# generated using pymatgen data_Tb20(Ir3Os)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.83292714 _cell_length_b 10.83292714 _cell_length_c 6.43468341 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb20(Ir3Os)3 _chemical_formula_sum 'Tb20 Ir9 Os3' _cell_volume 755.12496422 _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 0.29425802 0.08706362 0.38317379 1.0 Tb Tb1 1 0.29429267 0.91375870 0.88360198 1.0 Tb Tb2 1 0.70570733 0.08624130 0.88360198 1.0 Tb Tb3 1 0.70574198 0.91293638 0.38317379 1.0 Tb Tb4 1 0.58624130 0.79429267 0.88360198 1.0 Tb Tb5 1 0.58706362 0.20574198 0.38317379 1.0 Tb Tb6 1 0.41293638 0.79425802 0.38317379 1.0 Tb Tb7 1 0.41375870 0.20570733 0.88360198 1.0 Tb Tb8 1 0.20788356 0.41279821 0.61934064 1.0 Tb Tb9 1 0.20700395 0.58781095 0.11503080 1.0 Tb Tb10 1 0.79299605 0.41218905 0.11503080 1.0 Tb Tb11 1 0.79211644 0.58720179 0.61934064 1.0 Tb Tb12 1 0.91218905 0.70700395 0.11503080 1.0 Tb Tb13 1 0.91279821 0.29211644 0.61934064 1.0 Tb Tb14 1 0.08720179 0.70788356 0.61934064 1.0 Tb Tb15 1 0.08781095 0.29299605 0.11503080 1.0 Tb Tb16 1 0.00000000 0.00000000 0.49821617 1.0 Tb Tb17 1 0.00000000 0.00000000 0.99851989 1.0 Tb Tb18 1 0.50000000 0.50000000 0.99851989 1.0 Tb Tb19 1 0.50000000 0.50000000 0.49821617 1.0 Ir Ir20 1 0.84920832 0.15352090 0.24943638 1.0 Ir Ir21 1 0.84823075 0.84730607 0.74917625 1.0 Ir Ir22 1 0.15176925 0.15269393 0.74917625 1.0 Ir Ir23 1 0.15079168 0.84647910 0.24943638 1.0 Ir Ir24 1 0.65269393 0.34823075 0.74917625 1.0 Ir Ir25 1 0.65352090 0.65079168 0.24943638 1.0 Ir Ir26 1 0.34647910 0.34920832 0.24943638 1.0 Ir Ir27 1 0.34730607 0.65176925 0.74917625 1.0 Ir Ir28 1 0.00000000 0.50000000 0.37382101 1.0 Os Os29 1 0.50000000 0.00000000 0.13175361 1.0 Os Os30 1 0.50000000 0.00000000 0.63109924 1.0 Os Os31 1 0.00000000 0.50000000 0.87081366 1.0