# generated using pymatgen data_Tb16Ho4Ir7Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.77462549 _cell_length_b 10.77462533 _cell_length_c 6.43903872 _cell_angle_alpha 89.97884467 _cell_angle_beta 89.97884446 _cell_angle_gamma 90.02723567 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb16Ho4Ir7Ru5 _chemical_formula_sum 'Tb16 Ho4 Ir7 Ru5' _cell_volume 747.52425549 _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 Tb Tb0 1 0.29363324 0.08711671 0.38393490 1.0 Tb Tb1 1 0.29272757 0.91345018 0.88410914 1.0 Tb Tb2 1 0.70824971 0.08736360 0.88371639 1.0 Tb Tb3 1 0.70770577 0.91375093 0.38288089 1.0 Tb Tb4 1 0.58700461 0.79352320 0.88344469 1.0 Tb Tb5 1 0.58801671 0.20736396 0.38439465 1.0 Tb Tb6 1 0.41345897 0.79395639 0.38363485 1.0 Tb Tb7 1 0.41345703 0.20658696 0.88396175 1.0 Tb Tb8 1 0.20647680 0.41299539 0.61655531 1.0 Tb Tb9 1 0.20604361 0.58654103 0.11636515 1.0 Tb Tb10 1 0.79263604 0.41198329 0.11560535 1.0 Tb Tb11 1 0.79341304 0.58654297 0.61603825 1.0 Tb Tb12 1 0.91288329 0.70636676 0.11606510 1.0 Tb Tb13 1 0.91263640 0.29175029 0.61628361 1.0 Tb Tb14 1 0.08654982 0.70727243 0.61589086 1.0 Tb Tb15 1 0.08624907 0.29229423 0.11711911 1.0 Ho Ho16 1 0.99982772 0.00129777 0.49897093 1.0 Ho Ho17 1 0.99870223 0.00017228 0.00102907 1.0 Ho Ho18 1 0.49959933 0.50012652 0.00008925 1.0 Ho Ho19 1 0.49987348 0.50040067 0.49991075 1.0 Ir Ir20 1 0.84892934 0.84776901 0.74902302 1.0 Ir Ir21 1 0.15223099 0.15107066 0.75097698 1.0 Ir Ir22 1 0.15160106 0.84839894 0.25000000 1.0 Ir Ir23 1 0.65041079 0.34958921 0.75000000 1.0 Ir Ir24 1 0.65116441 0.65126977 0.24966514 1.0 Ir Ir25 1 0.34873023 0.34883559 0.25033486 1.0 Ir Ir26 1 0.34865887 0.65134113 0.75000000 1.0 Ru Ru27 1 0.84900566 0.15099434 0.25000000 1.0 Ru Ru28 1 0.50095589 0.00057725 0.13140713 1.0 Ru Ru29 1 0.50020084 0.00045427 0.63152505 1.0 Ru Ru30 1 0.99954573 0.49979916 0.86847495 1.0 Ru Ru31 1 0.99942275 0.49904411 0.36859287 1.0