# generated using pymatgen data_Ta2GaB2Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.23026008 _cell_length_b 9.23026008 _cell_length_c 2.99707763 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta2GaB2Ru5 _chemical_formula_sum 'Ta4 Ga2 B4 Ru10' _cell_volume 255.34412428 _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 Ta Ta0 1 0.82327696 0.67672304 0.00000000 1.0 Ta Ta1 1 0.17672304 0.32327696 0.00000000 1.0 Ta Ta2 1 0.32327696 0.82327696 0.00000000 1.0 Ta Ta3 1 0.67672304 0.17672304 0.00000000 1.0 Ga Ga4 1 0.50000000 0.50000000 0.00000000 1.0 Ga Ga5 1 0.00000000 0.00000000 0.00000000 1.0 B B6 1 0.62504367 0.87495633 0.00000000 1.0 B B7 1 0.37495633 0.12504367 0.00000000 1.0 B B8 1 0.12504367 0.62504367 0.00000000 1.0 B B9 1 0.87495633 0.37495633 0.00000000 1.0 Ru Ru10 1 0.57034313 0.71493182 0.50000000 1.0 Ru Ru11 1 0.42965687 0.28506818 0.50000000 1.0 Ru Ru12 1 0.07034313 0.78506818 0.50000000 1.0 Ru Ru13 1 0.92965687 0.21493182 0.50000000 1.0 Ru Ru14 1 0.28506818 0.57034313 0.50000000 1.0 Ru Ru15 1 0.71493182 0.42965687 0.50000000 1.0 Ru Ru16 1 0.21493182 0.07034313 0.50000000 1.0 Ru Ru17 1 0.78506818 0.92965687 0.50000000 1.0 Ru Ru18 1 0.50000000 0.00000000 0.50000000 1.0 Ru Ru19 1 0.00000000 0.50000000 0.50000000 1.0