data_[Cd8In4Hg20Pb4]
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 [Cmc2_1]
_cell_length_a [3.4926]
_cell_length_b [16.3940]
_cell_length_c [16.7156]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Cd2InHg5Pb]
_chemical_formula_sum '[Cd8 In4 Hg20 Pb4]'
_cell_volume [957.1074]
_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  4  0.0000  0.0792  0.7285  1.0
  Cd  Cd1  4  0.0000  0.1244  0.4076  1.0
  In  In2  4  0.0000  0.2171  0.9643  1.0
  Hg  Hg3  4  0.0000  0.0586  0.0850  1.0
  Hg  Hg4  4  0.0000  0.2657  0.6282  1.0
  Hg  Hg5  4  0.0000  0.2711  0.2897  1.0
  Hg  Hg6  4  0.0000  0.3936  0.0693  1.0
  Hg  Hg7  4  0.0000  0.4119  0.7485  1.0
  Pb  Pb8  4  0.0000  0.4543  0.4029  1.0
]