0  B7R0.4  COCCCC(=O)O 1781 [2,0,0,0,0,0|2,0,0]=4
1  B9R1.35  O=C1CC[C@H](C(=O)O)O1 2037 [1,0,0,1,0,0|1,0,0]=3
2  B9R0.4  NCCC[C@@H](N)CC(=O)O 4677 [1,0,0,0,0,1|0,0,1]=3