# generated using pymatgen data_Ta2AlB2Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.22708640 _cell_length_b 9.22708640 _cell_length_c 2.99098964 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta2AlB2Ru5 _chemical_formula_sum 'Ta4 Al2 B4 Ru10' _cell_volume 254.65023570 _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 0.82300900 0.67699100 0.00000000 1.0 Ta Ta1 1 0.17699100 0.32300900 0.00000000 1.0 Ta Ta2 1 0.32300900 0.82300900 0.00000000 1.0 Ta Ta3 1 0.67699100 0.17699100 0.00000000 1.0 Al Al4 1 0.50000000 0.50000000 0.00000000 1.0 Al Al5 1 0.00000000 0.00000000 0.00000000 1.0 B B6 1 0.62484593 0.87515407 0.00000000 1.0 B B7 1 0.37515407 0.12484593 0.00000000 1.0 B B8 1 0.12484593 0.62484593 0.00000000 1.0 B B9 1 0.87515407 0.37515407 0.00000000 1.0 Ru Ru10 1 0.57016779 0.71459212 0.50000000 1.0 Ru Ru11 1 0.42983221 0.28540788 0.50000000 1.0 Ru Ru12 1 0.07016779 0.78540788 0.50000000 1.0 Ru Ru13 1 0.92983221 0.21459212 0.50000000 1.0 Ru Ru14 1 0.28540788 0.57016779 0.50000000 1.0 Ru Ru15 1 0.71459212 0.42983221 0.50000000 1.0 Ru Ru16 1 0.21459212 0.07016779 0.50000000 1.0 Ru Ru17 1 0.78540788 0.92983221 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