data_[K1H2Au1F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  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 [5.0835]
_cell_length_b [5.0833]
_cell_length_c [7.7120]
_cell_angle_alpha [83.2580]
_cell_angle_beta [81.7392]
_cell_angle_gamma [68.2097]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KH2AuF8]
_chemical_formula_sum '[K1 H2 Au1 F8]'
_cell_volume [182.6834]
_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
[
  K  K0  1  0.0000  0.0000  0.5000  1.0
  H  H1  2  0.3082  0.2900  0.7289  1.0
  Au  Au2  1  0.0000  0.0000  0.0000  1.0
  F  F3  2  0.2269  0.7617  0.8114  1.0
  F  F4  2  0.2311  0.7633  0.1812  1.0
  F  F5  2  0.2417  0.2279  0.9442  1.0
  F  F6  2  0.3261  0.2977  0.6027  1.0
]