data_[Cd14Hg10]
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
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.2436]
_cell_length_b [3.5360]
_cell_length_c [10.6779]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.5115]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd7Hg5]
_chemical_formula_sum '[Cd14 Hg10]'
_cell_volume [574.4748]
_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  4  0.0853  0.0000  0.7541  1
  Cd  Cd1  4  0.1668  0.5000  0.0009  1
  Cd  Cd2  4  0.2469  0.0000  0.2482  1
  Cd  Cd3  2  0.0000  0.5000  0.5000  1
  Hg  Hg4  4  0.0822  0.5000  0.2526  1
  Hg  Hg5  4  0.1667  0.0000  0.5069  1
  Hg  Hg6  2  0.0000  0.0000  0.0000  1
]