# 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 9DI 9DI '9-DEAZAINOSINE ' non-polymer 32 19 M # data_comp_9DI # 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 9DI C9 C . 0.000 9DI C4 C . 0.000 9DI N3 N . 0.000 9DI C2 C . 0.000 9DI N1 N . 0.000 9DI C6 C . 0.000 9DI O6 O . 0.000 9DI C5 C . 0.000 9DI N7 N . 0.000 9DI C8 C . 0.000 9DI 'C5'' C . 0.000 9DI 'O5'' O . 0.000 9DI 'C4'' C . 0.000 9DI 'O4'' O . 0.000 9DI 'C1'' C . 0.000 9DI 'C2'' C . 0.000 9DI 'O2'' O . 0.000 9DI 'C3'' C . 0.000 9DI 'O3'' O . 0.000 9DI H2 H . 0.000 9DI HN1 H . 0.000 9DI HN7 H . 0.000 9DI H8 H . 0.000 9DI 'H5'1' H . 0.000 9DI 'H5'2' H . 0.000 9DI 'HO5'' H . 0.000 9DI 'H4'' H . 0.000 9DI 'H1'' H . 0.000 9DI 'H2'' H . 0.000 9DI 'HO2'' H . 0.000 9DI 'H3'' H . 0.000 9DI 'HO3'' 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 9DI C9 C4 single 9DI C9 C8 double 9DI C9 'C1'' single 9DI C4 N3 single 9DI C4 C5 double 9DI N3 C2 double 9DI C2 N1 single 9DI C2 H2 single 9DI N1 C6 single 9DI N1 HN1 single 9DI C6 O6 double 9DI C6 C5 single 9DI C5 N7 single 9DI N7 C8 single 9DI N7 HN7 single 9DI C8 H8 single 9DI 'C5'' 'O5'' single 9DI 'C5'' 'C4'' single 9DI 'C5'' 'H5'1' single 9DI 'C5'' 'H5'2' single 9DI 'O5'' 'HO5'' single 9DI 'C4'' 'O4'' single 9DI 'C4'' 'C3'' single 9DI 'C4'' 'H4'' single 9DI 'O4'' 'C1'' single 9DI 'C1'' 'C2'' single 9DI 'C1'' 'H1'' single 9DI 'C2'' 'O2'' single 9DI 'C2'' 'C3'' single 9DI 'C2'' 'H2'' single 9DI 'O2'' 'HO2'' single 9DI 'C3'' 'O3'' single 9DI 'C3'' 'H3'' single 9DI 'O3'' 'HO3'' single