data_[K24Ag2Hg12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ag  1.9300  1.6000  1.0867
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [Im-3]
_cell_length_a [12.1417]
_cell_length_b [12.1417]
_cell_length_c [12.1417]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [204]
_chemical_formula_structural [K12AgHg6]
_chemical_formula_sum '[K24 Ag2 Hg12]'
_cell_volume [1789.9215]
_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
[
  K  K0  24  0.0000  0.2862  0.1830  1.0
  Ag  Ag1  2  0.0000  0.0000  0.0000  1.0
  Hg  Hg2  12  0.0000  0.1245  0.5000  1.0
]