0  B5R0.1  CC(CCO)O 719 [0,0,0,0,0,0|2,0,0]=2
1  B4R0.1  CC(=O)OC 753 [1,0,0,0,0,0|2,0,1]=4
2  B4R0.1  CN(C)C=S 110 [1,0,0,0,0,0|2,0,1]=4
3  B4R0.2  CCOC=O 720 [1,0,0,0,0,0|2,0,1]=4
4  B6R0.4  CCCOC(=O)C 762 [0,1,0,0,0,0|2,0,1]=4
5  B6R0.5  C(CS(=O)(=O)O)N 747 [0,1,0,0,0,0|3,0,0]=4
6  B6R0.5  C[N+](C)(C)CCO 1302 [0,1,0,0,0,0|2,0,0]=3
7  B3R0.2  CC(C)O 275 [2,0,0,0,0,0|1,0,0]=3
8  B3R0.2  CS(=O)C 188 [2,0,0,0,0,0|2,0,0]=4
9  B5R0.3  CCC(C=C)O 776 [1,1,0,0,0,0|1,0,1]=4
10  B5R0.2  CCCOC=O 763 [1,1,0,0,0,0|1,0,1]=4
11  B7R0.2  CCC(=O)OC(C)C 731 [0,2,0,0,0,0|1,0,1]=4
12  B7R0.3  CCCCC(CC)O 730 [0,2,0,0,0,0|2,0,0]=4
13  B7R0.16  CC(C)[C@@H](C(=O)O)N 1154 [0,2,0,0,0,0|1,0,1]=4
14  B7R0.4  CCCCCC(C)O 729 [0,2,0,0,0,0|2,0,0]=4
15  B7R0.6  CC(C)COC(=O)C 721 [0,2,0,0,0,0|1,0,1]=4