# generated using pymatgen data_Ho17Zr2InIr12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.73868367 _cell_length_b 10.73868367 _cell_length_c 6.23458321 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho17Zr2InIr12 _chemical_formula_sum 'Ho17 Zr2 In1 Ir12' _cell_volume 718.96793988 _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 0.28412046 0.08248633 0.38044376 1.0 Ho Ho1 1 0.29218943 0.91093810 0.88008016 1.0 Ho Ho2 1 0.70781057 0.08906190 0.88008016 1.0 Ho Ho3 1 0.71587954 0.91751367 0.38044376 1.0 Ho Ho4 1 0.58811925 0.78992955 0.88068742 1.0 Ho Ho5 1 0.58552927 0.21007967 0.37656345 1.0 Ho Ho6 1 0.41447073 0.78992033 0.37656345 1.0 Ho Ho7 1 0.41188075 0.21007045 0.88068742 1.0 Ho Ho8 1 0.21007967 0.41447073 0.62343655 1.0 Ho Ho9 1 0.21007045 0.58811925 0.11931258 1.0 Ho Ho10 1 0.78992955 0.41188075 0.11931258 1.0 Ho Ho11 1 0.78992033 0.58552927 0.62343655 1.0 Ho Ho12 1 0.91093810 0.70781057 0.11991984 1.0 Ho Ho13 1 0.91751367 0.28412046 0.61955624 1.0 Ho Ho14 1 0.08248633 0.71587954 0.61955624 1.0 Ho Ho15 1 0.08906190 0.29218943 0.11991984 1.0 Ho Ho16 1 0.00000000 0.00000000 0.00000000 1.0 Zr Zr17 1 0.50000000 0.50000000 0.00000000 1.0 Zr Zr18 1 0.50000000 0.50000000 0.50000000 1.0 In In19 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir20 1 0.84523163 0.15814363 0.24359294 1.0 Ir Ir21 1 0.84185637 0.84523163 0.75640706 1.0 Ir Ir22 1 0.15814363 0.15476837 0.75640706 1.0 Ir Ir23 1 0.15476837 0.84185637 0.24359294 1.0 Ir Ir24 1 0.64420973 0.35653641 0.74690300 1.0 Ir Ir25 1 0.64346359 0.64420973 0.25309700 1.0 Ir Ir26 1 0.35653641 0.35579027 0.25309700 1.0 Ir Ir27 1 0.35579027 0.64346359 0.74690300 1.0 Ir Ir28 1 0.50000000 0.00000000 0.12795075 1.0 Ir Ir29 1 0.50000000 0.00000000 0.62329464 1.0 Ir Ir30 1 0.00000000 0.50000000 0.87204925 1.0 Ir Ir31 1 0.00000000 0.50000000 0.37670536 1.0