# generated using pymatgen data_Ho5Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.33243610 _cell_length_b 10.76892899 _cell_length_c 10.76874243 _cell_angle_alpha 89.99956638 _cell_angle_beta 89.99907036 _cell_angle_gamma 90.00021274 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho5Ir3 _chemical_formula_sum 'Ho20 Ir12' _cell_volume 734.35882583 _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 0.38386296 0.83826245 0.54192450 1.0 Ho Ho1 1 0.88386038 0.66174419 0.54191263 1.0 Ho Ho2 1 0.88387103 0.83826568 0.95807406 1.0 Ho Ho3 1 0.38386858 0.66173731 0.95808652 1.0 Ho Ho4 1 0.88387161 0.54195692 0.83828662 1.0 Ho Ho5 1 0.38385457 0.95804495 0.83827257 1.0 Ho Ho6 1 0.38386971 0.54196171 0.66170619 1.0 Ho Ho7 1 0.88385379 0.95803788 0.66171562 1.0 Ho Ho8 1 0.61614160 0.16171543 0.45803159 1.0 Ho Ho9 1 0.11614106 0.33828009 0.45804730 1.0 Ho Ho10 1 0.11613594 0.16171247 0.04196876 1.0 Ho Ho11 1 0.61613530 0.33828737 0.04195414 1.0 Ho Ho12 1 0.11612754 0.45808309 0.16173484 1.0 Ho Ho13 1 0.61614117 0.04191674 0.16174950 1.0 Ho Ho14 1 0.61612635 0.45807764 0.33827078 1.0 Ho Ho15 1 0.11614204 0.04192146 0.33826127 1.0 Ho Ho16 1 0.50000704 0.74999169 0.25000009 1.0 Ho Ho17 1 -0.00000542 0.74999247 0.24999598 1.0 Ho Ho18 1 0.00001291 0.25000577 0.75000385 1.0 Ho Ho19 1 0.49998020 0.25000452 0.75000035 1.0 Ir Ir20 1 0.24999934 0.90348985 0.09651762 1.0 Ir Ir21 1 0.75000458 0.59652003 0.09652022 1.0 Ir Ir22 1 0.74999928 0.90349410 0.40349277 1.0 Ir Ir23 1 0.24999643 0.59651615 0.40349516 1.0 Ir Ir24 1 0.75000395 0.09648380 0.90350000 1.0 Ir Ir25 1 0.25000333 0.40350032 0.90350145 1.0 Ir Ir26 1 0.24999903 0.09648433 0.59648926 1.0 Ir Ir27 1 0.74999253 0.40350292 0.59648495 1.0 Ir Ir28 1 0.13063226 0.74999850 0.75000023 1.0 Ir Ir29 1 0.63063235 0.74999929 0.75000092 1.0 Ir Ir30 1 0.86936848 0.25000474 0.24999885 1.0 Ir Ir31 1 0.36937007 0.25000414 0.24999840 1.0