0  B9R0.2  CCCCCCCC(=O)O DB04519 [0,0,0,0,0,0|0,0,2]=2
1  B8R0.7  CCCCCCC(=O)O DB02938 [1,0,0,0,0,0|0,0,1]=2
2  B8R0.7  CCCCCCC(N)=O DB02641 [1,0,0,0,0,0|1,0,1]=3
3  B10R0.75  CNCCCC[C@H](N)C(=O)O DB01714 [0,1,0,0,0,0|1,0,2]=4
4  B10R0.75  [C@H](O)(CCCCCC)C(=O)O DB07907 [0,1,0,0,0,0|0,0,2]=3
5  B7R0.4  O=C(O)CCCCO DB04781 [2,0,0,0,0,0|1,0,0]=3
6  B7R0.4  [NH3+]CCCCC(=O)O DB02068 [2,0,0,0,0,0|1,0,0]=3
7  B9R0.5  CCCCC[C@H](C)NC=O DB03061 [1,1,0,0,0,0|1,0,1]=4
8  B9R0.45  CCCCCCCNC=O DB04105 [1,1,0,0,0,0|0,0,2]=4
9  B9R0.47  NCCCC[C@@H](N)C(=O)O DB03252 [1,1,0,0,0,0|1,0,1]=4
10  B9R0.47  N[C@@H](CCCCO)C(=O)O DB03412 [1,1,0,0,0,0|1,0,1]=4
11  B9R0.47  [C@@H](N)(CCCCO)C(=O)O DB02233 [1,1,0,0,0,0|1,0,1]=4
12  B11R0.40  CCCCCCCCC(=O)OC DB01631 [0,2,0,0,0,0|0,0,2]=4
13  B11R0.42  NCCCCCC[C@H](N)C(=O)O DB04486 [0,2,0,0,0,0|0,0,2]=4
14  B11R0.111  N[C@H](CO)CCCCNC(=O)O DB02437 [0,2,0,0,0,0|1,0,1]=4
15  B11R0.148  CCCCCCCCCC(=O)O DB03600 [0,2,0,0,0,0|0,0,2]=4
16  B11R0.176  [C@H](S)(CCS)CCCCC(=O)O DB03760 [0,2,0,0,0,0|0,0,2]=4
17  B11R0.165  CCCCCC(=O)CP(=O)(O)O DB07912 [0,2,0,0,0,0|1,0,1]=4
18  B9R1.8  O=CNC1CCCCC1 DB03559 [1,0,0,1,0,0|1,0,1]=4
19  B9R1.6  O=C(O)C1=CCCNC1 DB08848 [1,0,0,1,0,0|1,0,0]=3
20  B11R1.91  O=C(O)CCC1CCCCC1 DB02242 [0,1,0,1,0,0|0,0,2]=4