0  B9R1.35  O=C1CC[C@H](C(=O)O)O1 2037 [0,0,0,1,0,0|3,0,0]=4
1  B6R0.3  CC[C@H](O)C(=O)O 3680 [2,0,0,0,0,0|1,0,1]=4
2  B6R0.3  NC(=O)[C@H](N)CS 361 [2,0,0,0,0,0|1,1,0]=4
3  B6R0.3  O=C(O)[C@@H](O)CO 3697 [2,0,0,0,0,0|1,0,1]=4