# generated using pymatgen data_Cs2HfF6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.36074430 _cell_length_b 6.36074362 _cell_length_c 4.97031964 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999831 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cs2HfF6 _chemical_formula_sum 'Cs2 Hf1 F6' _cell_volume 174.15293052 _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 Cs Cs0 1 0.33333300 0.66666700 0.69548101 1.0 Cs Cs1 1 0.66666700 0.33333300 0.30451899 1.0 Hf Hf2 1 0.00000000 0.00000000 0.00000000 1.0 F F3 1 0.84892582 0.15107418 0.77846776 1.0 F F4 1 0.84892582 0.69785265 0.77846776 1.0 F F5 1 0.30214735 0.15107418 0.77846776 1.0 F F6 1 0.15107418 0.84892582 0.22153224 1.0 F F7 1 0.15107418 0.30214735 0.22153224 1.0 F F8 1 0.69785265 0.84892582 0.22153224 1.0