0  B5R0.1  CC(C)CC=O HMDB0006478 [0,0,0,0,0,0|1,1,1]=3
1  B4R0.1  CC(N)CN HMDB0013136 [1,0,0,0,0,0|2,0,1]=4
2  B4R0.1  CC(O)CO HMDB0001881 [1,0,0,0,0,0|1,1,1]=4
3  B4R0.1  CN(C)C=O HMDB0001888 [1,0,0,0,0,0|1,1,1]=4
4  B4R0.1  C\C(O)=N\N HMDB0060428 [1,0,0,0,0,0|2,0,1]=4
5  B6R0.2  CC(=O)CC(C)C HMDB0002939 [0,1,0,0,0,0|1,1,1]=4
6  B6R0.2  CC(C)CC(=O)O HMDB0000718 [0,1,0,0,0,0|1,1,1]=4
7  B3R0.2  CC(C)=O HMDB0001659 [2,0,0,0,0,0|0,1,1]=4
8  B3R0.2  CC(C)O HMDB0000863 [2,0,0,0,0,0|0,1,0]=3
9  B3R0.2  CN(C)C HMDB0000906 [2,0,0,0,0,0|1,0,1]=4
10  B5R0.5  CC(C)C(=O)O HMDB0001873 [1,1,0,0,0,0|0,1,1]=4