0  B9R0.64  C#C[C@@](C)(O)CCC(C)C F17036 [0,0,0,0,1,0|0,0,1]=2
1  B8R0.6  C#C[C@@H](O)CCCCC 51060 [2,0,0,0,0,0|0,0,2]=4
2  B8R0.6  C#C[C@@H](O)CCCCC T72294 [2,0,0,0,0,0|0,0,2]=4