# generated using pymatgen data_Yb2IrRu3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.14154987 _cell_length_b 5.14170316 _cell_length_c 8.91156927 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.98962605 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb2IrRu3 _chemical_formula_sum 'Yb4 Ir2 Ru6' _cell_volume 204.04749222 _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 Yb Yb0 1 0.66667754 0.33328838 0.56514267 1.0 Yb Yb1 1 0.33332246 0.66671162 0.43485733 1.0 Yb Yb2 1 0.33332246 0.66671162 0.06514267 1.0 Yb Yb3 1 0.66667754 0.33328838 0.93485733 1.0 Ir Ir4 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir5 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru6 1 0.17070659 0.34184972 0.75000000 1.0 Ru Ru7 1 0.17111822 0.82902490 0.75000000 1.0 Ru Ru8 1 0.65810071 0.82933538 0.75000000 1.0 Ru Ru9 1 0.82929341 0.65815028 0.25000000 1.0 Ru Ru10 1 0.82888178 0.17097510 0.25000000 1.0 Ru Ru11 1 0.34189929 0.17066462 0.25000000 1.0