data_[Al16Ga4W4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Ga  1.8100  1.3000  0.7600
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [5.6340]
_cell_length_b [7.0483]
_cell_length_c [11.1009]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [74]
_chemical_formula_structural [Al4GaW]
_chemical_formula_sum '[Al16 Ga4 W4]'
_cell_volume [440.8210]
_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
[
  Al  Al0  8  0.2255  0.0000  0.0000  1
  Al  Al1  8  0.2500  0.0234  0.7500  1
  Ga  Ga2  4  0.0000  0.2500  0.6008  1
  W  W3  4  0.0000  0.2500  0.1551  1
]