data_[K2Bi1Au1Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Bi  2.0200  1.6000  1.0350
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.5734]
_cell_length_b [7.8124]
_cell_length_c [8.1069]
_cell_angle_alpha [115.6384]
_cell_angle_beta [92.0710]
_cell_angle_gamma [118.5769]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [K2BiAuCl6]
_chemical_formula_sum '[K2 Bi1 Au1 Cl6]'
_cell_volume [361.4050]
_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  0.4834  0.9307  0.3915  1.0
  K  K1  1  0.9916  0.9799  0.9517  1.0
  Bi  Bi2  1  0.6901  0.3585  0.0238  1.0
  Au  Au3  1  0.1159  0.3430  0.7342  1.0
  Cl  Cl4  1  0.0320  0.4554  0.2292  1.0
  Cl  Cl5  1  0.3050  0.1819  0.7224  1.0
  Cl  Cl6  1  0.4568  0.2359  0.2295  1.0
  Cl  Cl7  1  0.5809  0.9296  0.7793  1.0
  Cl  Cl8  1  0.7863  0.7916  0.2134  1.0
  Cl  Cl9  1  0.8963  0.4702  0.7403  1.0
]