# generated using pymatgen data_Tb5Bi2Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.06300466 _cell_length_b 8.96050737 _cell_length_c 12.52293693 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb5Bi2Ir _chemical_formula_sum 'Tb20 Bi8 Ir4' _cell_volume 904.76481987 _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 Tb Tb0 1 0.84090668 0.75000000 0.79491469 1.0 Tb Tb1 1 0.15909332 0.25000000 0.20508531 1.0 Tb Tb2 1 0.34090668 0.25000000 0.70508531 1.0 Tb Tb3 1 0.65909332 0.75000000 0.29491469 1.0 Tb Tb4 1 0.37698460 0.75000000 0.69483036 1.0 Tb Tb5 1 0.62301540 0.25000000 0.30516964 1.0 Tb Tb6 1 0.87698460 0.25000000 0.80516964 1.0 Tb Tb7 1 0.12301540 0.75000000 0.19483036 1.0 Tb Tb8 1 0.94515707 0.75000000 0.50138754 1.0 Tb Tb9 1 0.05484293 0.25000000 0.49861246 1.0 Tb Tb10 1 0.44515707 0.25000000 0.99861246 1.0 Tb Tb11 1 0.55484293 0.75000000 0.00138754 1.0 Tb Tb12 1 0.67602993 0.04261627 0.56504743 1.0 Tb Tb13 1 0.32397007 0.95738373 0.43495257 1.0 Tb Tb14 1 0.17602993 0.95738373 0.93495257 1.0 Tb Tb15 1 0.32397007 0.54261627 0.43495257 1.0 Tb Tb16 1 0.82397007 0.04261627 0.06504743 1.0 Tb Tb17 1 0.67602993 0.45738373 0.56504743 1.0 Tb Tb18 1 0.82397007 0.45738373 0.06504743 1.0 Tb Tb19 1 0.17602993 0.54261627 0.93495257 1.0 Bi Bi20 1 0.56811659 0.49023499 0.82738638 1.0 Bi Bi21 1 0.43188341 0.50976501 0.17261362 1.0 Bi Bi22 1 0.06811659 0.50976501 0.67261362 1.0 Bi Bi23 1 0.43188341 0.99023499 0.17261362 1.0 Bi Bi24 1 0.93188341 0.49023499 0.32738638 1.0 Bi Bi25 1 0.56811659 0.00976501 0.82738638 1.0 Bi Bi26 1 0.93188341 0.00976501 0.32738638 1.0 Bi Bi27 1 0.06811659 0.99023499 0.67261362 1.0 Ir Ir28 1 0.57146045 0.75000000 0.51041580 1.0 Ir Ir29 1 0.42853955 0.25000000 0.48958420 1.0 Ir Ir30 1 0.07146045 0.25000000 0.98958420 1.0 Ir Ir31 1 0.92853955 0.75000000 0.01041580 1.0