data_[K1Sb1Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Sb  2.0500  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [5.0591]
_cell_length_b [4.8151]
_cell_length_c [5.3700]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.6196]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [KSbAu2]
_chemical_formula_sum '[K1 Sb1 Au2]'
_cell_volume [129.3354]
_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  0.4532  0.0000  0.5007  1.0
  Sb  Sb1  1  0.7907  0.5000  0.0978  1.0
  Au  Au2  1  0.2759  0.5000  0.9260  1.0
  Au  Au3  1  0.9802  0.0000  0.9755  1.0
]