# generated using pymatgen data_Ho4ErIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.76330340 _cell_length_b 10.76330340 _cell_length_c 6.32061968 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho4ErIr3 _chemical_formula_sum 'Ho16 Er4 Ir12' _cell_volume 732.23557360 _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 0.29137686 0.08784751 0.38358325 1.0 Ho Ho1 1 0.29137686 0.91215249 0.88358325 1.0 Ho Ho2 1 0.70862314 0.08784751 0.88358325 1.0 Ho Ho3 1 0.70862314 0.91215249 0.38358325 1.0 Ho Ho4 1 0.58784751 0.79137686 0.88358325 1.0 Ho Ho5 1 0.58784751 0.20862314 0.38358325 1.0 Ho Ho6 1 0.41215249 0.79137686 0.38358325 1.0 Ho Ho7 1 0.41215249 0.20862314 0.88358325 1.0 Ho Ho8 1 0.20862314 0.41215249 0.61641675 1.0 Ho Ho9 1 0.20862314 0.58784751 0.11641675 1.0 Ho Ho10 1 0.79137686 0.41215249 0.11641675 1.0 Ho Ho11 1 0.79137686 0.58784751 0.61641675 1.0 Ho Ho12 1 0.91215249 0.70862314 0.11641675 1.0 Ho Ho13 1 0.91215249 0.29137686 0.61641675 1.0 Ho Ho14 1 0.08784751 0.70862314 0.61641675 1.0 Ho Ho15 1 0.08784751 0.29137686 0.11641675 1.0 Er Er16 1 0.00000000 0.00000000 0.50000000 1.0 Er Er17 1 0.00000000 0.00000000 0.00000000 1.0 Er Er18 1 0.50000000 0.50000000 0.00000000 1.0 Er Er19 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir20 1 0.84718017 0.15281983 0.25000000 1.0 Ir Ir21 1 0.84718017 0.84718017 0.75000000 1.0 Ir Ir22 1 0.15281983 0.15281983 0.75000000 1.0 Ir Ir23 1 0.15281983 0.84718017 0.25000000 1.0 Ir Ir24 1 0.65281983 0.34718017 0.75000000 1.0 Ir Ir25 1 0.65281983 0.65281983 0.25000000 1.0 Ir Ir26 1 0.34718017 0.34718017 0.25000000 1.0 Ir Ir27 1 0.34718017 0.65281983 0.75000000 1.0 Ir Ir28 1 0.50000000 0.00000000 0.12956656 1.0 Ir Ir29 1 0.50000000 0.00000000 0.62956656 1.0 Ir Ir30 1 0.00000000 0.50000000 0.87043344 1.0 Ir Ir31 1 0.00000000 0.50000000 0.37043344 1.0