# generated using pymatgen data_Sr2HfO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.99508816 _cell_length_b 6.99508816 _cell_length_c 6.99508816 _cell_angle_alpha 146.10092834 _cell_angle_beta 146.10092834 _cell_angle_gamma 48.69687488 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2HfO4 _chemical_formula_sum 'Sr2 Hf1 O4' _cell_volume 106.01044178 _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 Sr Sr0 1 0.64732453 0.64732453 0.00000000 1.0 Sr Sr1 1 0.35267547 0.35267547 -0.00000000 1.0 Hf Hf2 1 0.00000000 -0.00000000 -0.00000000 1.0 O O3 1 0.50000000 -0.00000000 0.50000000 1.0 O O4 1 0.00000000 0.50000000 0.50000000 1.0 O O5 1 0.83630069 0.83630069 0.00000000 1.0 O O6 1 0.16369931 0.16369931 -0.00000000 1.0