data_[K2Zn5Au5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Zn  1.6500  1.3500  0.8800
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pmmm]
_cell_length_a [4.2530]
_cell_length_b [5.7477]
_cell_length_c [10.3077]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [47]
_chemical_formula_structural [K2(ZnAu)5]
_chemical_formula_sum '[K2 Zn5 Au5]'
_cell_volume [251.9691]
_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  0.0000  0.0000  0.5000  1
  K  K1  1  0.0000  0.5000  0.0000  1
  Zn  Zn2  4  0.5000  0.2507  0.2512  1
  Zn  Zn3  1  0.5000  0.5000  0.5000  1
  Au  Au4  2  0.0000  0.0000  0.1835  1
  Au  Au5  2  0.0000  0.5000  0.3352  1
  Au  Au6  1  0.5000  0.0000  0.0000  1
]