# generated using pymatgen data_Lu2TaB2Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.53723851 _cell_length_b 9.53723851 _cell_length_c 3.09278304 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu2TaB2Ru5 _chemical_formula_sum 'Lu4 Ta2 B4 Ru10' _cell_volume 281.31619999 _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 Lu Lu0 1 0.82524455 0.67475545 0.00000000 1.0 Lu Lu1 1 0.17475545 0.32524455 0.00000000 1.0 Lu Lu2 1 0.32524455 0.82524455 0.00000000 1.0 Lu Lu3 1 0.67475545 0.17475545 0.00000000 1.0 Ta Ta4 1 0.50000000 0.50000000 0.00000000 1.0 Ta Ta5 1 0.00000000 0.00000000 0.00000000 1.0 B B6 1 0.62081545 0.87918455 0.00000000 1.0 B B7 1 0.37918455 0.12081545 0.00000000 1.0 B B8 1 0.12081545 0.62081545 0.00000000 1.0 B B9 1 0.87918455 0.37918455 0.00000000 1.0 Ru Ru10 1 0.57204225 0.71732561 0.50000000 1.0 Ru Ru11 1 0.42795775 0.28267439 0.50000000 1.0 Ru Ru12 1 0.07204225 0.78267439 0.50000000 1.0 Ru Ru13 1 0.92795775 0.21732561 0.50000000 1.0 Ru Ru14 1 0.28267439 0.57204225 0.50000000 1.0 Ru Ru15 1 0.71732561 0.42795775 0.50000000 1.0 Ru Ru16 1 0.21732561 0.07204225 0.50000000 1.0 Ru Ru17 1 0.78267439 0.92795775 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