# generated using pymatgen data_Pr2B8Ru7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.44800252 _cell_length_b 6.44800252 _cell_length_c 10.06434946 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr2B8Ru7 _chemical_formula_sum 'Pr4 B16 Ru14' _cell_volume 418.44280505 _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 Pr Pr0 1 0.73421672 0.87720384 0.00000000 1.0 Pr Pr1 1 0.12279616 0.73421672 0.50000000 1.0 Pr Pr2 1 0.87720384 0.26578328 0.50000000 1.0 Pr Pr3 1 0.26578328 0.12279616 0.00000000 1.0 B B4 1 0.50000000 0.00000000 0.58905568 1.0 B B5 1 0.50000000 0.00000000 0.41094432 1.0 B B6 1 0.89640692 0.27509978 0.17053734 1.0 B B7 1 0.10359308 0.72490022 0.82946266 1.0 B B8 1 0.50000000 0.50000000 0.34168874 1.0 B B9 1 0.50000000 0.50000000 0.84168874 1.0 B B10 1 0.27509978 0.10359308 0.67053734 1.0 B B11 1 0.10359308 0.72490022 0.17053734 1.0 B B12 1 0.27509978 0.10359308 0.32946266 1.0 B B13 1 0.89640692 0.27509978 0.82946266 1.0 B B14 1 0.50000000 0.50000000 0.65831126 1.0 B B15 1 0.50000000 0.50000000 0.15831126 1.0 B B16 1 0.00000000 0.50000000 0.91094432 1.0 B B17 1 0.72490022 0.89640692 0.67053734 1.0 B B18 1 0.72490022 0.89640692 0.32946266 1.0 B B19 1 0.00000000 0.50000000 0.08905568 1.0 Ru Ru20 1 0.20454315 0.40042941 0.75242990 1.0 Ru Ru21 1 0.39804273 0.28513493 0.50000000 1.0 Ru Ru22 1 0.40042941 0.79545685 0.25242990 1.0 Ru Ru23 1 0.20454315 0.40042941 0.24757010 1.0 Ru Ru24 1 0.60195727 0.71486507 0.50000000 1.0 Ru Ru25 1 0.59957059 0.20454315 0.74757010 1.0 Ru Ru26 1 0.28513493 0.60195727 0.00000000 1.0 Ru Ru27 1 0.71486507 0.39804273 0.00000000 1.0 Ru Ru28 1 0.79545685 0.59957059 0.24757010 1.0 Ru Ru29 1 0.79545685 0.59957059 0.75242990 1.0 Ru Ru30 1 0.40042941 0.79545685 0.74757010 1.0 Ru Ru31 1 0.00000000 0.00000000 0.25000000 1.0 Ru Ru32 1 0.59957059 0.20454315 0.25242990 1.0 Ru Ru33 1 0.00000000 0.00000000 0.75000000 1.0