data_image0 _chemical_formula_structural MgZrO3SnZrO3SnZrO3MgZrO3 _chemical_formula_sum "Mg2 Zr4 O12 Sn2" _cell_length_a 5.869672302779739 _cell_length_b 5.869672302779739 _cell_length_c 8.300970177276822 _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 90.0 _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 Mg Mg1 1.0 0.9169598377232875 0.9169598377232875 0.053112061612830004 1.0000 Zr Zr1 1.0 0.47495057889284087 0.9840404310156015 0.2537424558203123 1.0000 O O1 1.0 0.46816911624326013 0.05549326738727229 0.9945167356904316 1.0000 O O2 1.0 0.31652567136015003 0.31652567136015003 0.27399326569413285 1.0000 O O3 1.0 0.1862155093057546 0.8038739205117142 0.21221022362947337 1.0000 Sn Sn1 1.0 0.4555240963167842 0.4555240963167842 0.038459363670121 1.0000 Zr Zr2 1.0 0.9840404310156192 0.4749505788928574 0.2537424558203128 1.0000 O O4 1.0 0.0554932673872508 0.46816911624324 0.9945167356904315 1.0000 O O5 1.0 0.7152209306352351 0.7152209306352351 0.192171545912602 1.0000 O O6 1.0 0.8038739205117156 0.18621550930575326 0.21221022362947364 1.0000 Sn Sn2 1.0 0.9515519518980725 0.9515519518980725 0.5181186188424565 1.0000 Zr Zr3 1.0 0.5030549130902117 0.016743220845494778 0.7551430831687467 1.0000 O O7 1.0 0.5740709697900319 0.9264502333399695 0.49157048201277764 1.0000 O O8 1.0 0.27366423200356416 0.2736642320035642 0.6888756429202285 1.0000 O O9 1.0 0.3061087727379987 0.7314134889194577 0.7160780983864898 1.0000 Mg Mg2 1.0 0.5121630831350056 0.5121630831350057 0.5972135200604531 1.0000 Zr Zr4 1.0 0.016743220845491402 0.5030549130902093 0.7551430831687468 1.0000 O O10 1.0 0.9264502333399948 0.5740709697900578 0.4915704820127799 1.0000 O O11 1.0 0.8307615163173081 0.8307615163173081 0.7986263809719255 1.0000 O O12 1.0 0.7314134889194488 0.3061087727380101 0.7160780983864911 1.0000