CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C-]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)O    mol30160    0_1
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)O)=C([CH-][n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)O    mol30160    0_2
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@@H]21)c1csc([NH-])n1)C(=O)O    mol30160    0_3
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)[O-])=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)[nH+]1)C(=O)[O-]    mol30160    0_4
CC(C)(O/[NH+]=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)[O-])=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)[O-]    mol30160    0_5
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)[O-]    mol30160    0_6
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)[O-])=C(C[n+]3ccccc3)CS[C@@H]21)c1csc([NH3+])n1)C(=O)[O-]    mol30160    0_7
CC(C)(O/N=C(\C(=O)[N-][C@@H]1C(=O)[C@@H]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)O    mol30160    0_8
CC(C)(O/N=C(\C(=O)N[C-]1C(=O)[C@@H]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@H]12)c1csc(N)n1)C(=O)O    mol30160    0_9
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)[O-])=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)O    mol30160    0_10
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)O)=C([CH-][n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)[O-]    mol30160    -1_1
CC(C)(O/N=C(\C(=O)N[C-]1C(=O)[C@@H]2C(C(=O)[O-])=C(C[n+]3ccccc3)CS[C@H]12)c1csc(N)n1)C(=O)O    mol30160    -1_2
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C-]2C(C(=O)[O-])=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)O    mol30160    -1_3
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)[O-])=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)[O-]    mol30160    -1_4
CC(C)(O/N=C(\C(=O)N[C-]1C(=O)[C@@H]2C(C(=O)O)=C([CH-][n+]3ccccc3)CS[C@H]12)c1csc(N)n1)C(=O)O    mol30160    -1_5
CC(C)(O/N=C(\C(=O)N[C-]1C(=O)[C@@H]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@H]12)c1csc([NH-])n1)C(=O)O    mol30160    -1_6
CC(C)(O/N=C(\C(=O)N[C-]1C(=O)[C-]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@H]12)c1csc(N)n1)C(=O)O    mol30160    -1_7
CC(C)(O/N=C(\C(=O)[N-][C@@H]1C(=O)[C@@H]2C(C(=O)[O-])=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)O    mol30160    -1_8
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C-]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)[O-]    mol30160    -1_9
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C-]2C(C(=O)O)=C([CH-][n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)O    mol30160    -1_10
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)O)=C([CH-][n+]3ccccc3)CS[C@@H]21)c1csc([NH-])n1)C(=O)O    mol30160    -1_11
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)[O-])=C(C[n+]3ccccc3)CS[C@@H]21)c1csc([NH-])n1)C(=O)O    mol30160    -1_12
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C-]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@@H]21)c1csc([NH-])n1)C(=O)O    mol30160    -1_13
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@@H]21)c1csc([NH-])n1)C(=O)[O-]    mol30160    -1_14
CC(C)(O/N=C(\C(=O)[N-][C@@H]1C(=O)[C@@H]2C(C(=O)O)=C([CH-][n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)O    mol30160    -1_15
CC(C)(O/N=C(\C(=O)[N-][C-]1C(=O)[C@@H]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@H]12)c1csc(N)n1)C(=O)O    mol30160    -1_16
CC(C)(O/N=C(\C(=O)[N-][C@@H]1C(=O)[C-]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)O    mol30160    -1_17
CC(C)(O/N=C(\C(=O)[N-][C@@H]1C(=O)[C@@H]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@@H]21)c1csc([NH-])n1)C(=O)O    mol30160    -1_18
CC(C)(O/N=C(\C(=O)N[C@@H]1C(=O)[C@@H]2C(C(=O)[O-])=C([CH-][n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)O    mol30160    -1_19
CC(C)(O/N=C(\C(=O)[N-][C@@H]1C(=O)[C@@H]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@@H]21)c1csc(N)n1)C(=O)[O-]    mol30160    -1_20
CC(C)(O/N=C(\C(=O)N[C-]1C(=O)[C@@H]2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@H]12)c1csc(N)n1)C(=O)[O-]    mol30160    -1_21