data_[Cs16K4Au2]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [27.0393]
_cell_length_b [8.1190]
_cell_length_c [9.6124]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.4128]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs8K2Au]
_chemical_formula_sum '[Cs16 K4 Au2]'
_cell_volume [2013.5119]
_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  4  0.0074  0.0000  0.7794  1.0
  Cs  Cs1  4  0.0852  0.5000  0.3902  1.0
  Cs  Cs2  4  0.1252  0.5000  0.9447  1.0
  Cs  Cs3  4  0.2116  0.0000  0.2762  1.0
  K  K4  4  0.1775  0.0000  0.7245  1.0
  Au  Au5  2  0.0000  0.5000  0.0000  1.0
]