0  B9R0.7  C(CC(=O)[O-])[C@@H](C(=O)O)N 23689119 [0,0,0,0,0,0|1,0,2]=3
1  B8R0.23  C(C(C(=O)O)O)C(=O)O 525 [0,0,0,0,1,0|0,0,2]=3
2  B11R1.74  C1C(NC(=S)NC1=O)C(=O)O 4221067 [0,0,0,1,0,1|1,1,0]=4