# generated using pymatgen data_KRuF6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.96039112 _cell_length_b 4.96039089 _cell_length_c 4.96038823 _cell_angle_alpha 97.98083971 _cell_angle_beta 97.98083389 _cell_angle_gamma 97.98084304 _symmetry_Int_Tables_number 1 _chemical_formula_structural KRuF6 _chemical_formula_sum 'K1 Ru1 F6' _cell_volume 118.13391592 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy K K0 1 0.50000000 0.50000000 0.50000000 1.0 Ru Ru1 1 0.00000000 0.00000000 0.00000000 1.0 F F2 1 0.26828430 0.26828430 0.91907673 1.0 F F3 1 0.26828530 0.91907673 0.26828430 1.0 F F4 1 0.73171470 0.08092327 0.73171570 1.0 F F5 1 0.73171570 0.73171570 0.08092327 1.0 F F6 1 0.08092327 0.73171470 0.73171570 1.0 F F7 1 0.91907673 0.26828530 0.26828430 1.0