# generated using pymatgen data_Hf5Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.91528023 _cell_length_b 7.91524671 _cell_length_c 5.51179974 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99985748 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf5Ir3 _chemical_formula_sum 'Hf10 Ir6' _cell_volume 299.05800808 _cell_formula_units_Z 2 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 0.66664778 0.33332746 -0.00000001 1.0 Hf Hf1 1 0.33335222 0.66667254 0.00000001 1.0 Hf Hf2 1 0.33335222 0.66667254 0.49999999 1.0 Hf Hf3 1 0.66664778 0.33332746 0.50000001 1.0 Hf Hf4 1 0.75912976 0.75914073 0.75000000 1.0 Hf Hf5 1 0.24086682 0.00001418 0.75000000 1.0 Hf Hf6 1 0.00000321 0.24084690 0.75000000 1.0 Hf Hf7 1 0.24087024 0.24085927 0.25000000 1.0 Hf Hf8 1 0.75913318 -0.00001418 0.25000000 1.0 Hf Hf9 1 -0.00000321 0.75915310 0.25000000 1.0 Ir Ir10 1 0.39974657 0.39974184 0.75000000 1.0 Ir Ir11 1 0.60025383 -0.00000614 0.75000000 1.0 Ir Ir12 1 -0.00000142 0.60026296 0.75000000 1.0 Ir Ir13 1 0.60025343 0.60025816 0.25000000 1.0 Ir Ir14 1 0.39974617 0.00000614 0.25000000 1.0 Ir Ir15 1 0.00000142 0.39973704 0.25000000 1.0