data_[Cs1H1Au1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  H  2.2000  0.2500  0.0000
  Au  2.5400  1.3500  1.0700
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0427]
_cell_length_b [5.1273]
_cell_length_c [6.3950]
_cell_angle_alpha [94.1009]
_cell_angle_beta [95.0066]
_cell_angle_gamma [105.9359]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsHAuF6]
_chemical_formula_sum '[Cs1 H1 Au1 F6]'
_cell_volume [157.5988]
_cell_formula_units_Z [1]
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  1  0.0000  0.5000  0.5000  1.0
  H  H1  1  0.0000  0.5000  0.0000  1.0
  Au  Au2  1  0.5000  0.0000  0.0000  1.0
  F  F3  2  0.0949  0.7219  0.0727  1.0
  F  F4  2  0.3219  0.0861  0.7363  1.0
  F  F5  2  0.4322  0.2980  0.1787  1.0
]