# generated using pymatgen data_Hf3TaFe8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.94351674 _cell_length_b 4.94351723 _cell_length_c 8.06256995 _cell_angle_alpha 89.99999899 _cell_angle_beta 89.99998777 _cell_angle_gamma 119.99922461 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3TaFe8 _chemical_formula_sum 'Hf3 Ta1 Fe8' _cell_volume 170.63950446 _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 0.33333221 0.66666746 0.44112097 1.0 Hf Hf1 1 0.33333219 0.66666767 0.06145975 1.0 Hf Hf2 1 0.66666794 0.33333213 0.93547416 1.0 Ta Ta3 1 0.66666807 0.33333113 0.56035556 1.0 Fe Fe4 1 -0.00000089 0.00000032 0.50044185 1.0 Fe Fe5 1 -0.00000089 -0.00000100 1.00018239 1.0 Fe Fe6 1 0.16797115 0.33594061 0.74801874 1.0 Fe Fe7 1 0.16797063 0.83203045 0.74801903 1.0 Fe Fe8 1 0.66405934 0.83202933 0.74801828 1.0 Fe Fe9 1 0.83200507 0.66401031 0.25230476 1.0 Fe Fe10 1 0.83200548 0.16799603 0.25230399 1.0 Fe Fe11 1 0.33599171 0.16799655 0.25230450 1.0