# generated using pymatgen data_GdLuB6Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.63047617 _cell_length_b 9.07600949 _cell_length_c 11.46646433 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural GdLuB6Ru _chemical_formula_sum 'Gd4 Lu4 B24 Ru4' _cell_volume 377.82270765 _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 Gd Gd0 1 0.00000000 0.32173027 0.41427921 1.0 Gd Gd1 1 0.00000000 0.67826973 0.58572079 1.0 Gd Gd2 1 0.00000000 0.82173027 0.08572079 1.0 Gd Gd3 1 0.00000000 0.17826973 0.91427921 1.0 Lu Lu4 1 0.00000000 0.94425759 0.37262489 1.0 Lu Lu5 1 0.00000000 0.05574241 0.62737511 1.0 Lu Lu6 1 0.00000000 0.44425759 0.12737511 1.0 Lu Lu7 1 0.00000000 0.55574241 0.87262489 1.0 B B8 1 0.50000000 0.55516627 0.43180799 1.0 B B9 1 0.50000000 0.44483373 0.56819201 1.0 B B10 1 0.50000000 0.05516627 0.06819201 1.0 B B11 1 0.50000000 0.94483373 0.93180799 1.0 B B12 1 0.50000000 0.75014852 0.41855235 1.0 B B13 1 0.50000000 0.24985148 0.58144765 1.0 B B14 1 0.50000000 0.25014852 0.08144765 1.0 B B15 1 0.50000000 0.74985148 0.91855235 1.0 B B16 1 0.50000000 0.79149353 0.26588173 1.0 B B17 1 0.50000000 0.20850647 0.73411827 1.0 B B18 1 0.50000000 0.29149353 0.23411827 1.0 B B19 1 0.50000000 0.70850647 0.76588173 1.0 B B20 1 0.50000000 0.63057199 0.18430137 1.0 B B21 1 0.50000000 0.36942801 0.81569863 1.0 B B22 1 0.50000000 0.13057199 0.31569863 1.0 B B23 1 0.50000000 0.86942801 0.68430137 1.0 B B24 1 0.50000000 0.98382877 0.21373526 1.0 B B25 1 0.50000000 0.01617123 0.78626474 1.0 B B26 1 0.50000000 0.48382877 0.28626474 1.0 B B27 1 0.50000000 0.51617123 0.71373526 1.0 B B28 1 0.50000000 0.60386045 0.02829366 1.0 B B29 1 0.50000000 0.39613955 0.97170634 1.0 B B30 1 0.50000000 0.10386045 0.47170634 1.0 B B31 1 0.50000000 0.89613955 0.52829366 1.0 Ru Ru32 1 0.00000000 0.63926480 0.31953285 1.0 Ru Ru33 1 0.00000000 0.36073520 0.68046715 1.0 Ru Ru34 1 0.00000000 0.13926480 0.18046715 1.0 Ru Ru35 1 0.00000000 0.86073520 0.81953285 1.0