0  B8R0.23  C=C(CC(C)C)C(=O)O W18790 [0,0,0,0,0,0|2,0,0]=2
1  B9R0.39  CC(C)C[C@@H](CN)C(=O)O 31361 [0,1,0,0,0,0|2,0,1]=4
2  B9R0.39  CC(C)C[C@@H](CN)C(=O)O 31362 [0,1,0,0,0,0|2,0,1]=4
3  B9R0.39  CC(C)C[C@@H](CN)C(=O)O 32003 [0,1,0,0,0,0|2,0,1]=4
4  B9R0.39  CC(C)C[C@@H](CN)C(=O)O F15243 [0,1,0,0,0,0|2,0,1]=4
5  B9R0.42  C=C(C)C(=O)O[C@@H](C)CO D93504 [0,1,0,0,0,0|2,0,0]=3
6  B9R0.57  CC(C)(F)C[C@H](N)C(=O)O 81510 [0,1,0,0,0,0|2,0,1]=4
7  B9R0.57  CN(C)C(=O)CC(C)(C)N D96351 [0,1,0,0,0,0|2,0,0]=3
8  B9R0.79  CC(C)[C@H](O)[C@H](N)C(=O)O 25814 [0,1,0,0,0,0|2,0,1]=4
9  B9R1.69  CN1C[C@@H](N)CCC1=O AT26867 [0,0,0,1,0,0|3,0,0]=4
10  B9R1.112  O=C(O)[C@@H](O)CC1CC1 69647 [0,0,0,1,0,0|1,0,2]=4
11  B9R1.112  O=C(O)[C@@H](O)CC1CC1 AT26814 [0,0,0,1,0,0|1,0,2]=4
12  B9R0.53  CC(C)C[C@H](O)CC(=O)O D96477 [0,0,0,0,0,1|1,0,2]=4
13  B8R0.19  CC[C@H](N)CC(=O)OC Y11154 [1,1,0,0,0,0|2,0,0]=4
14  B8R1.4  C[C@H]1CC(=O)CCO1 P13205 [1,0,0,1,0,0|1,0,1]=4
15  B8R1.4  C[C@H]1CCCC(=O)N1 D85681 [1,0,0,1,0,0|1,0,1]=4
16  B8R1.3  C[C@H]1CCC(=O)CN1 P20466 [1,0,0,1,0,0|1,0,1]=4
17  B8R1.3  C[C@H]1CCC(=O)CN1 P20467 [1,0,0,1,0,0|1,0,1]=4
18  B8R1.77  CC1(C)C[C@@H]1C(N)=O P18982 [1,0,0,1,0,0|1,0,1]=4