0  B10R1.118  C[C@H]1OC(=O)[C@@H](C)OC1=O M21221 [0,0,0,1,0,0|2,0,1]=4
1  B10R0.2  CCOC(=O)CC(=O)OCC M20230 [0,0,0,0,0,1|2,0,1]=4
2  B7R0.3  COC(=O)CCCN M27562 [2,0,0,0,0,0|1,0,0]=3
3  B7R0.5  C=CCC(C)C(=O)O M21378 [2,0,0,0,0,0|0,0,2]=4
4  B7R0.5  CCCC(C)C(=O)O M20371 [2,0,0,0,0,0|0,0,0]=2
5  B7R0.5  CCCC(N)C(=O)O M26165 [2,0,0,0,0,0|1,0,0]=3
6  B7R0.5  CCC[C@H](N)C(=O)O M19655 [2,0,0,0,0,0|1,0,0]=3
7  B7R0.5  CCOC(=O)C(C)=O M21386 [2,0,0,0,0,0|1,0,1]=4
8  B7R0.5  CC\C=C(/C)C(=O)O M21395 [2,0,0,0,0,0|0,0,2]=4
9  B7R0.5  CNC[C@H](N)C(=O)O M23698 [2,0,0,0,0,0|2,0,0]=4
10  B7R0.5  CSC[C@H](N)C(=O)O M21402 [2,0,0,0,0,0|2,0,0]=4
11  B7R0.5  C[Se]C[C@H](N)C(=O)O M28563 [2,0,0,0,0,0|2,0,0]=4
12  B7R0.5  NC(CCS)C(=O)O M19720 [2,0,0,0,0,0|2,0,0]=4
13  B7R0.5  NCC[C@H](N)C(=O)O M20932 [2,0,0,0,0,0|2,0,0]=4
14  B7R0.5  N[C@@H](CCO)C(=O)O M19657 [2,0,0,0,0,0|2,0,0]=4
15  B7R0.10  COC(=O)[C@@H](N)CS M12873 [2,0,0,0,0,0|2,0,0]=4
16  B9R0.18  O=C(CCCO)NCCO M27983 [1,1,0,0,0,0|2,0,0]=4
17  B9R0.23  COC(=O)C(O)CC(C)C M28725 [1,1,0,0,0,0|1,0,0]=3
18  B9R1.8  CCCC1CCCCN1 M23697 [1,0,0,1,0,0|2,0,0]=4
19  B11R1.16  CCOC(=O)C1=CCCNC1 M18149 [0,1,0,1,0,0|0,0,2]=4