data_[K2As1Au1Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  As  2.1800  1.1500  0.6600
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.5735]
_cell_length_b [7.5881]
_cell_length_c [7.6651]
_cell_angle_alpha [90.1984]
_cell_angle_beta [117.0356]
_cell_angle_gamma [118.9349]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [K2AsAuCl6]
_chemical_formula_sum '[K2 As1 Au1 Cl6]'
_cell_volume [328.9878]
_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  0.9259  0.4369  0.3817  1.0
  K  K1  1  0.9563  0.9791  0.9213  1.0
  As  As2  1  0.3581  0.6692  0.0353  1.0
  Au  Au3  1  0.3454  0.2160  0.7252  1.0
  Cl  Cl4  1  0.2012  0.8711  0.7221  1.0
  Cl  Cl5  1  0.2706  0.8003  0.2358  1.0
  Cl  Cl6  1  0.4464  0.4604  0.2308  1.0
  Cl  Cl7  1  0.4556  0.5564  0.7284  1.0
  Cl  Cl8  1  0.7805  0.9762  0.2250  1.0
  Cl  Cl9  1  0.9367  0.3726  0.8096  1.0
]