0  B7R0.9  C[C@H](O)CC(C)(C)O DB03564 [0,0,0,0,0,0|0,1,0]=1
1  B7R0.9  C[N+](C)(C)CC(=O)O DB04455 [0,0,0,0,0,0|3,0,1]=4
2  B6R0.2  CC(C)CC(=O)O DB03750 [1,0,0,0,0,0|1,0,1]=3
3  B6R0.2  CC(C)C[C@@H](C)N DB02107 [1,0,0,0,0,0|1,0,0]=2
4  B6R0.2  CN(C)CC(=O)O DB02083 [1,0,0,0,0,0|2,0,1]=4
5  B6R0.5  C[N+](C)(C)CCO DB00122 [1,0,0,0,0,0|2,0,0]=3
6  B6R0.5  C[N+](C)(C)CCS DB01803 [1,0,0,0,0,0|2,1,0]=4
7  B6R0.5  C[N+](C)([11CH3])CCO DB09277 [1,0,0,0,0,0|2,0,0]=3
8  B6R0.5  C[N+](C)([11CH3])CCO DB09563 [1,0,0,0,0,0|2,0,0]=3
9  B8R0.27  [C@H](N)(C(=O)O)C(C)(C)S DB00859 [0,1,0,0,0,0|1,0,1]=3
10  B8R0.34  [C@@H](C)(O)C[C@](C)(O)CO DB01881 [0,1,0,0,0,0|0,1,0]=2
11  B6R0.7  CC(C)(N)C(=O)O DB02952 [0,0,0,0,1,0|2,0,1]=4
12  B5R0.1  CC(=O)CCO DB04094 [2,0,0,0,0,0|0,1,1]=4
13  B5R0.1  CC(C)CCO DB02296 [2,0,0,0,0,0|0,0,0]=2
14  B5R0.1  CC(O)CCO DB14110 [2,0,0,0,0,0|0,1,0]=3
15  B5R0.1  CCCC(=O)O DB03568 [2,0,0,0,0,0|1,0,1]=4
16  B5R0.1  CN(C)CCO DB13352 [2,0,0,0,0,0|1,0,0]=3
17  B5R0.1  C[C@H](O)CCO DB02202 [2,0,0,0,0,0|0,1,0]=3
18  B5R0.4  CC[Si](C)(C)C DB02265 [2,0,0,0,0,0|1,1,0]=4
19  B7R0.16  CC(C)[C@H](N)C(=O)O DB00161 [1,1,0,0,0,0|1,0,1]=4
20  B7R0.13  [C@H](C)(O)[C@@](C)(O)CN DB02847 [0,1,0,0,1,0|0,1,0]=3
21  B5R0.5  CC(=O)[C@@H](C)O DB04364 [1,0,0,0,1,0|0,1,1]=4
22  B5R0.5  CC(=O)[C@H](C)O DB02788 [1,0,0,0,1,0|0,1,1]=4
23  B5R0.5  CC(C)C(=O)O DB02531 [1,0,0,0,1,0|1,0,1]=4
24  B5R0.5  C[C@H](O)[C@@H](C)O DB02418 [1,0,0,0,1,0|0,1,0]=3
25  B7R0.6  CC(C)CCC(=O)O DB03993 [1,0,0,0,0,1|1,0,1]=4