data_[Cd16In8Hg4Pb4]
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
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [6.3728]
_cell_length_b [11.1096]
_cell_length_c [12.4647]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [74]
_chemical_formula_structural [Cd4In2HgPb]
_chemical_formula_sum '[Cd16 In8 Hg4 Pb4]'
_cell_volume [882.4836]
_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
[
  Cd  Cd0  8  0.0000  0.0043  0.7542  1.0
  Cd  Cd1  8  0.2421  0.2500  0.9980  1.0
  In  In2  4  0.0000  0.0000  0.0000  1.0
  In  In3  4  0.2500  0.2500  0.2500  1.0
  Hg  Hg4  4  0.2500  0.2500  0.7500  1.0
  Pb  Pb5  4  0.0000  0.0000  0.5000  1.0
]