# generated using pymatgen data_Hf3Si4Ir4Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.89431213 _cell_length_b 6.39430246 _cell_length_c 7.29685693 _cell_angle_alpha 90.88725779 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Si4Ir4Ru _chemical_formula_sum 'Hf3 Si4 Ir4 Ru1' _cell_volume 181.68023776 _cell_formula_units_Z 1 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 0.75000000 0.48018525 0.82883625 1.0 Hf Hf1 1 0.25000000 0.01503125 0.31496060 1.0 Hf Hf2 1 0.75000000 0.96901228 0.67388174 1.0 Si Si3 1 0.25000000 0.77440045 0.89148630 1.0 Si Si4 1 0.75000000 0.23889665 0.12676505 1.0 Si Si5 1 0.25000000 0.27108779 0.62042018 1.0 Si Si6 1 0.75000000 0.70473890 0.35977982 1.0 Ir Ir7 1 0.75000000 0.85590820 0.06109493 1.0 Ir Ir8 1 0.25000000 0.15638035 0.93622583 1.0 Ir Ir9 1 0.75000000 0.34356943 0.43799383 1.0 Ir Ir10 1 0.25000000 0.64998837 0.57170755 1.0 Ru Ru11 1 0.25000000 0.54080209 0.17684691 1.0