O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2ncccn2)CC1    mol55    0_1
O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2nccc[nH+]2)CC1    mol55    1_1
O=C1CC2(CCCC2)CC(=O)N1CCCCN1CC[NH+](c2ncccn2)CC1    mol55    1_2
O=C1CC2(CCCC2)CC(=O)N1CCCC[NH+]1CCN(c2ncccn2)CC1    mol55    1_3
O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(c2[nH+]ccc[nH+]2)CC1    mol55    2_1
O=C1CC2(CCCC2)CC(=O)N1CCCCN1CC[NH+](c2nccc[nH+]2)CC1    mol55    2_2
O=C1CC2(CCCC2)CC(=O)N1CCCC[NH+]1CCN(c2nccc[nH+]2)CC1    mol55    2_3
O=C1CC2(CCCC2)CC(=O)N1CCCC[NH+]1CC[NH+](c2ncccn2)CC1    mol55    2_4
O=C1CC2(CCCC2)CC(=O)N1CCCCN1CC[NH+](c2[nH+]ccc[nH+]2)CC1    mol55    3_1
O=C1CC2(CCCC2)CC(=O)N1CCCC[NH+]1CC[NH+](c2nccc[nH+]2)CC1    mol55    3_2
O=C1CC2(CCCC2)CC(=O)N1CCCC[NH+]1CCN(c2[nH+]ccc[nH+]2)CC1    mol55    3_3