data_[Cs12Hg4Au2F2]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.7186]
_cell_length_b [9.6311]
_cell_length_c [15.4030]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.8516]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Cs6Hg2AuF]
_chemical_formula_sum '[Cs12 Hg4 Au2 F2]'
_cell_volume [1074.1393]
_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  0.1325  0.5185  0.2302  1.0
  Cs  Cs1  4  0.2177  0.2068  0.0487  1.0
  Cs  Cs2  4  0.3418  0.6771  0.0450  1.0
  Hg  Hg3  4  0.2935  0.5916  0.7504  1.0
  Au  Au4  2  0.5000  0.0000  0.0000  1.0
  F  F5  2  0.0000  0.0000  0.5000  1.0
]