# 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 MBR MBR 'TRIBROMOMETHANE ' non-polymer 5 4 M # data_comp_MBR # 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 MBR C1 C . 0.000 MBR BR2 BR . 0.000 MBR BR1 BR . 0.000 MBR BR3 BR . 0.000 MBR H1 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 MBR C1 BR2 single MBR C1 BR1 single MBR C1 BR3 single MBR C1 H1 single