data_[Hf20In8Pb4]
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
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [7.5751]
_cell_length_b [7.5751]
_cell_length_c [12.6283]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [Hf5In2Pb]
_chemical_formula_sum '[Hf20 In8 Pb4]'
_cell_volume [724.6316]
_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  0.1516  0.3484  0.3406  1.0
  Hf  Hf1  4  0.0000  0.0000  0.0000  1.0
  In  In2  8  0.1438  0.6438  0.5000  1.0
  Pb  Pb3  4  0.0000  0.0000  0.2500  1.0
]