data_[V2Ir2Ru4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Ir  2.2000  1.3500  0.7650
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.6886]
_cell_length_b [5.1215]
_cell_length_c [5.1358]
_cell_angle_alpha [64.5653]
_cell_angle_beta [89.9168]
_cell_angle_gamma [89.8802]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [VIrRu2]
_chemical_formula_sum '[V2 Ir2 Ru4]'
_cell_volume [111.3706]
_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
[
  V  V0  1  0.1991  0.5706  0.0971  1.0
  V  V1  1  0.8538  0.3062  0.8316  1.0
  Ir  Ir2  1  0.1938  0.0646  0.5916  1.0
  Ir  Ir3  1  0.3515  0.5627  0.5946  1.0
  Ru  Ru4  1  0.3515  0.0648  0.0916  1.0
  Ru  Ru5  1  0.7054  0.3150  0.3366  1.0
  Ru  Ru6  1  0.7061  0.8106  0.8400  1.0
  Ru  Ru7  1  0.8641  0.8151  0.3349  1.0
]