data_[K2Au2F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  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 [5.5984]
_cell_length_b [6.4139]
_cell_length_c [6.4779]
_cell_angle_alpha [92.6192]
_cell_angle_beta [114.5426]
_cell_angle_gamma [90.0378]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KAuF3]
_chemical_formula_sum '[K2 Au2 F6]'
_cell_volume [211.3210]
_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
[
  K  K0  2  0.3013  0.7576  0.5944  1
  Au  Au1  1  0.0000  0.0000  0.0000  1
  Au  Au2  1  0.0000  0.5000  0.0000  1
  F  F3  2  0.1196  0.4429  0.7576  1
  F  F4  2  0.1747  0.0838  0.3332  1
  F  F5  2  0.3604  0.5557  0.2305  1
]