data_[Cs8K4Hg4Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  K  0.8200  2.2000  1.5200
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.3794]
_cell_length_b [9.7929]
_cell_length_c [7.5831]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.2457]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs4K2Hg2Au]
_chemical_formula_sum '[Cs8 K4 Hg4 Au2]'
_cell_volume [1120.1555]
_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
[
  Cs  Cs0  8  0.1113  0.2384  0.2845  1
  K  K1  4  0.1566  0.5000  0.8355  1
  Hg  Hg2  4  0.1608  0.0000  0.7732  1
  Au  Au3  2  0.0000  0.0000  0.5000  1
]