0  B22R3.671514084  C12CC(=O)N1C(C(S2(=O)=O)(C)CN3C=CN=N3)C(=O)O MCULE-9859384324 [0,0,0,0,0,0|0,0,0]=0
1  B22R3.671514084  CC1(C(N2C(=O)CC2S1(=O)=O)C(=O)[O-])CN3C=CN=N3 MCULE-6538021261 [0,0,0,0,0,0|0,0,1]=1
2  B22R3.671514084  C[C@@]1([C@@H](N2C(=O)CC2S1(=O)=O)C(=O)O)CN3C=CN=N3 MCULE-6292984350 [0,0,0,0,0,0|0,0,0]=0
3  B22R3.671514084  C[C@@]1([C@@H](N2C(=O)C[C@H]2S1(=O)=O)C(=O)[O-])CN3C=CN=N3 MCULE-9460387746 [0,0,0,0,0,0|0,0,1]=1
4  B22R3.671514084  [C@@H]12CC(=O)N1[C@H](C(S2(=O)=O)(C)CN3C=CN=N3)C(=O)O MCULE-2051850634 [0,0,0,0,0,0|0,0,0]=0
5  B22R3.671514084  [C@@H]12CC(=O)N1[C@H]([C@](S2(=O)=O)(C)CN3C=CN=N3)C(=O)O MCULE-7574505159 [0,0,0,0,0,0|0,0,0]=0
6  B22R3.671514084  [C@@H]12CC(=O)N1[C@H]([C@](S2(=O)=O)(C)CN3C=CN=N3)C(=O)[O-] MCULE-7765834230 [0,0,0,0,0,0|0,0,1]=1
7  B22R3.671514084  [C@H]1(N2C(=O)C[C@H]2S(=O)(=O)[C@@]1(C)CN3C=CN=N3)C(=O)O MCULE-5911637745 [0,0,0,0,0,0|0,0,0]=0
8  B23R3.71615316  C[N+]1=NN(C=C1)C[C@]2([C@@H](N3C(=O)C[C@H]3S2(=O)=O)C(=O)[O-])C MCULE-5789146379 [0,1,0,0,0,0|0,0,2]=3
9  B23R3.71615316  [C@@H]12CC(=O)N1[C@H]([C@](S2(=O)=O)(C)CN3C=C[N+](=N3)C)C(=O)[O-] MCULE-3181599059 [0,1,0,0,0,0|0,0,2]=3