data_[Cd24In8Hg24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [I-43m]
_cell_length_a [11.2649]
_cell_length_b [11.2649]
_cell_length_c [11.2649]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [217]
_chemical_formula_structural [Cd3InHg3]
_chemical_formula_sum '[Cd24 In8 Hg24]'
_cell_volume [1429.5052]
_cell_formula_units_Z [8]
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
[
  Cd  Cd0  24  0.1038  0.1038  0.7013  1
  In  In1  8  0.1078  0.1078  0.1078  1
  Hg  Hg2  24  0.0764  0.3633  0.6367  1
]