data_[Al34W24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [I-43m]
_cell_length_a [9.7615]
_cell_length_b [9.7615]
_cell_length_c [9.7615]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [217]
_chemical_formula_structural [Al17W12]
_chemical_formula_sum '[Al34 W24]'
_cell_volume [930.1378]
_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
[
  Al  Al0  24  0.0993  0.0993  0.7115  1
  Al  Al1  8  0.1722  0.8278  0.8278  1
  Al  Al2  2  0.0000  0.0000  0.0000  1
  W  W3  24  0.0576  0.3723  0.6277  1
]