0  B9R0.7  C[C@H](Cl)C(=O)NCC(=O)O C41218 [0,0,0,0,0,0|1,0,2]=3
1  B8R0.9  COC(=O)CCC(=O)O M37827 [1,0,0,0,0,0|2,0,1]=4
2  B8R0.9  COC(=O)NCC(=O)O M40229 [1,0,0,0,0,0|1,0,2]=4
3  B10R1.83  CC1(C)C(=O)C[C@@H]1C(=O)O D11839 [0,0,0,1,0,0|2,0,1]=4
4  B8R0.23  CC(C)[C@@H](N)CC(=O)O A67729 [0,0,0,0,1,0|2,0,1]=4
5  B8R0.23  CC(C)[C@H](N)CC(=O)O A38977 [0,0,0,0,1,0|2,0,1]=4
6  B8R0.23  CC(C)[C@H](N)CC(=O)O A43501 [0,0,0,0,1,0|2,0,1]=4
7  B8R0.23  C[C@@H](O)[C@H](N)CC(=O)O A41340 [0,0,0,0,1,0|1,1,1]=4
8  B7R0.4  CCCOCC(=O)O P40387 [2,0,0,0,0,0|1,0,1]=4
9  B9R0.79  CC(C)[C@H](O)[C@@H](N)C(=O)O A41594 [0,1,0,0,1,0|1,0,1]=4
10  B7R0.2  CCC(=O)CC(C)=O H69646 [1,0,0,0,1,0|1,0,1]=4
11  B7R0.2  CC[C@H](C)CC(=O)O M41552 [1,0,0,0,1,0|1,0,1]=4
12  B7R0.2  CC[C@H](N)CC(=O)O A69512 [1,0,0,0,1,0|1,0,1]=4
13  B7R0.2  COC(=O)CC(=O)O M37882 [1,0,0,0,1,0|1,0,1]=4
14  B7R0.2  NC[C@@H](O)CC(=O)O A32052 [1,0,0,0,1,0|1,0,1]=4
15  B7R0.2  NC[C@H](O)CC(=O)O A67723 [1,0,0,0,1,0|1,0,1]=4
16  B7R0.16  CC(C)[C@@H](O)C(=O)O H64151 [0,0,0,0,2,0|1,0,1]=4
17  B7R0.16  CC(C)[C@H](O)C(=O)O H40392 [0,0,0,0,2,0|1,0,1]=4