# data_comp_list loop_ _chem_comp.id _chem_comp.three_letter_code _chem_comp.name _chem_comp.group _chem_comp.number_atoms_all _chem_comp.number_atoms_nh _chem_comp.desc_level RIN RIN '3-AMINO-AZACYCLOTRIDECAN-2-ONE ' non-polymer 39 15 M # data_comp_RIN # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.type_energy _chem_comp_atom.partial_charge RIN N N . 0.000 RIN CA C . 0.000 RIN CB C . 0.000 RIN CG C . 0.000 RIN CD C . 0.000 RIN CE C . 0.000 RIN CZ C . 0.000 RIN C5 C . 0.000 RIN C4 C . 0.000 RIN C3 C . 0.000 RIN C2 C . 0.000 RIN C1 C . 0.000 RIN N1 N . 0.000 RIN C C . 0.000 RIN O O . 0.000 RIN H H . 0.000 RIN HN2 H . 0.000 RIN HA H . 0.000 RIN HB1 H . 0.000 RIN HB2 H . 0.000 RIN HG1 H . 0.000 RIN HG2 H . 0.000 RIN HD1 H . 0.000 RIN HD2 H . 0.000 RIN HE1 H . 0.000 RIN HE2 H . 0.000 RIN HZ1 H . 0.000 RIN HZ2 H . 0.000 RIN H51 H . 0.000 RIN H52 H . 0.000 RIN H41 H . 0.000 RIN H42 H . 0.000 RIN H31 H . 0.000 RIN H32 H . 0.000 RIN H21 H . 0.000 RIN H22 H . 0.000 RIN H11 H . 0.000 RIN H12 H . 0.000 RIN HN1 H . 0.000 loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.type RIN N CA single RIN N H single RIN N HN2 single RIN CA CB single RIN CA C single RIN CA HA single RIN CB CG single RIN CB HB1 single RIN CB HB2 single RIN CG CD single RIN CG HG1 single RIN CG HG2 single RIN CD CE single RIN CD HD1 single RIN CD HD2 single RIN CE CZ single RIN CE HE1 single RIN CE HE2 single RIN CZ C5 single RIN CZ HZ1 single RIN CZ HZ2 single RIN C5 C4 single RIN C5 H51 single RIN C5 H52 single RIN C4 C3 single RIN C4 H41 single RIN C4 H42 single RIN C3 C2 single RIN C3 H31 single RIN C3 H32 single RIN C2 C1 single RIN C2 H21 single RIN C2 H22 single RIN C1 N1 single RIN C1 H11 single RIN C1 H12 single RIN N1 C single RIN N1 HN1 single RIN C O double