data_[V8Ir4Ru4]
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 [C2/m]
_cell_length_a [8.8476]
_cell_length_b [5.7018]
_cell_length_c [4.4273]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.5069]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [V2IrRu]
_chemical_formula_sum '[V8 Ir4 Ru4]'
_cell_volume [221.4305]
_cell_formula_units_Z [4]
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  8  0.1429  0.2473  0.2874  1.0
  Ir  Ir1  4  0.1083  0.5000  0.7824  1.0
  Ru  Ru2  4  0.1113  0.0000  0.7809  1.0
]