# generated using pymatgen data_MnZn2IrO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.17769000 _cell_length_b 5.17020200 _cell_length_c 9.48729898 _cell_angle_alpha 57.30715080 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MnZn2IrO6 _chemical_formula_sum 'Mn2 Zn4 Ir2 O12' _cell_volume 213.73744829 _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 Mn Mn0 1 0.50000000 0.00000000 0.00000000 1.0 Mn Mn1 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn2 1 0.96832700 0.25093400 0.75409600 1.0 Zn Zn3 1 0.46832700 0.74906600 0.74590400 1.0 Zn Zn4 1 0.53167300 0.25093400 0.25409600 1.0 Zn Zn5 1 0.03167300 0.74906600 0.24590400 1.0 Ir Ir6 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir7 1 0.00000000 0.50000000 0.00000000 1.0 O O8 1 0.40933800 0.61085400 0.26823100 1.0 O O9 1 0.17694700 0.88783900 0.93803500 1.0 O O10 1 0.17783800 0.25404000 0.57379500 1.0 O O11 1 0.67783800 0.74596000 0.92620500 1.0 O O12 1 0.67694700 0.11216100 0.56196500 1.0 O O13 1 0.90933800 0.38914600 0.23176900 1.0 O O14 1 0.09066200 0.61085400 0.76823100 1.0 O O15 1 0.32305300 0.88783900 0.43803500 1.0 O O16 1 0.32216200 0.25404000 0.07379500 1.0 O O17 1 0.82305300 0.11216100 0.06196500 1.0 O O18 1 0.82216200 0.74596000 0.42620500 1.0 O O19 1 0.59066200 0.38914600 0.73176900 1.0