0  B6R0.1  CCCC(=O)CC NPA012016 [0,1,0,0,0,0|2,0,1]=4
1  B6R0.3  CC(CO)C(=O)O NPA011485 [0,1,0,0,0,0|2,0,1]=4
2  B6R1.8  C1C(C1=O)CO NPA020911 [0,0,0,1,0,0|2,0,1]=4
3  B5R0.1  C=C(C)CCO NPA031414 [1,1,0,0,0,0|0,0,2]=4
4  B5R0.1  CC(=CCO)C NPA031413 [1,1,0,0,0,0|0,0,2]=4
5  B5R0.4  CC(C)(CS)S NPA010607 [1,1,0,0,0,0|1,0,0]=3
6  B5R0.5  CC(C(=O)C)O NPA007460 [1,1,0,0,0,0|1,0,1]=4
7  B5R0.5  CC(C(C)O)O NPA007728 [1,1,0,0,0,0|1,0,0]=3
8  B7R0.3  CCC(C)CCCO NPA009905 [0,2,0,0,0,0|1,0,0]=3
9  B7R0.3  CCCCC(C)C=C NPA006261 [0,2,0,0,0,0|1,0,1]=4
10  B7R0.3  CC[C@@H](C#CCO)O NPA000240 [0,2,0,0,0,0|2,0,0]=4
11  B7R0.10  C([C@H]([C@H](CO)O)O)O NPA017638 [0,2,0,0,0,0|2,0,0]=4
12  B7R0.10  CCC(C)C(=O)OC NPA003841 [0,2,0,0,0,0|1,0,1]=4