data_[Cd24Hg10Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Hg  2.0000  1.5000  1.2450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.0165]
_cell_length_b [6.9786]
_cell_length_c [8.8814]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.6328]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd12Hg5Pb2]
_chemical_formula_sum '[Cd24 Hg10 Pb4]'
_cell_volume [1029.1557]
_cell_formula_units_Z [2]
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  0.1429  0.2460  0.6099  1.0
  Cd  Cd1  8  0.2057  0.2335  0.1317  1.0
  Cd  Cd2  4  0.0251  0.5000  0.3410  1.0
  Cd  Cd3  4  0.1070  0.0000  0.2919  1.0
  Hg  Hg4  4  0.1389  0.5000  0.8794  1.0
  Hg  Hg5  4  0.2118  0.5000  0.4027  1.0
  Hg  Hg6  2  0.0000  0.0000  0.5000  1.0
  Pb  Pb7  4  0.0000  0.2504  0.0000  1.0
]