data_image0 _chemical_formula_structural ZrO _chemical_formula_sum "Zr1 O1" _cell_length_a 3.548410238467041 _cell_length_b 3.548908339256818 _cell_length_c 15.00009310009194 _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 121.3161777309287 _space_group_name_H-M_alt "P 1" _space_group_IT_number 1 loop_ _space_group_symop_operation_xyz '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 Zr1 1.0 0.8369721568741674 0.6631382730735842 0.4999976453448833 1.0000 O O1 1.0 0.1630396532382205 0.3368572581934856 0.5000026279806243 1.0000