data_[Na2Sb1Au1Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Sb  2.0500  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.4944]
_cell_length_b [7.5474]
_cell_length_c [7.9846]
_cell_angle_alpha [107.2326]
_cell_angle_beta [102.0194]
_cell_angle_gamma [115.4871]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Na2SbAuBr6]
_chemical_formula_sum '[Na2 Sb1 Au1 Br6]'
_cell_volume [358.6441]
_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  0.0280  0.0269  0.9802  1.0
  Na  Na1  1  0.1141  0.4655  0.6047  1.0
  Sb  Sb2  1  0.6464  0.3401  0.9943  1.0
  Au  Au3  1  0.6402  0.8190  0.4797  1.0
  Br  Br4  1  0.0450  0.4233  0.2197  1.0
  Br  Br5  1  0.2336  0.2008  0.7426  1.0
  Br  Br6  1  0.4682  0.1766  0.2140  1.0
  Br  Br7  1  0.5530  0.8837  0.7614  1.0
  Br  Br8  1  0.7378  0.7653  0.2039  1.0
  Br  Br9  1  0.8570  0.5605  0.7843  1.0
]