0  B8R0.8  N[C@H](C(O)=O)CCSC M0524 [0,0,0,0,0,0|0,0,0]=0
1  B8R0.8  O=C(O)C(N)CCSC D0444 [0,0,0,0,0,0|0,0,0]=0
2  B7R0.5  [NH3+]CCC([NH3+])C(O)=O D0154 [1,0,0,0,0,0|1,0,1]=3
3  B9R0.7  NC(CC[C@H](N)C(O)=O)=O G0041 [0,1,0,0,0,0|2,0,0]=3
4  B9R0.47  NCCCC[C@H](N)C(O)=O L0110 [0,1,0,0,0,0|1,0,0]=2
5  B9R1.5  BrC1CCCCCC1=O B0101 [0,0,0,1,0,0|3,0,0]=4
6  B9R1.35  O=C1CC[C@@H](C(O)=O)O1 O0227 [0,0,0,1,0,0|3,0,0]=4
7  B6R0.4  OC(CCCN)=O G0043 [2,0,0,0,0,0|1,0,0]=3
8  B8R0.23  O=C(O)[C@H](N)CC(O)=O A0326 [1,1,0,0,0,0|0,1,1]=4
9  B8R1.5  BrC1CCCCC1=O B0249 [1,0,0,1,0,0|2,0,0]=4
10  B8R1.7  O=C(O)[C@H]1NCCC1 P0446 [1,0,0,1,0,0|2,0,0]=4