# generated using pymatgen data_Ho16Er4(Ir3Ru)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.69664057 _cell_length_b 10.69664057 _cell_length_c 6.37974923 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho16Er4(Ir3Ru)3 _chemical_formula_sum 'Ho16 Er4 Ir9 Ru3' _cell_volume 729.95890954 _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 Ho Ho0 1 0.29355426 0.08637331 0.38222587 1.0 Ho Ho1 1 0.29354563 0.91419359 0.88249917 1.0 Ho Ho2 1 0.70645437 0.08580641 0.88249917 1.0 Ho Ho3 1 0.70644574 0.91362669 0.38222587 1.0 Ho Ho4 1 0.58580641 0.79354563 0.88249917 1.0 Ho Ho5 1 0.58637331 0.20644574 0.38222587 1.0 Ho Ho6 1 0.41362669 0.79355426 0.38222587 1.0 Ho Ho7 1 0.41419359 0.20645437 0.88249917 1.0 Ho Ho8 1 0.20834982 0.41296353 0.61971963 1.0 Ho Ho9 1 0.20780536 0.58750218 0.11648598 1.0 Ho Ho10 1 0.79219464 0.41249782 0.11648598 1.0 Ho Ho11 1 0.79165018 0.58703647 0.61971963 1.0 Ho Ho12 1 0.91249782 0.70780536 0.11648598 1.0 Ho Ho13 1 0.91296353 0.29165018 0.61971963 1.0 Ho Ho14 1 0.08703647 0.70834982 0.61971963 1.0 Ho Ho15 1 0.08750218 0.29219464 0.11648598 1.0 Er Er16 1 0.00000000 0.00000000 0.49798536 1.0 Er Er17 1 0.00000000 0.00000000 0.99824904 1.0 Er Er18 1 0.50000000 0.50000000 0.99824904 1.0 Er Er19 1 0.50000000 0.50000000 0.49798536 1.0 Ir Ir20 1 0.84824262 0.15227444 0.24938229 1.0 Ir Ir21 1 0.84797425 0.84775002 0.74898636 1.0 Ir Ir22 1 0.15202575 0.15224998 0.74898636 1.0 Ir Ir23 1 0.15175738 0.84772556 0.24938229 1.0 Ir Ir24 1 0.65224998 0.34797425 0.74898636 1.0 Ir Ir25 1 0.65227444 0.65175738 0.24938229 1.0 Ir Ir26 1 0.34772556 0.34824262 0.24938229 1.0 Ir Ir27 1 0.34775002 0.65202575 0.74898636 1.0 Ir Ir28 1 0.00000000 0.50000000 0.37277144 1.0 Ru Ru29 1 0.50000000 0.00000000 0.13348161 1.0 Ru Ru30 1 0.50000000 0.00000000 0.63324078 1.0 Ru Ru31 1 0.00000000 0.50000000 0.87083519 1.0