0  B40R4.4926968632  CC(C)(O\N=C(\c1c[s]c(N)[n]1)/C(=O)NC2C3SCC(C[n+]4ccccc4)=C(C([O-])=O)N3C2=O)C(O)=O Amb24121251 [0,0,0,0,0,0|0,0,0]=0
1  B40R4.4926968632  CC(C)(O\N=C(\c1c[s]c(N)[n]1)/C(=O)N[C@@H]2[C@@H]3SC=C(C[n+]4ccccc4)C(C([O-])=O)N3C2=O)C(O)=O Amb19131163 [0,0,0,0,0,0|0,0,2]=2
2  B40R4.4926968632  CC(C)(O\N=C(\c1c[s]c(N)[n]1)/C(=O)N[C@@H]2[C@@H]3SCC(C[n+]4ccccc4)=C(C([O-])=O)N3C2=O)C(O)=O Amb19131162 [0,0,0,0,0,0|0,0,0]=0
3  B40R4.4926968632  O=C1[C@@H](NC(=O)\C(=N/OC(C(=O)O)(C)C)\c2csc(n2)N)[C@@H]3N1C(=C(CS3)C[n+]4ccccc4)C(=O)[O-] Amb17610689 [0,0,0,0,0,0|0,0,0]=0