data_[K5Na1Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Na  0.9300  1.8000  1.1600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.0465]
_cell_length_b [4.0465]
_cell_length_c [21.4393]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [K5NaAu4]
_chemical_formula_sum '[K5 Na1 Au4]'
_cell_volume [351.0459]
_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  0.5000  0.5000  0.1388  1
  K  K1  2  0.5000  0.5000  0.3182  1
  K  K2  1  0.5000  0.5000  0.5000  1
  Na  Na3  1  0.0000  0.0000  0.0000  1
  Au  Au4  2  0.0000  0.0000  0.2210  1
  Au  Au5  2  0.0000  0.0000  0.4068  1
]