0  B27R3.368466399  CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](c3ccc(cc3)O)N)C(=O)O)C 19188 [0,0,0,0,0,0|0,0,0]=0
1  B26R3.529849969  CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](c3ccccc3)N)C(=O)[O-])C 14417 [1,0,0,0,0,0|0,0,1]=2
2  B27R3.368466829  CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](c3ccc(cc3)O)N)SC1)C(=O)O 20365 [0,0,1,1,0,0|0,0,2]=4