# generated using pymatgen data_Ho20IrRu11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.67689842 _cell_length_b 10.67689842 _cell_length_c 6.33207101 _cell_angle_alpha 89.96972758 _cell_angle_beta 89.96972758 _cell_angle_gamma 89.98820914 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho20IrRu11 _chemical_formula_sum 'Ho20 Ir1 Ru11' _cell_volume 721.83156286 _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 0.29201013 0.08639772 0.37702686 1.0 Ho Ho1 1 0.29199089 0.91478871 0.87723233 1.0 Ho Ho2 1 0.70845832 0.08634902 0.87682552 1.0 Ho Ho3 1 0.70851047 0.91373714 0.37697735 1.0 Ho Ho4 1 0.58656066 0.79258798 0.87706179 1.0 Ho Ho5 1 0.58653561 0.20754110 0.37630320 1.0 Ho Ho6 1 0.41383094 0.79269643 0.37733105 1.0 Ho Ho7 1 0.41368708 0.20852369 0.87695735 1.0 Ho Ho8 1 0.20741202 0.41343934 0.62293821 1.0 Ho Ho9 1 0.20730357 0.58616906 0.12266895 1.0 Ho Ho10 1 0.79245890 0.41346439 0.12369680 1.0 Ho Ho11 1 0.79147631 0.58631292 0.62304265 1.0 Ho Ho12 1 0.91360228 0.70798987 0.12297314 1.0 Ho Ho13 1 0.91365098 0.29154168 0.62317448 1.0 Ho Ho14 1 0.08521129 0.70800911 0.62276767 1.0 Ho Ho15 1 0.08626286 0.29148953 0.12302265 1.0 Ho Ho16 1 0.00037646 0.00006742 0.50006401 1.0 Ho Ho17 1 0.99993258 0.99962354 0.99993599 1.0 Ho Ho18 1 0.50133478 0.49964251 0.00109560 1.0 Ho Ho19 1 0.50035749 0.49866522 0.49890440 1.0 Ir Ir20 1 0.34618910 0.65381090 0.75000000 1.0 Ru Ru21 1 0.84673672 0.15326328 0.25000000 1.0 Ru Ru22 1 0.84663453 0.84636491 0.74977205 1.0 Ru Ru23 1 0.15363509 0.15336547 0.75022795 1.0 Ru Ru24 1 0.15422214 0.84577786 0.25000000 1.0 Ru Ru25 1 0.65313919 0.34686081 0.75000000 1.0 Ru Ru26 1 0.65195281 0.65370551 0.25072860 1.0 Ru Ru27 1 0.34629449 0.34804719 0.24927140 1.0 Ru Ru28 1 0.50020329 0.99965376 0.12790586 1.0 Ru Ru29 1 0.50010430 0.00042251 0.62809725 1.0 Ru Ru30 1 0.99957749 0.49989570 0.87190275 1.0 Ru Ru31 1 0.00034624 0.49979671 0.37209414 1.0