COc1cc([S@@+](C)[O-])ccc1-c1nc2ncncc2[nH]1    mol14673    0_1
COc1cc([S@@+](C)[O-])ccc1-c1nc2[nH+]cncc2[nH]1    mol14673    1_1
COc1cc([S@@+](C)[O-])ccc1-c1[nH]c2cncnc2[nH+]1    mol14673    1_2
COc1cc([S@@+](C)[O-])ccc1-c1nc2nc[nH+]cc2[nH]1    mol14673    1_3
COc1cc([S@@+](C)[O-])ccc1-c1nc2ncncc2[n-]1    mol14673    -1_1