# generated using pymatgen
data_IrRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.72491168
_cell_length_b   2.72491049
_cell_length_c   4.33069764
_cell_angle_alpha   89.97215012
_cell_angle_beta   90.02784866
_cell_angle_gamma   120.00235785
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrRu
_chemical_formula_sum   'Ir1 Ru1'
_cell_volume   27.84727983
_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
  Ir  Ir0  1  0.66665862  0.33333938  0.75000809  1.0
  Ru  Ru1  1  0.33333938  0.66665862  0.24998991  1.0