data_[K2Cd3Hg6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Cd  1.6900  1.5500  1.0900
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P-62m]
_cell_length_a [8.7584]
_cell_length_b [8.7584]
_cell_length_c [5.1920]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [189]
_chemical_formula_structural [K2(CdHg2)3]
_chemical_formula_sum '[K2 Cd3 Hg6]'
_cell_volume [344.9191]
_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
[
  K  K0  2  0.3333  0.6667  0.0000  1.0
  Cd  Cd1  3  0.0000  0.3553  0.5000  1.0
  Hg  Hg2  3  0.0000  0.1971  0.0000  1.0
  Hg  Hg3  3  0.0000  0.6851  0.5000  1.0
]