0  B9R0.56  CC(=O)OCC[N+](C)(C)C M15250 [0,0,0,0,0,0|0,0,0]=0
1  B9R0.56  CC(=O)OCC[N+](C)(C)C M18267 [0,0,0,0,0,0|0,0,0]=0
2  B9R0.56  CC(=O)OCC[N+](C)(C)C M27252 [0,0,0,0,0,0|0,0,0]=0
3  B9R0.56  C[N+](C)(C)CCCC(=O)O M19648 [0,0,0,0,0,0|2,0,0]=2
4  B9R0.56  C[N+](C)(C)CCOC(N)=O M14811 [0,0,0,0,0,0|1,0,0]=1
5  B9R0.56  C[N+](C)(C)NCCC(=O)[O-] M15892 [0,0,0,0,0,0|3,0,0]=3
6  B9R0.56  C[N+](C)(C)NCCC(=O)[O-] M19190 [0,0,0,0,0,0|3,0,0]=3
7  B8R0.28  CC(=O)CCC=C(C)C M29386 [1,0,0,0,0,0|2,0,1]=4
8  B10R0.31  CC(=O)OC(C)C[N+](C)(C)C M15366 [0,1,0,0,0,0|0,0,0]=1
9  B10R0.31  CC(C[N+](C)(C)C)OC(N)=O M15188 [0,1,0,0,0,0|1,0,0]=2
10  B10R0.31  C[N+](C)(C)CC(O)CC(=O)O M18566 [0,1,0,0,0,0|2,0,0]=3
11  B10R0.31  C[N+](C)(C)CC(O)CC(=O)[O-] M14553 [0,1,0,0,0,0|2,0,0]=3
12  B10R0.31  C[N+](C)(C)CC(O)CC(=O)[O-] M14933 [0,1,0,0,0,0|2,0,0]=3
13  B10R0.31  C[N+](C)(C)C[C@@H](O)CC(=O)O M10022 [0,1,0,0,0,0|2,0,0]=3
14  B10R0.113  C[N+](C)(C)CCOP(=O)(O)O M20513 [0,1,0,0,0,0|2,0,0]=3
15  B10R0.113  C[N+](C)(C)CCOP(=O)([O-])[O-] M19660 [0,1,0,0,0,0|2,0,0]=3
16  B9R0.57  CC(C)(C)C[C@H](N)C(=O)O M27985 [0,1,0,0,1,0|2,0,0]=4
17  B9R1.66  CC1(O)CCOC(=O)C1 M15570 [1,0,0,1,0,0|2,0,0]=4
18  B7R0.6  CC(C)CCC(=O)O M27056 [1,0,0,0,1,0|2,0,0]=4
19  B7R0.9  C[N+](C)(C)CC(=O)O M15185 [0,0,0,0,2,0|1,0,0]=3
20  B7R0.9  C[N+](C)(C)CC(=O)[O-] M10307 [0,0,0,0,2,0|1,0,0]=3