data_[K9Au3I1O2]
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
  I  2.6600  1.4000  1.2733
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [7.6165]
_cell_length_b [7.6165]
_cell_length_c [11.4581]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [K9Au3IO2]
_chemical_formula_sum '[K9 Au3 I1 O2]'
_cell_volume [575.6508]
_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  6  0.1706  0.3412  0.7398  1.0
  K  K1  3  0.0000  0.5000  0.0000  1.0
  Au  Au2  2  0.3333  0.6667  0.2426  1.0
  Au  Au3  1  0.0000  0.0000  0.0000  1.0
  I  I4  1  0.0000  0.0000  0.5000  1.0
  O  O5  2  0.3333  0.6667  0.8545  1.0
]