0  B4R0.1  CC(=O)NO HMDB0014691 [1,0,0,0,0,0|2,0,0]=3
1  B4R0.1  CC(O)=NN HMDB0060428 [1,0,0,0,0,0|2,0,1]=4
2  B4R0.1  NC(=O)NO HMDB0015140 [1,0,0,0,0,0|3,0,0]=4
3  B4R0.2  C/C=C\C=O HMDB0034233 [1,0,0,0,0,0|1,0,1]=3
4  B6R0.2  OC(=O)CC(O)=O HMDB0000691 [0,1,0,0,0,0|3,0,0]=4
5  B6R0.4  CCCOC(C)=O HMDB0034237 [0,1,0,0,0,0|0,0,2]=3
6  B3R0.1  C(=O)CCl HMDB0013860 [2,0,0,0,0,0|1,0,1]=4
7  B3R0.1  C=CC=O HMDB0041822 [2,0,0,0,0,0|0,0,0]=2
8  B3R0.2  CC(O)=O HMDB0000042 [2,0,0,0,0,0|0,0,0]=2
9  B3R0.2  CS(C)=O HMDB0002151 [2,0,0,0,0,0|1,0,1]=4
10  B5R0.3  NCC(=O)O[Al] HMDB0015457 [1,1,0,0,0,0|1,0,0]=3
11  B5R0.5  OC(=O)C(O)=O HMDB0002329 [1,1,0,0,0,0|2,0,0]=4
12  B7R0.3  NCC(=O)OCCO HMDB0061148 [0,2,0,0,0,0|0,0,2]=4
13  B5R1.1  N1C=CN=C1 HMDB0001525 [1,0,0,1,0,0|2,0,0]=4
14  B7R1.4  CN1C=CNC1=S HMDB0014901 [0,1,0,1,0,0|1,1,0]=4