0  B9R0.56  CC(=O)OCC[N+](C)(C)C 30313 [0,0,0,0,0,0|0,0,0]=0
1  B9R0.56  C[N+](C)(C)CCCC(=O)O 25116 [0,0,0,0,0,0|2,0,0]=2
2  B8R0.21  C[Si](C)(C)CCOCCl 7073 [1,0,0,0,0,0|2,0,1]=4
3  B8R0.28  CC(=O)CCC=C(C)C 35423 [1,0,0,0,0,0|2,0,1]=4
4  B8R0.28  CC(C)CCCC(=O)O 36049 [1,0,0,0,0,0|3,0,0]=4
5  B8R0.28  CN(C)CCCC(=O)O 35953 [1,0,0,0,0,0|2,0,1]=4
6  B10R0.31  C[N+](C)(C)CC(O)CC(=O)[O-] 5901 [0,1,0,0,0,0|2,0,0]=3
7  B10R0.31  C[N+](C)(C)C[C@@H](O)CC(=O)[O-] 6011 [0,1,0,0,0,0|2,0,0]=3
8  B10R0.31  C[N+](C)(C)C[C@H](O)CC(=O)[O-] 20726 [0,1,0,0,0,0|2,0,0]=3
9  B10R0.31  C[N+](C)(C)C[C@H](O)CC(=O)[O-] 20727 [0,1,0,0,0,0|2,0,0]=3
10  B8R0.29  CC(=O)C#C[Si](C)(C)C 16060 [0,0,0,0,1,0|1,0,2]=4
11  B8R0.29  CC(C)(C)NCC(=O)O 32009 [0,0,0,0,1,0|3,0,0]=4
12  B8R0.29  CC(C)(C)NCC(=O)O 32035 [0,0,0,0,1,0|3,0,0]=4
13  B7R0.4  COCCOC(=O)Cl 12774 [2,0,0,0,0,0|2,0,0]=4
14  B9R0.10  CC(C)(C)[C@@H](N)CC(=O)O 30136 [0,1,0,0,1,0|2,0,0]=4
15  B9R0.57  CC(C)(C)CC(N)C(=O)O 30143 [0,1,0,0,1,0|2,0,0]=4
16  B9R0.57  CC(C)(C)C[C@H](N)C(=O)O 30263 [0,1,0,0,1,0|2,0,0]=4
17  B9R1.66  CC1(C)CCCC(=O)C1 27316 [1,0,0,1,0,0|2,0,0]=4
18  B9R1.35  CC(C)[C@@H]1COC(=O)N1 8176 [1,0,0,1,0,0|2,0,0]=4
19  B9R1.35  CC(C)[C@H]1COC(=O)N1 2450 [1,0,0,1,0,0|2,0,0]=4
20  B9R1.49  CN1CCCC(=O)CC1 2442 [1,0,0,1,0,0|1,0,1]=4
21  B9R1.49  CN1CCCC(=O)CC1 2443 [1,0,0,1,0,0|1,0,1]=4
22  B9R1.10  CC1(C)CCC(=O)CC1 30356 [0,0,0,1,1,0|1,0,0]=3
23  B11R1.19  CC(C)(C)C1CCC(=O)CC1 26440 [0,1,0,1,0,0|2,0,0]=4
24  B7R0.6  C=C(C)CCC(C)=O 25282 [1,0,0,0,1,0|1,0,1]=4
25  B7R0.6  CC(C)CCC(=O)Cl 20015 [1,0,0,0,1,0|2,0,0]=4
26  B7R0.6  C[S+](C)CCC(=O)O 35248 [1,0,0,0,1,0|2,0,0]=4
27  B7R0.9  CC(=O)CC(C)(C)N 19406 [0,0,0,0,2,0|2,0,0]=4
28  B7R0.9  CC(C)(C)CC(=O)Cl 2093 [0,0,0,0,2,0|2,0,0]=4
29  B7R0.9  CC(O)C[N+](C)(C)C 44871 [0,0,0,0,2,0|0,0,2]=4