0  B8R0.23  CC(=O)N[C@@H](C)C(=O)O T4839 [0,0,0,0,0,0|2,0,0]=2
1  B8R0.23  NC(=O)C[C@H](N)C(=O)O T2O2774 [0,0,0,0,0,0|4,0,0]=4
2  B8R0.23  N[C@@H](CC(=O)O)C(=O)O T2O2731 [0,0,0,0,0,0|4,0,0]=4
3  B8R0.23  N[C@H](CC(=O)O)C(=O)O T4885 [0,0,0,0,0,0|4,0,0]=4
4  B8R0.23  O=C(O)CC(O)C(=O)O T2S0850 [0,0,0,0,0,0|4,0,0]=4
5  B8R0.23  O=C(O)C[C@H](O)C(=O)O T4838 [0,0,0,0,0,0|4,0,0]=4
6  B7R0.6  CC(=O)NCC(=O)O T4822 [1,0,0,0,0,0|2,0,0]=3
7  B7R0.6  O=C(O)CCC(=O)O BBP02045 [1,0,0,0,0,0|3,0,0]=4
8  B7R0.6  O=C(O)CCC(=O)O T2719 [1,0,0,0,0,0|3,0,0]=4
9  B9R0.39  CC(=O)N[C@@H](CS)C(=O)O T0875 [0,1,0,0,0,0|2,0,0]=3
10  B9R0.42  COC(=O)C[C@H](O)C(=O)O BBP00069 [0,1,0,0,0,0|3,0,0]=4
11  B9R1.35  O=C1CC[C@@H](C(=O)O)N1 T0507 [0,0,0,1,0,0|2,0,0]=3
12  B9R1.35  O=C1CC[C@H](C(=O)O)N1 T4814 [0,0,0,1,0,0|2,0,0]=3
13  B7R0.16  CC(C(=O)O)C(=O)O T4817 [0,0,0,0,1,0|2,0,0]=3
14  B9R0.7  CC(=O)OC[C@H](N)C(=O)O T4722 [0,0,0,0,0,1|2,0,0]=3
15  B9R0.53  CC(CC(=O)O)CC(=O)O T4766 [0,0,0,0,0,1|3,0,0]=4
16  B6R0.2  CC(C)CC(N)=O T0361 [2,0,0,0,0,0|2,0,0]=4
17  B6R0.3  C\C=C(\C)C(=O)O T3328 [2,0,0,0,0,0|1,0,1]=4
18  B8R0.9  COC(=O)CCC(C)=O BBP00556 [1,1,0,0,0,0|1,0,0]=3
19  B8R0.9  NCC(=O)CCC(=O)O T1662 [1,1,0,0,0,0|2,0,0]=4
20  B8R1.1  COC1CCC(=O)N1 BBP00214 [1,0,0,1,0,0|2,0,0]=4
21  B10R1.14  COC(=O)[C@@H]1CCC(=O)N1 BBP03108 [0,1,0,1,0,0|1,0,0]=3