data_[Au4Cl4F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.7300]
_cell_length_b [7.0496]
_cell_length_c [8.7967]
_cell_angle_alpha [86.2626]
_cell_angle_beta [76.9488]
_cell_angle_gamma [89.3097]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [AuClF2]
_chemical_formula_sum '[Au4 Cl4 F8]'
_cell_volume [345.4162]
_cell_formula_units_Z [4]
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
[
  Au  Au0  2  0.0248  0.1096  0.6949  1
  Au  Au1  2  0.1767  0.4052  0.1025  1
  Cl  Cl2  2  0.2503  0.3740  0.6157  1
  Cl  Cl3  2  0.2799  0.1200  0.2077  1
  F  F4  2  0.1041  0.6678  0.9923  1
  F  F5  2  0.1650  0.8265  0.4624  1
  F  F6  2  0.2166  0.0395  0.8481  1
  F  F7  2  0.4360  0.5099  0.1815  1
]