# generated using pymatgen data_Tb3(GaIr)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.54366806 _cell_length_b 7.79055535 _cell_length_c 13.66480196 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3(GaIr)2 _chemical_formula_sum 'Tb12 Ga8 Ir8' _cell_volume 590.15892272 _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 0.62219768 0.26457432 0.25000000 1.0 Tb Tb1 1 0.37780232 0.73542568 0.75000000 1.0 Tb Tb2 1 0.37780232 0.76457432 0.25000000 1.0 Tb Tb3 1 0.62219768 0.23542568 0.75000000 1.0 Tb Tb4 1 0.15082814 0.39915641 0.09853254 1.0 Tb Tb5 1 0.84917186 0.60084359 0.90146746 1.0 Tb Tb6 1 0.84917186 0.60084359 0.59853254 1.0 Tb Tb7 1 0.84917186 0.89915641 0.40146746 1.0 Tb Tb8 1 0.15082814 0.39915641 0.40146746 1.0 Tb Tb9 1 0.15082814 0.10084359 0.59853254 1.0 Tb Tb10 1 0.15082814 0.10084359 0.90146746 1.0 Tb Tb11 1 0.84917186 0.89915641 0.09853254 1.0 Ga Ga12 1 0.12122099 0.10679723 0.25000000 1.0 Ga Ga13 1 0.87877901 0.89320277 0.75000000 1.0 Ga Ga14 1 0.87877901 0.60679723 0.25000000 1.0 Ga Ga15 1 0.12122099 0.39320277 0.75000000 1.0 Ga Ga16 1 0.63277255 0.25000000 0.00000000 1.0 Ga Ga17 1 0.36722745 0.75000000 0.00000000 1.0 Ga Ga18 1 0.36722745 0.75000000 0.50000000 1.0 Ga Ga19 1 0.63277255 0.25000000 0.50000000 1.0 Ir Ir20 1 0.35067481 0.03460445 0.09293896 1.0 Ir Ir21 1 0.64932519 0.96539555 0.90706104 1.0 Ir Ir22 1 0.64932519 0.96539555 0.59293896 1.0 Ir Ir23 1 0.64932519 0.53460445 0.40706104 1.0 Ir Ir24 1 0.35067481 0.03460445 0.40706104 1.0 Ir Ir25 1 0.35067481 0.46539555 0.59293896 1.0 Ir Ir26 1 0.35067481 0.46539555 0.90706104 1.0 Ir Ir27 1 0.64932519 0.53460445 0.09293896 1.0