# generated using pymatgen data_Hf6Al16Cu3Rh4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.57750927 _cell_length_b 8.61503834 _cell_length_c 8.61107053 _cell_angle_alpha 59.72870187 _cell_angle_beta 59.75984126 _cell_angle_gamma 60.11211163 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Al16Cu3Rh4 _chemical_formula_sum 'Hf6 Al16 Cu3 Rh4' _cell_volume 448.57460378 _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 0.69191654 0.30956431 0.30806673 1.0 Hf Hf1 1 0.30805841 0.69047648 0.69192661 1.0 Hf Hf2 1 0.31189835 0.68813489 0.31190533 1.0 Hf Hf3 1 0.32035450 0.32012230 0.67967706 1.0 Hf Hf4 1 0.68809047 0.31193126 0.68811664 1.0 Hf Hf5 1 0.67966962 0.67988203 0.32034101 1.0 Al Al6 1 0.33614201 0.33494320 0.33202441 1.0 Al Al7 1 0.33338364 0.33479853 0.99986785 1.0 Al Al8 1 0.99984188 0.33191785 0.33345661 1.0 Al Al9 1 0.33207620 0.99695702 0.33614940 1.0 Al Al10 1 0.66380482 0.66515280 0.66798776 1.0 Al Al11 1 0.66656459 0.66527741 0.00015640 1.0 Al Al12 1 0.66804471 0.00310136 0.66380600 1.0 Al Al13 1 0.00016903 0.66797046 0.66660442 1.0 Al Al14 1 0.12456804 0.11618018 0.11640042 1.0 Al Al15 1 0.12335543 0.12253020 0.64058546 1.0 Al Al16 1 0.64058957 0.11364167 0.12330883 1.0 Al Al17 1 0.11631829 0.64282690 0.12454329 1.0 Al Al18 1 0.87553279 0.88371840 0.88355793 1.0 Al Al19 1 0.87667451 0.87747175 0.35941456 1.0 Al Al20 1 0.88355467 0.35715365 0.87550894 1.0 Al Al21 1 0.35942203 0.88648884 0.87666343 1.0 Cu Cu22 1 0.99996028 0.49961322 0.00003056 1.0 Cu Cu23 1 0.00012211 0.99988905 0.49992057 1.0 Cu Cu24 1 0.49983144 0.50020442 0.00000554 1.0 Rh Rh25 1 0.00000781 0.99997248 0.99998797 1.0 Rh Rh26 1 0.50006689 0.00002462 0.99997743 1.0 Rh Rh27 1 0.99996086 0.49999980 0.50002081 1.0 Rh Rh28 1 0.50001849 0.00005190 0.49998603 1.0