DB09249 [1,1,0,0,0,0|2,0,0]=4
20  B9R0.46  NCCCSC[C@H](N)CO DB04648 [1,1,0,0,0,0|2,0,0]=4
21  B11R0.1  CCC[C@@H](C)C[C@H](N)CC(=O)O DB12105 [0,2,0,0,0,0|1,0,1]=4
22  B11R0.180  C(=O)CC(C)CCCC(C)(C)O DB14187 [0,2,0,0,0,0|1,0,1]=4
23  B11R0.40  CCCCCCCCC(=O)OC DB01631 [0,2,0,0,0,0|0,0,2]=4
24  B11R0.42  NCCCCCC[C@H](N)C(=O)O DB04486 [0,2,0,0,0,0|1,0,1]=4
25  B11R0.148  CCCCCCCCCC(=O)O DB03600 [0,2,0,0,0,0|1,0,1]=4
26  B11R0.148  CCCCCCCCCC(C)=O DB08688 [0,2,0,0,0,0|0,0,2]=4
27  B11R0.148  NCCCCCCCNC(N)N DB03639 [0,2,0,0,0,0|2,0,0]=4
28  B11R0.176  [C@H](S)(CCS)CCCCC(=O)O DB03760 [0,2,0,0,0,0|1,0,1]=4
29  B11R1.166  CC(C)[C@@H]1CC[C@@H](C)C[C@H]1O DB00825 [0,1,0,1,0,0|2,0,0]=4
30  B11R1.166  CC(C)[C@H]1CC[C@H](C)C[C@@H]1O DB11344 [0,1,0,1,0,0|2,0,0]=4
31  B11R1.91  O=C(O)CCC1CCCCC1 DB02242 [0,1,0,1,0,0|1,0,1]=4
32  B11R1.40  CNC(C)CC1CCCCC1 DB06714 [0,1,0,1,0,0|1,0,0]=3
33  B11R1.40  N[C@H](CO)CC1CCCCC1 DB04387 [0,1,0,1,0,0|1,0,0]=3
34  B11R2.432  [C@H]1(O)C[C@@H]2CC[C@H](C1)N2C DB04026 [0,0,0,2,0,0|1,0,0]=3