# 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 ALF . 'TETRAFLUOROALUMINATE ION ' non-polymer 5 5 . # data_comp_ALF # 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 ALF F4 F F 0.000 ALF AL AL AL 0.000 ALF F1 F F 0.000 ALF F2 F F 0.000 ALF F3 F F 0.000 loop_ _chem_comp_tree.comp_id _chem_comp_tree.atom_id _chem_comp_tree.atom_back _chem_comp_tree.atom_forward _chem_comp_tree.connect_type ALF F4 n/a AL START ALF AL F4 F3 . ALF F1 AL . . ALF F2 AL . . ALF F3 AL . END loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.type _chem_comp_bond.value_dist _chem_comp_bond.value_dist_esd ALF AL F4 coval 1.785 0.020 ALF F1 AL coval 1.785 0.020 ALF F2 AL coval 1.785 0.020 ALF F3 AL coval 1.785 0.020 loop_ _chem_comp_angle.comp_id _chem_comp_angle.atom_id_1 _chem_comp_angle.atom_id_2 _chem_comp_angle.atom_id_3 _chem_comp_angle.value_angle _chem_comp_angle.value_angle_esd ALF F4 AL F1 90.000 3.000 ALF F4 AL F2 90.000 3.000 ALF F4 AL F3 180.000 3.000 ALF F1 AL F2 180.000 3.000 ALF F1 AL F3 90.000 3.000 ALF F2 AL F3 90.000 3.000