# generated using pymatgen data_ZrO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.42584038 _cell_length_b 7.66609213 _cell_length_c 3.44778885 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrO2 _chemical_formula_sum 'Zr4 O8' _cell_volume 143.41075045 _cell_formula_units_Z 4 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 Zr Zr0 1 0.14395401 0.83043230 0.25000000 1.0 Zr Zr1 1 0.35604599 0.33043230 0.25000000 1.0 Zr Zr2 1 0.64395401 0.66956770 0.75000000 1.0 Zr Zr3 1 0.85604599 0.16956770 0.75000000 1.0 O O4 1 0.10844575 0.10998023 0.25000000 1.0 O O5 1 0.13094916 0.35663633 0.75000000 1.0 O O6 1 0.36905084 0.85663633 0.75000000 1.0 O O7 1 0.39155425 0.60998023 0.25000000 1.0 O O8 1 0.60844575 0.39001977 0.75000000 1.0 O O9 1 0.63094916 0.14336367 0.25000000 1.0 O O10 1 0.86905084 0.64336367 0.25000000 1.0 O O11 1 0.89155425 0.89001977 0.75000000 1.0