0  B7R0.16  CC(C)[C@@H](O)C(=O)O 4139 [0,0,0,0,0,0|0,0,2]=2
1  B6R0.3  C#CC(=O)C(C)C 1200 [1,0,0,0,0,0|1,0,1]=3
2  B6R0.3  CC[C@H](O)C(=O)O 3680 [1,0,0,0,0,0|0,0,2]=3
3  B6R0.3  O=C(O)[C@@H](O)CO 3697 [1,0,0,0,0,0|1,0,2]=4
4  B8R0.2  CC[C@H](C)[C@H](O)C(=O)O 4121 [0,1,0,0,0,0|0,0,2]=3
5  B8R0.27  CC(C)(C)[C@@H](O)C(=O)O 4582 [0,1,0,0,0,0|0,0,2]=3
6  B5R0.1  O=C(O)\C=N\O 1812 [2,0,0,0,0,0|2,0,0]=4
7  B7R0.2  CC[C@@H](C)CC(=O)O 911 [1,1,0,0,0,0|0,0,1]=3
8  B7R0.2  CC[C@H](C)CC(=O)O 916 [1,1,0,0,0,0|0,0,1]=3
9  B7R0.10  C=C(CBr)C(=O)OC 1082 [1,1,0,0,0,0|2,0,0]=4