# generated using pymatgen data_Tb2TaOs3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.59400653 _cell_length_b 5.59400571 _cell_length_c 8.33757855 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00262711 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb2TaOs3 _chemical_formula_sum 'Tb4 Ta2 Os6' _cell_volume 225.94615074 _cell_formula_units_Z 2 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 0.66666939 0.33333061 0.56580744 1.0 Tb Tb1 1 0.33333061 0.66666939 0.43419256 1.0 Tb Tb2 1 0.33333061 0.66666939 0.06580744 1.0 Tb Tb3 1 0.66666939 0.33333061 0.93419256 1.0 Ta Ta4 1 0.00000000 0.00000000 0.50000000 1.0 Ta Ta5 1 0.00000000 0.00000000 0.00000000 1.0 Os Os6 1 0.17332007 0.34662807 0.75000000 1.0 Os Os7 1 0.17330390 0.82669610 0.75000000 1.0 Os Os8 1 0.65337193 0.82667993 0.75000000 1.0 Os Os9 1 0.82667993 0.65337193 0.25000000 1.0 Os Os10 1 0.82669610 0.17330390 0.25000000 1.0 Os Os11 1 0.34662807 0.17332007 0.25000000 1.0