# generated using pymatgen data_Hf2ZrB2Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.47286028 _cell_length_b 9.47286028 _cell_length_c 3.11032538 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.26604357 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf2ZrB2Ru5 _chemical_formula_sum 'Hf4 Zr2 B4 Ru10' _cell_volume 279.10229381 _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 Hf Hf0 1 0.32523177 0.82523177 0.00000000 1.0 Hf Hf1 1 0.67476823 0.17476823 0.00000000 1.0 Hf Hf2 1 0.50000000 0.50000000 0.00000000 1.0 Hf Hf3 1 0.00000000 0.00000000 0.00000000 1.0 Zr Zr4 1 0.82398142 0.67601858 0.00000000 1.0 Zr Zr5 1 0.17601858 0.32398142 0.00000000 1.0 B B6 1 0.62135202 0.87864798 0.00000000 1.0 B B7 1 0.37864798 0.12135202 0.00000000 1.0 B B8 1 0.12201195 0.62201195 0.00000000 1.0 B B9 1 0.87798805 0.37798805 0.00000000 1.0 Ru Ru10 1 0.56994430 0.72098918 0.50000000 1.0 Ru Ru11 1 0.43005570 0.27901082 0.50000000 1.0 Ru Ru12 1 0.07393636 0.78028496 0.50000000 1.0 Ru Ru13 1 0.92606364 0.21971504 0.50000000 1.0 Ru Ru14 1 0.28028496 0.57393636 0.50000000 1.0 Ru Ru15 1 0.71971504 0.42606364 0.50000000 1.0 Ru Ru16 1 0.22098918 0.06994430 0.50000000 1.0 Ru Ru17 1 0.77901082 0.93005570 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