O=C(O)[C@@H]1Cc2[nH]cnc2CN1    mol12854    0_1
O=C([O-])[C@@H]1Cc2[nH]cnc2C[NH2+]1    mol12854    0_2
O=C([O-])[C@@H]1Cc2[nH]c[nH+]c2CN1    mol12854    0_3
O=C(O)[C@@H]1Cc2[nH]c[nH+]c2CN1    mol12854    1_1
O=C(O)[C@@H]1Cc2[nH]cnc2C[NH2+]1    mol12854    1_2
O=C([O-])[C@@H]1Cc2[nH]c[nH+]c2C[NH2+]1    mol12854    1_3
O=C([O-])[C@@H]1Cc2[nH]cnc2CN1    mol12854    -1_1
O=C(O)[C@@H]1Cc2[n-]cnc2CN1    mol12854    -1_2