data_[K3Ag1Au2Br9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [7.6646]
_cell_length_b [7.6646]
_cell_length_c [9.3759]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [K3AgAu2Br9]
_chemical_formula_sum '[K3 Ag1 Au2 Br9]'
_cell_volume [477.0002]
_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  2  0.3333  0.6667  0.3468  1.0
  K  K1  1  0.0000  0.0000  0.0000  1.0
  Ag  Ag2  1  0.0000  0.0000  0.5000  1.0
  Au  Au3  2  0.3333  0.6667  0.8351  1.0
  Br  Br4  6  0.1674  0.3348  0.6707  1.0
  Br  Br5  3  0.0000  0.5000  0.0000  1.0
]