# generated using pymatgen data_Hf3Ti9Sn9Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.31050315 _cell_length_b 9.34247932 _cell_length_c 5.72220756 _cell_angle_alpha 90.24823928 _cell_angle_beta 89.99999999 _cell_angle_gamma 119.88684708 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Ti9Sn9Au _chemical_formula_sum 'Hf3 Ti9 Sn9 Au1' _cell_volume 431.53712964 _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 0.84986435 0.69972870 0.74075812 1.0 Hf Hf1 1 0.14016365 0.84127240 0.25818754 1.0 Hf Hf2 1 0.70110875 0.84127240 0.25818754 1.0 Ti Ti3 1 0.31325164 0.14462780 0.75784907 1.0 Ti Ti4 1 0.83137616 0.14462780 0.75784907 1.0 Ti Ti5 1 0.15962268 0.31924536 0.23117249 1.0 Ti Ti6 1 0.50055103 0.00110306 0.50508898 1.0 Ti Ti7 1 0.49115087 0.49313829 0.99934865 1.0 Ti Ti8 1 0.00198642 0.49313829 0.99934865 1.0 Ti Ti9 1 0.00040987 0.50103808 0.49883691 1.0 Ti Ti10 1 0.50250645 0.00501290 0.00091151 1.0 Ti Ti11 1 0.50062821 0.50103808 0.49883691 1.0 Sn Sn12 1 0.19644518 0.39289135 0.73649100 1.0 Sn Sn13 1 0.79921882 0.20131107 0.25658503 1.0 Sn Sn14 1 0.40209225 0.20131107 0.25658503 1.0 Sn Sn15 1 0.58525241 0.79210892 0.75627460 1.0 Sn Sn16 1 0.20685650 0.79210892 0.75627460 1.0 Sn Sn17 1 0.78828109 0.57656119 0.24189916 1.0 Sn Sn18 1 0.66706254 0.33412309 0.75139512 1.0 Sn Sn19 1 0.33483281 0.66966662 0.24957325 1.0 Sn Sn20 1 0.00733801 0.01467602 0.99160444 1.0 Au Au21 1 0.01999930 0.03999860 0.49694331 1.0