# generated using pymatgen data_CeCu5Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.03945690 _cell_length_b 8.18756835 _cell_length_c 10.32556351 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CeCu5Au _chemical_formula_sum 'Ce4 Cu20 Au4' _cell_volume 426.04202087 _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 Ce Ce0 1 0.25000000 0.25937330 0.56461511 1.0 Ce Ce1 1 0.75000000 0.74062670 0.43538489 1.0 Ce Ce2 1 0.25000000 0.75937330 0.93538489 1.0 Ce Ce3 1 0.75000000 0.24062670 0.06461511 1.0 Cu Cu4 1 0.49989908 0.56729808 0.18679478 1.0 Cu Cu5 1 -0.00010092 0.43270192 0.81320522 1.0 Cu Cu6 1 0.00010092 0.06729808 0.31320522 1.0 Cu Cu7 1 0.50010092 0.93270192 0.68679478 1.0 Cu Cu8 1 0.50010092 0.43270192 0.81320522 1.0 Cu Cu9 1 0.00010092 0.56729808 0.18679478 1.0 Cu Cu10 1 -0.00010092 0.93270192 0.68679478 1.0 Cu Cu11 1 0.49989908 0.06729808 0.31320522 1.0 Cu Cu12 1 0.75000000 0.94539347 0.89184954 1.0 Cu Cu13 1 0.25000000 0.05460653 0.10815046 1.0 Cu Cu14 1 0.75000000 0.44539347 0.60815046 1.0 Cu Cu15 1 0.25000000 0.55460653 0.39184954 1.0 Cu Cu16 1 0.75000000 0.68334954 0.75421975 1.0 Cu Cu17 1 0.25000000 0.31665046 0.24578025 1.0 Cu Cu18 1 0.75000000 0.18334954 0.74578025 1.0 Cu Cu19 1 0.25000000 0.81665046 0.25421975 1.0 Cu Cu20 1 0.75000000 0.58877701 0.98448893 1.0 Cu Cu21 1 0.25000000 0.41122299 0.01551107 1.0 Cu Cu22 1 0.75000000 0.08877701 0.51551107 1.0 Cu Cu23 1 0.25000000 0.91122299 0.48448893 1.0 Au Au24 1 0.25000000 0.14082238 0.86286306 1.0 Au Au25 1 0.75000000 0.85917762 0.13713694 1.0 Au Au26 1 0.25000000 0.64082238 0.63713694 1.0 Au Au27 1 0.75000000 0.35917762 0.36286306 1.0