data_[V2Pd2Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Pd  2.2000  1.4000  0.8462
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.5029]
_cell_length_b [2.9219]
_cell_length_c [6.5826]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.9441]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [VPdRu]
_chemical_formula_sum '[V2 Pd2 Ru2]'
_cell_volume [85.7761]
_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  2  0.2755  0.5000  0.6663  1.0
  Ru  Ru1  2  0.2241  0.0000  0.3593  1.0
  Pd  Pd2  1  0.0000  0.5000  0.0000  1.0
  Pd  Pd3  1  0.5000  0.0000  0.0000  1.0
]