data_[Ni8Pd2W2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Pd  2.2000  1.4000  0.8462
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [4.4991]
_cell_length_b [7.7580]
_cell_length_c [4.4757]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.6574]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ni4PdW]
_chemical_formula_sum '[Ni8 Pd2 W2]'
_cell_volume [148.8613]
_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
[
  Ni  Ni0  4  0.0000  0.1660  0.0000  1.0
  Ni  Ni1  4  0.0000  0.3298  0.5000  1.0
  Pd  Pd2  2  0.0000  0.5000  0.0000  1.0
  W  W3  2  0.0000  0.0000  0.5000  1.0
]