0  B10R0.31  CC(=O)OC(C)C[N+](C)(C)C 4156-5-17 [0,0,0,0,0,0|0,0,0]=0
1  B10R0.31  CC(CC(=O)O)CC(C)(C)C 2121-1-0Q [0,0,0,0,0,0|3,0,0]=3
2  B10R0.31  C[N+](C)(C)C[C@H](N)CC(=O)[O-] 4157-1-29 [0,0,0,0,0,0|3,0,0]=3
3  B9R0.56  CC(=O)SCC[N+](C)(C)C 8166-9-01 [1,0,0,0,0,0|0,1,0]=2
4  B9R0.56  CC(=O)SCC[N+](C)(C)C 8166-H-01 [1,0,0,0,0,0|0,1,0]=2
5  B9R0.57  CC(C)(C)CC(N)C(=O)O 4157-1-0F [0,0,0,0,1,0|3,0,0]=4
6  B9R0.57  CC(C)(C)C[C@@H](N)C(=O)O 4157-1-R8 [0,0,0,0,1,0|3,0,0]=4
7  B8R0.28  CC(=O)CCCC(C)C 2117-1-0E [2,0,0,0,0,0|2,0,0]=4
8  B8R0.28  CC(=O)CCCN(C)C 4156-1-51 [2,0,0,0,0,0|1,0,1]=4
9  B8R0.28  CC(=O)OCC=C(C)C 2323-1-0B [2,0,0,0,0,0|1,0,1]=4
10  B8R0.28  CC(=O)OCCN(C)C 4132-1-05 [2,0,0,0,0,0|0,0,1]=3
11  B8R0.28  CC(C)CCOC(=O)Cl 2116-5-27 [2,0,0,0,0,0|2,0,0]=4
12  B10R0.48  CC(C)(C)CC(C)(C)NC=O 4148-1-1E [1,1,0,0,0,0|2,0,0]=4
13  B10R0.163  CC(=O)C(C)(C)C[N+](C)(C)C 4133-9-01 [0,1,0,0,1,0|0,0,0]=2
14  B10R1.329  CC1CC(=O)CC(C)(C)C1 2217-1-0S [1,0,0,1,0,0|2,0,0]=4
15  B10R1.147  CC1=C(C)C[N+](C)(C)CC1 3H33-H-05 [0,0,0,1,1,0|1,0,1]=4
16  B10R1.147  CC1C[N+](C)(C)CC[C@H]1O 4H56-H-15 [0,0,0,1,1,0|0,0,2]=4
17  B8R0.29  CC(=O)CSC(C)(C)C 6166-1-03 [1,0,0,0,1,0|2,0,0]=4
18  B8R0.29  CC(=O)OC[Si](C)(C)C 6180-1-04 [1,0,0,0,1,0|1,0,0]=3
19  B8R0.29  CC(=O)ONC(C)(C)C 4156-5-0H [1,0,0,0,1,0|2,0,0]=4
20  B8R0.29  CC(C)(C)CCC(=O)O 2121-1-36 [1,0,0,0,1,0|2,0,0]=4
21  B8R0.27  CC(C(=O)O)C(C)(C)C 2121-1-44 [0,0,0,0,2,0|2,0,0]=4
22  B10R0.96  CC(=O)OCC(C)OC(C)=O 2123-1-83 [1,0,0,0,0,1|2,0,0]=4
23  B10R0.15  CC(=O)SCCC[N+](C)(C)C 8166-H-02 [1,0,0,0,0,1|0,1,0]=3