data_[Na3Cd12Hg24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Cd  1.6900  1.5500  1.0900
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [6.8488]
_cell_length_b [6.8488]
_cell_length_c [27.1344]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Na(CdHg2)4]
_chemical_formula_sum '[Na3 Cd12 Hg24]'
_cell_volume [1102.2368]
_cell_formula_units_Z [3]
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
[
  Na  Na0  3  0.0000  0.0000  0.0000  1.0
  Cd  Cd1  9  0.0000  0.5000  0.0000  1.0
  Cd  Cd2  3  -0.0000  -0.0000  0.5000  1.0
  Hg  Hg3  18  0.0247  0.5123  0.7595  1.0
  Hg  Hg4  6  0.0000  0.0000  0.2078  1.0
]