CCCCCCNc1ncnc2c1cnn2C    mol4951    0_1
CCCCCCNc1ncnc2c1c[nH+]n2C    mol4951    1_1
CCCCCCNc1nc[nH+]c2c1cnn2C    mol4951    1_2
CCCCCC[NH2+]c1ncnc2c1cnn2C    mol4951    1_3
CCCCCCNc1[nH+]cnc2c1cnn2C    mol4951    1_4