# generated using pymatgen data_Li2MgIr _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.21490900 _cell_length_b 6.21490900 _cell_length_c 6.21490900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2MgIr _chemical_formula_sum 'Li8 Mg4 Ir4' _cell_volume 240.05144357 _cell_formula_units_Z 4 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 Li Li0 1 0.50000000 0.50000000 0.50000000 1.0 Li Li1 1 0.50000000 0.50000000 0.00000000 1.0 Li Li2 1 0.50000000 0.00000000 0.50000000 1.0 Li Li3 1 0.00000000 0.50000000 0.50000000 1.0 Li Li4 1 0.72856600 0.72856600 0.27143400 1.0 Li Li5 1 0.72856600 0.27143400 0.72856600 1.0 Li Li6 1 0.27143400 0.72856600 0.72856600 1.0 Li Li7 1 0.27143400 0.27143400 0.27143400 1.0 Mg Mg8 1 0.00000000 0.00000000 0.00000000 1.0 Mg Mg9 1 0.00000000 0.00000000 0.50000000 1.0 Mg Mg10 1 0.00000000 0.50000000 0.00000000 1.0 Mg Mg11 1 0.50000000 0.00000000 0.00000000 1.0 Ir Ir12 1 0.25250800 0.25250800 0.74749200 1.0 Ir Ir13 1 0.25250800 0.74749200 0.25250800 1.0 Ir Ir14 1 0.74749200 0.25250800 0.25250800 1.0 Ir Ir15 1 0.74749200 0.74749200 0.74749200 1.0