data_[Cd8Hg3Pb1]
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 [P1]
_cell_length_a [5.8621]
_cell_length_b [5.9473]
_cell_length_c [10.1525]
_cell_angle_alpha [73.8702]
_cell_angle_beta [75.3270]
_cell_angle_gamma [60.7154]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Cd8Hg3Pb]
_chemical_formula_sum '[Cd8 Hg3 Pb1]'
_cell_volume [293.6420]
_cell_formula_units_Z [1]
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  1  0.0146  0.4853  0.8907  1
  Cd  Cd1  1  0.0565  0.5670  0.3058  1
  Cd  Cd2  1  0.4681  0.3075  0.0672  1
  Cd  Cd3  1  0.4873  0.0015  0.3646  1
  Cd  Cd4  1  0.5155  0.6016  0.7598  1
  Cd  Cd5  1  0.5819  0.0435  0.8195  1
  Cd  Cd6  1  0.9084  0.8252  0.5545  1
  Cd  Cd7  1  0.9673  0.1476  0.2422  1
  Hg  Hg8  1  0.0551  0.9267  0.9830  1
  Hg  Hg9  1  0.5229  0.4547  0.4889  1
  Hg  Hg10  1  0.5697  0.7116  0.1369  1
  Pb  Pb11  1  0.1028  0.1778  0.6368  1
]