data_[Na2In1Au1Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  In  1.7800  1.5500  0.9400
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.9430]
_cell_length_b [7.1485]
_cell_length_c [7.5000]
_cell_angle_alpha [62.6995]
_cell_angle_beta [65.3142]
_cell_angle_gamma [61.0145]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Na2InAuCl6]
_chemical_formula_sum '[Na2 In1 Au1 Cl6]'
_cell_volume [280.0549]
_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  0.0050  0.0094  0.0171  1.0
  Na  Na1  1  0.4456  0.4859  0.6015  1.0
  In  In2  1  0.6622  0.6860  0.9793  1.0
  Au  Au3  1  0.2356  0.1250  0.2621  1.0
  Cl  Cl4  1  0.0274  0.7518  0.8084  1.0
  Cl  Cl5  1  0.3160  0.6044  0.2359  1.0
  Cl  Cl6  1  0.4270  0.0489  0.7654  1.0
  Cl  Cl7  1  0.6107  0.8855  0.2508  1.0
  Cl  Cl8  1  0.7564  0.4359  0.7841  1.0
  Cl  Cl9  1  0.8524  0.3054  0.2803  1.0
]