data_[Na2Pb1Au1Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Pb  2.3300  1.8000  1.1225
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.7959]
_cell_length_b [7.3169]
_cell_length_c [7.3375]
_cell_angle_alpha [63.1623]
_cell_angle_beta [88.6293]
_cell_angle_gamma [66.2883]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Na2PbAuCl6]
_chemical_formula_sum '[Na2 Pb1 Au1 Cl6]'
_cell_volume [292.4760]
_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
[
  Na  Na0  1  0.4843  0.0417  0.4446  1.0
  Na  Na1  1  0.9387  0.0969  0.9270  1.0
  Pb  Pb2  1  0.1833  0.6282  0.5400  1.0
  Au  Au3  1  0.6698  0.6598  0.0297  1.0
  Cl  Cl4  1  0.1143  0.0778  0.2685  1.0
  Cl  Cl5  1  0.2569  0.1671  0.7189  1.0
  Cl  Cl6  1  0.4645  0.4896  0.2745  1.0
  Cl  Cl7  1  0.5814  0.5320  0.7921  1.0
  Cl  Cl8  1  0.7751  0.7998  0.2472  1.0
  Cl  Cl9  1  0.8701  0.8301  0.7726  1.0
]