# generated using pymatgen data_Li2HfO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.20041164 _cell_length_b 5.20041164 _cell_length_c 5.32889506 _cell_angle_alpha 78.84351462 _cell_angle_beta 101.15648538 _cell_angle_gamma 61.69300740 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2HfO3 _chemical_formula_sum 'Li4 Hf2 O6' _cell_volume 117.50161647 _cell_formula_units_Z 2 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 Li Li0 1 0.56502002 0.58554221 0.49372938 1.0 Li Li1 1 0.25169937 0.26482903 0.49166897 1.0 Li Li2 1 0.41445779 0.43497998 0.99372938 1.0 Li Li3 1 0.73517097 0.74830063 0.99166897 1.0 Hf Hf4 1 0.90006579 0.91736720 0.49046324 1.0 Hf Hf5 1 0.08263280 0.09993421 0.99046324 1.0 O O6 1 0.29715231 0.85445496 0.75320268 1.0 O O7 1 0.14554504 0.70284769 0.25320268 1.0 O O8 1 0.99118037 0.50887476 0.74100534 1.0 O O9 1 0.68611900 0.16256671 0.72773139 1.0 O O10 1 0.49112524 0.00881963 0.24100534 1.0 O O11 1 0.83743329 0.31388100 0.22773139 1.0