# generated using pymatgen data_La2MgIrO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.71753800 _cell_length_b 5.59841100 _cell_length_c 9.72872952 _cell_angle_alpha 54.94272960 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural La2MgIrO6 _chemical_formula_sum 'La4 Mg2 Ir2 O12' _cell_volume 254.91195397 _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 La La0 1 0.54856200 0.73826300 0.75078200 1.0 La La1 1 0.04856200 0.26173700 0.74921800 1.0 La La2 1 0.95143800 0.73826300 0.25078200 1.0 La La3 1 0.45143800 0.26173700 0.24921800 1.0 Mg Mg4 1 0.50000000 0.50000000 0.50000000 1.0 Mg Mg5 1 0.00000000 0.50000000 0.00000000 1.0 Ir Ir6 1 0.50000000 0.00000000 0.00000000 1.0 Ir Ir7 1 0.00000000 0.00000000 0.50000000 1.0 O O8 1 0.52292200 0.83910000 0.24810400 1.0 O O9 1 0.02292200 0.16090000 0.25189600 1.0 O O10 1 0.47707800 0.16090000 0.75189600 1.0 O O11 1 0.97707800 0.83910000 0.74810400 1.0 O O12 1 0.79426300 0.66120800 0.54701900 1.0 O O13 1 0.29426300 0.33879200 0.95298100 1.0 O O14 1 0.20573700 0.33879200 0.45298100 1.0 O O15 1 0.70573700 0.66120800 0.04701900 1.0 O O16 1 0.21099500 0.75070700 0.04718200 1.0 O O17 1 0.71099500 0.24929300 0.45281800 1.0 O O18 1 0.78900500 0.24929300 0.95281800 1.0 O O19 1 0.28900500 0.75070700 0.54718200 1.0