Oc1cc(C2CCNCC2)no1    mol16716    0_1
[O-]c1cc(C2CC[NH2+]CC2)no1    mol16716    0_2
[O-]c1cc(C2CCNCC2)[nH+]o1    mol16716    0_3
Oc1cc(C2CC[NH2+]CC2)no1    mol16716    1_1
[O-]c1cc(C2CC[NH2+]CC2)[nH+]o1    mol16716    1_2
Oc1cc(C2CCNCC2)[nH+]o1    mol16716    1_3
[O-]c1cc(C2CCNCC2)no1    mol16716    -1_1