0  B9R0.56  CC(=O)OCC[N+](C)(C)C T1221 [0,0,0,0,0,0|0,0,0]=0
1  B9R0.56  CC(=O)OCC[N+](C)(C)C T20344 [0,0,0,0,0,0|0,0,0]=0
2  B9R0.56  CC(=O)OCC[N+](C)(C)C T20522 [0,0,0,0,0,0|0,0,0]=0
3  B9R0.56  CC(=O)OCC[N+](C)(C)C T6751 [0,0,0,0,0,0|0,0,0]=0
4  B9R0.56  C[N+](C)(C)CCCC(O)=O T4702 [0,0,0,0,0,0|2,0,0]=2
5  B9R0.56  C[N+](C)(C)NCCC([O-])=O T3268 [0,0,0,0,0,0|3,0,0]=3
6  B8R0.28  CC(=O)CC/C=C(/C)C TN6832 [1,0,0,0,0,0|2,0,1]=4
7  B10R0.31  CC(C[N+](C)(C)C)OC(C)=O T1682 [0,1,0,0,0,0|0,0,0]=1
8  B10R0.31  CC(C[N+](C)(C)C)OC(N)=O T3126 [0,1,0,0,0,0|1,0,0]=2
9  B10R0.31  C[N+](C)(C)CC(O)CC(=O)[O-] T0743 [0,1,0,0,0,0|2,0,0]=3
10  B10R0.31  C[N+](C)(C)CC(O)CC([O-])=O T6475 [0,1,0,0,0,0|2,0,0]=3
11  B10R0.31  C[N+](C)(C)C[C@@H](O)CC(O)=O T2203 [0,1,0,0,0,0|2,0,0]=3
12  B10R0.31  C[N+](C)(C)C[C@H](O)CC(=O)[O-] T0846 [0,1,0,0,0,0|2,0,0]=3
13  B10R0.31  C[N+](C)(C)C[C@H](O)CC(O)=O T20123 [0,1,0,0,0,0|2,0,0]=3
14  B10R0.31  C[N+](C)(C)C[C@H](O)CC([O-])=O T20193 [0,1,0,0,0,0|2,0,0]=3
15  B10R0.113  C[N+](C)(C)CCOP(O)(O)=O T6105 [0,1,0,0,0,0|2,0,0]=3
16  B10R0.113  C[N+](C)(C)CCOP([O-])([O-])=O T4713 [0,1,0,0,0,0|2,0,0]=3
17  B8R0.29  CC(C)(O)CCC([O-])=O T29058 [0,0,0,0,1,0|3,0,0]=4
18  B10R0.15  C[N+](C)(C)CCCCC([O-])=O T19274 [0,0,0,0,0,1|2,0,0]=3
19  B9R0.57  CC(C)(C)C[C@H](N)C(O)=O T31907 [0,1,0,0,1,0|2,0,0]=4
20  B11R0.180  CCCC(=O)OCC[N+](C)(C)C T30640 [0,2,0,0,0,0|0,0,0]=2
21  B9R1.66  CC1(O)CCOC(=O)C1 T1353 [1,0,0,1,0,0|2,0,0]=4
22  B7R0.6  CC(C)CCC(O)=O T19138 [1,0,0,0,1,0|2,0,0]=4
23  B7R0.9  CC(=O)CC(C)(C)N TMA2536 [0,0,0,0,2,0|2,0,0]=4
24  B7R0.9  C[N+](C)(C)CC(O)=O T0019 [0,0,0,0,2,0|1,0,0]=3
25  B7R0.9  C[N+](C)(C)CC([O-])=O T3243 [0,0,0,0,2,0|1,0,0]=3