data_[Al20Ag4Te32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [11.7366]
_cell_length_b [11.7366]
_cell_length_c [11.7366]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [216]
_chemical_formula_structural [Al5AgTe8]
_chemical_formula_sum '[Al20 Ag4 Te32]'
_cell_volume [1616.6706]
_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  16  0.1182  0.1182  0.6182  1
  Al  Al1  4  0.0000  0.0000  0.0000  1
  Ag  Ag2  4  0.2500  0.2500  0.2500  1
  Te  Te3  16  0.1157  0.1157  0.3843  1
  Te  Te4  16  0.1344  0.1344  0.8656  1
]