# generated using pymatgen data_Mg2CoIrO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.24761300 _cell_length_b 5.03898700 _cell_length_c 8.93020188 _cell_angle_alpha 55.76322242 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2CoIrO6 _chemical_formula_sum 'Mg4 Co2 Ir2 O12' _cell_volume 195.22010970 _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 Mg Mg0 1 0.93590600 0.23504700 0.75243400 1.0 Mg Mg1 1 0.43590600 0.76495300 0.74756600 1.0 Mg Mg2 1 0.56409400 0.23504700 0.25243400 1.0 Mg Mg3 1 0.06409400 0.76495300 0.24756600 1.0 Co Co4 1 0.50000000 0.00000000 0.00000000 1.0 Co Co5 1 0.00000000 0.00000000 0.50000000 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 0.43306200 0.62062600 0.24660500 1.0 O O9 1 0.18856000 0.89104000 0.93208800 1.0 O O10 1 0.18204800 0.24561300 0.57066000 1.0 O O11 1 0.68204800 0.75438700 0.92934000 1.0 O O12 1 0.68856000 0.10896000 0.56791200 1.0 O O13 1 0.93306200 0.37937400 0.25339500 1.0 O O14 1 0.06693800 0.62062600 0.74660500 1.0 O O15 1 0.31144000 0.89104000 0.43208800 1.0 O O16 1 0.31795200 0.24561300 0.07066000 1.0 O O17 1 0.81144000 0.10896000 0.06791200 1.0 O O18 1 0.81795200 0.75438700 0.42934000 1.0 O O19 1 0.56693800 0.37937400 0.75339500 1.0