# generated using pymatgen data_Hf5Zr3(TaGa3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.51456078 _cell_length_b 8.41230038 _cell_length_c 9.11349482 _cell_angle_alpha 90.07965353 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf5Zr3(TaGa3)4 _chemical_formula_sum 'Hf5 Zr3 Ta4 Ga12' _cell_volume 422.77590835 _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 0.25000000 0.03083761 0.62232283 1.0 Hf Hf1 1 0.75000000 0.36450696 0.18237825 1.0 Hf Hf2 1 0.25000000 0.63362506 0.81768312 1.0 Hf Hf3 1 0.75000000 0.86565162 0.81772798 1.0 Hf Hf4 1 0.25000000 0.13481893 0.18088487 1.0 Zr Zr5 1 0.75000000 0.47101186 0.62052052 1.0 Zr Zr6 1 0.25000000 0.53076430 0.37923499 1.0 Zr Zr7 1 0.75000000 0.96918476 0.37937766 1.0 Ta Ta8 1 0.00016682 0.75046634 0.11010837 1.0 Ta Ta9 1 0.49976094 0.24927957 0.88948444 1.0 Ta Ta10 1 0.00023906 0.24927957 0.88948444 1.0 Ta Ta11 1 0.49983318 0.75046634 0.11010837 1.0 Ga Ga12 1 0.00123725 0.75132090 0.57241358 1.0 Ga Ga13 1 0.49860219 0.24907238 0.42847263 1.0 Ga Ga14 1 0.00139781 0.24907238 0.42847263 1.0 Ga Ga15 1 0.49876275 0.75132090 0.57241358 1.0 Ga Ga16 1 0.75000000 0.04469040 0.07980276 1.0 Ga Ga17 1 0.25000000 0.95468749 0.91951292 1.0 Ga Ga18 1 0.75000000 0.54449860 0.92048827 1.0 Ga Ga19 1 0.25000000 0.45531258 0.07951552 1.0 Ga Ga20 1 0.75000000 0.13291248 0.65350588 1.0 Ga Ga21 1 0.25000000 0.86878123 0.34695639 1.0 Ga Ga22 1 0.75000000 0.63245095 0.34591139 1.0 Ga Ga23 1 0.25000000 0.36598977 0.65321660 1.0