# generated using pymatgen data_Ho4ZrIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.74247391 _cell_length_b 10.74247391 _cell_length_c 6.22288529 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho4ZrIr3 _chemical_formula_sum 'Ho16 Zr4 Ir12' _cell_volume 718.12560255 _cell_formula_units_Z 4 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 Ho Ho0 1 0.28989849 0.08709919 0.37505721 1.0 Ho Ho1 1 0.28989849 0.91290081 0.87505721 1.0 Ho Ho2 1 0.71010151 0.08709919 0.87505721 1.0 Ho Ho3 1 0.71010151 0.91290081 0.37505721 1.0 Ho Ho4 1 0.58709919 0.78989849 0.87505721 1.0 Ho Ho5 1 0.58709919 0.21010151 0.37505721 1.0 Ho Ho6 1 0.41290081 0.78989849 0.37505721 1.0 Ho Ho7 1 0.41290081 0.21010151 0.87505721 1.0 Ho Ho8 1 0.21010151 0.41290081 0.62494279 1.0 Ho Ho9 1 0.21010151 0.58709919 0.12494279 1.0 Ho Ho10 1 0.78989849 0.41290081 0.12494279 1.0 Ho Ho11 1 0.78989849 0.58709919 0.62494279 1.0 Ho Ho12 1 0.91290081 0.71010151 0.12494279 1.0 Ho Ho13 1 0.91290081 0.28989849 0.62494279 1.0 Ho Ho14 1 0.08709919 0.71010151 0.62494279 1.0 Ho Ho15 1 0.08709919 0.28989849 0.12494279 1.0 Zr Zr16 1 0.00000000 0.00000000 0.50000000 1.0 Zr Zr17 1 0.00000000 0.00000000 0.00000000 1.0 Zr Zr18 1 0.50000000 0.50000000 0.00000000 1.0 Zr Zr19 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir20 1 0.85488072 0.14511928 0.25000000 1.0 Ir Ir21 1 0.85488072 0.85488072 0.75000000 1.0 Ir Ir22 1 0.14511928 0.14511928 0.75000000 1.0 Ir Ir23 1 0.14511928 0.85488072 0.25000000 1.0 Ir Ir24 1 0.64511928 0.35488072 0.75000000 1.0 Ir Ir25 1 0.64511928 0.64511928 0.25000000 1.0 Ir Ir26 1 0.35488072 0.35488072 0.25000000 1.0 Ir Ir27 1 0.35488072 0.64511928 0.75000000 1.0 Ir Ir28 1 0.50000000 0.00000000 0.12028928 1.0 Ir Ir29 1 0.50000000 0.00000000 0.62028928 1.0 Ir Ir30 1 0.00000000 0.50000000 0.87971072 1.0 Ir Ir31 1 0.00000000 0.50000000 0.37971072 1.0