data_[Hf20In8Sn4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [7.5322]
_cell_length_b [7.5322]
_cell_length_c [12.5879]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [Hf5In2Sn]
_chemical_formula_sum '[Hf20 In8 Sn4]'
_cell_volume [714.1611]
_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
[
  Hf  Hf0  16  0.1532  0.3468  0.6602  1.0
  Hf  Hf1  4  0.0000  0.0000  0.0000  1.0
  In  In2  8  0.1425  0.3575  0.0000  1.0
  Sn  Sn3  4  0.0000  0.0000  0.2500  1.0
]