data_[Cs12Hg4Au4O2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.5225]
_cell_length_b [15.3501]
_cell_length_c [9.5572]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.7827]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs6Hg2Au2O]
_chemical_formula_sum '[Cs12 Hg4 Au4 O2]'
_cell_volume [1161.0057]
_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  0.2167  0.1370  0.6940  1.0
  Cs  Cs1  4  0.2045  0.0000  0.3103  1.0
  Hg  Hg2  4  0.0000  0.1944  0.0000  1.0
  Au  Au3  4  0.0000  0.3294  0.5000  1.0
  O  O4  2  0.0000  0.0000  0.5000  1.0
]