CNc1ncnc2scnc12    mol4969    0_1
CNc1nc[nH+]c2scnc12    mol4969    1_1
CNc1[nH+]cnc2scnc12    mol4969    1_2
C[NH2+]c1ncnc2scnc12    mol4969    1_3
CNc1ncnc2sc[nH+]c12    mol4969    1_4