0  B9R0.35  CCCC(O)C(=O)OCC YMDB01403 [0,0,0,0,0,0|1,0,0]=1
1  B8R0.1  CCCCC(=O)OCC YMDB01342 [1,0,0,0,0,0|0,0,0]=1
2  B8R0.1  CCCOC(=O)CCC YMDB01397 [1,0,0,0,0,0|2,0,0]=3
3  B8R0.1  CCOC(=O)CCCO YMDB01419 [1,0,0,0,0,0|1,0,0]=2
4  B8R0.3  CCOC(=O)C(C)CC YMDB01353 [1,0,0,0,0,0|0,0,0]=1
5  B10R0.19  CCOC(=O)C(N)CCSC YMDB01686 [0,1,0,0,0,0|1,0,0]=2
6  B10R0.2  CCCC(O)CC(=O)OCC YMDB01356 [0,0,0,0,0,1|1,0,0]=2
7  B10R0.2  CCOC(=O)CC(=O)OCC YMDB01670 [0,0,0,0,0,1|2,0,1]=4
8  B7R0.3  CCC(=O)CCSC YMDB01450 [2,0,0,0,0,0|1,0,0]=3
9  B7R0.3  COC(=O)CCSC YMDB01750 [2,0,0,0,0,0|1,0,0]=3
10  B7R0.7  CCCC(=O)OCC YMDB01385 [2,0,0,0,0,0|0,0,0]=2
11  B7R0.7  CCOC(C)OCC YMDB01369 [2,0,0,0,0,0|1,0,0]=3
12  B7R0.5  C=C(C)C(=O)OCC YMDB01685 [2,0,0,0,0,0|0,0,2]=4
13  B7R0.5  CCCC(=O)C(C)=O YMDB01708 [2,0,0,0,0,0|1,0,1]=4
14  B7R0.5  CCCC(O)C(=O)O YMDB01559 [2,0,0,0,0,0|1,0,0]=3
15  B7R0.5  CCC[C@@H](N)C(=O)O YMDB00822 [2,0,0,0,0,0|1,0,0]=3
16  B7R0.5  CCOC(=O)C(C)O YMDB01429 [2,0,0,0,0,0|1,0,0]=3
17  B7R0.5  NC(CCS)C(=O)O YMDB00371 [2,0,0,0,0,0|2,0,0]=4
18  B7R0.5  N[C@@H](CCO)C(=O)O YMDB00104 [2,0,0,0,0,0|2,0,0]=4
19  B7R0.5  N[C@@H](CCS)C(=O)O YMDB00520 [2,0,0,0,0,0|2,0,0]=4
20  B7R0.10  CCC(=O)C(O)CC YMDB00804 [2,0,0,0,0,0|1,0,0]=3
21  B9R0.5  CCC=CCC(=O)OCC YMDB01357 [1,1,0,0,0,0|0,0,1]=3
22  B9R0.5  CCCCCC(=O)OCC YMDB01381 [1,1,0,0,0,0|0,0,0]=2
23  B9R0.5  CCCCOC(=O)CCC YMDB01399 [1,1,0,0,0,0|1,0,0]=3
24  B9R0.5  CCC\C=C\C(=O)OCC YMDB01365 [1,1,0,0,0,0|0,0,1]=3
25  B9R0.48  CCOC(=O)CCC(=O)O YMDB01402 [1,1,0,0,0,0|1,0,1]=4