0  B7R0.11  CCCC(C)(C)CC HMDB0031418 [0,0,0,0,0,0|2,0,1]=3
1  B6R0.1  CCC(C)CCO HMDB0033676 [1,0,0,0,0,0|3,0,0]=4
2  B6R0.1  CSC(C)CC=O HMDB0041491 [1,0,0,0,0,0|2,1,0]=4
3  B6R0.5  CC(C)(S)CCO HMDB0036149 [1,0,0,0,0,0|2,1,0]=4
4  B6R0.5  C[As+](C)(C)CCO HMDB0032683 [1,0,0,0,0,0|3,0,0]=4
5  B6R0.5  C[N+](C)(C)CCO HMDB0000097 [1,0,0,0,0,0|3,0,0]=4
6  B6R0.8  CC(C)(OO)OO HMDB0034260 [1,0,0,0,0,0|3,0,0]=4
7  B8R0.34  CSC(C)(C)CC(C)=O HMDB0037621 [0,1,0,0,0,0|1,1,1]=4
8  B8R1.51  CC1COC(C)(C)O1 HMDB0037266 [0,0,0,1,0,0|2,0,1]=4
9  B5R0.1  CC(C)CC=O HMDB0006478 [2,0,0,0,0,0|2,0,0]=4
10  B5R0.1  CC(C)CCN HMDB0031659 [2,0,0,0,0,0|2,0,0]=4
11  B5R0.1  CC(C)CCS HMDB0033902 [2,0,0,0,0,0|2,0,0]=4
12  B5R0.1  CC(O)CCO HMDB0031320 [2,0,0,0,0,0|2,0,0]=4
13  B5R0.1  CC(O)CCS HMDB0041475 [2,0,0,0,0,0|2,0,0]=4
14  B5R0.1  CCCC(C)O HMDB0031599 [2,0,0,0,0,0|1,0,1]=4
15  B5R0.3  CCC(C)CN HMDB0032392 [2,0,0,0,0,0|1,0,1]=4
16  B5R0.3  CCC(C)CO HMDB0031527 [2,0,0,0,0,0|2,0,0]=4
17  B5R0.3  CCC(C)CS HMDB0035418 [2,0,0,0,0,0|2,0,0]=4
18  B5R0.3  COC(C)OC HMDB0030061 [2,0,0,0,0,0|1,0,1]=4
19  B5R0.4  CC(C)(O)C=C HMDB0033854 [2,0,0,0,0,0|0,0,2]=4
20  B5R0.4  CCC(C)(C)O HMDB0033772 [2,0,0,0,0,0|0,0,1]=3
21  B7R0.9  CC(=O)CC(C)(C)O HMDB0031511 [1,1,0,0,0,0|1,0,1]=4