# generated using pymatgen data_Tb3(GaRu)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.52410751 _cell_length_b 7.64148863 _cell_length_c 13.89386156 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3(GaRu)2 _chemical_formula_sum 'Tb12 Ga8 Ru8' _cell_volume 586.49330736 _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 0.84650483 0.90215180 0.59546114 1.0 Tb Tb1 1 0.15349517 0.40215180 0.90453886 1.0 Tb Tb2 1 0.84650483 0.59784820 0.09546114 1.0 Tb Tb3 1 0.62062048 0.26462048 0.75000000 1.0 Tb Tb4 1 0.62062048 0.23537952 0.25000000 1.0 Tb Tb5 1 0.84650483 0.59784820 0.40453886 1.0 Tb Tb6 1 0.37937952 0.73537952 0.25000000 1.0 Tb Tb7 1 0.15349517 0.09784820 0.09546114 1.0 Tb Tb8 1 0.15349517 0.09784820 0.40453886 1.0 Tb Tb9 1 0.37937952 0.76462048 0.75000000 1.0 Tb Tb10 1 0.15349517 0.40215180 0.59546114 1.0 Tb Tb11 1 0.84650483 0.90215180 0.90453886 1.0 Ga Ga12 1 0.36942871 0.75000000 0.50000000 1.0 Ga Ga13 1 0.36942871 0.75000000 0.00000000 1.0 Ga Ga14 1 0.12583652 0.10576610 0.75000000 1.0 Ga Ga15 1 0.63057129 0.25000000 0.50000000 1.0 Ga Ga16 1 0.12583652 0.39423390 0.25000000 1.0 Ga Ga17 1 0.87416348 0.89423390 0.25000000 1.0 Ga Ga18 1 0.87416348 0.60576610 0.75000000 1.0 Ga Ga19 1 0.63057129 0.25000000 0.00000000 1.0 Ru Ru20 1 0.35403730 0.03444440 0.90621201 1.0 Ru Ru21 1 0.35403730 0.46555560 0.09378799 1.0 Ru Ru22 1 0.64596270 0.96555560 0.09378799 1.0 Ru Ru23 1 0.64596270 0.53444440 0.90621201 1.0 Ru Ru24 1 0.64596270 0.96555560 0.40621201 1.0 Ru Ru25 1 0.64596270 0.53444440 0.59378799 1.0 Ru Ru26 1 0.35403730 0.46555560 0.40621201 1.0 Ru Ru27 1 0.35403730 0.03444440 0.59378799 1.0