# generated using pymatgen data_Mg4Cu(GeIr)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.99913832 _cell_length_b 6.99913887 _cell_length_c 6.99913817 _cell_angle_alpha 109.36571190 _cell_angle_beta 109.36571008 _cell_angle_gamma 109.68244349 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg4Cu(GeIr)6 _chemical_formula_sum 'Mg4 Cu1 Ge6 Ir6' _cell_volume 263.94136089 _cell_formula_units_Z 1 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 0.00193767 0.99806233 0.50000000 1.0 Mg Mg1 1 0.00193767 0.50193767 0.00387633 1.0 Mg Mg2 1 0.49806233 0.99806233 0.99612367 1.0 Mg Mg3 1 0.49806233 0.50193767 0.50000000 1.0 Cu Cu4 1 0.75000000 0.25000000 0.50000000 1.0 Ge Ge5 1 0.68687079 0.68687079 0.00000000 1.0 Ge Ge6 1 0.30780112 0.99784782 0.30995331 1.0 Ge Ge7 1 0.00215218 0.31210549 0.30995331 1.0 Ge Ge8 1 0.31312921 0.31312921 0.00000000 1.0 Ge Ge9 1 0.68789451 0.99784782 0.69004669 1.0 Ge Ge10 1 0.00215218 0.69219888 0.69004669 1.0 Ir Ir11 1 0.74608678 0.49157882 0.25450796 1.0 Ir Ir12 1 0.50842118 0.25391322 0.74549204 1.0 Ir Ir13 1 0.23707086 0.49157882 0.74549204 1.0 Ir Ir14 1 0.25000000 0.75000000 0.50000000 1.0 Ir Ir15 1 0.50842118 0.76292914 0.25450796 1.0 Ir Ir16 1 0.00000000 0.00000000 0.00000000 1.0