# generated using pymatgen data_Hf2Zr(AlCu)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.47633737 _cell_length_b 6.52824456 _cell_length_c 3.95735404 _cell_angle_alpha 89.99999998 _cell_angle_beta 89.99999137 _cell_angle_gamma 119.73774244 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf2Zr(AlCu)3 _chemical_formula_sum 'Hf2 Zr1 Al3 Cu3' _cell_volume 145.27907429 _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 Hf Hf0 1 0.00038028 0.41883774 0.50000100 1.0 Hf Hf1 1 0.58154254 0.58116026 0.50000000 1.0 Zr Zr2 1 0.41891667 1.00000000 0.50000100 1.0 Al Al3 1 0.75260575 0.99999900 1.00000000 1.0 Al Al4 1 0.24655158 0.24499537 0.00000000 1.0 Al Al5 1 0.00155721 0.75500463 0.00000000 1.0 Cu Cu6 1 0.67114447 0.33819953 1.00000000 1.0 Cu Cu7 1 0.33294494 0.66180147 1.00000000 1.0 Cu Cu8 1 0.99435656 0.00000100 0.50000000 1.0