data_[Au8Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pc]
_cell_length_a [19.4885]
_cell_length_b [10.9991]
_cell_length_c [7.7187]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [7]
_chemical_formula_structural [AuCl]
_chemical_formula_sum '[Au8 Cl8]'
_cell_volume [1654.5609]
_cell_formula_units_Z [8]
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
[
  Au  Au0  2  0.4794  0.0816  0.8661  1
  Au  Au1  2  0.5262  0.1283  0.1869  1
  Au  Au2  2  0.5420  0.3424  0.3715  1
  Au  Au3  2  0.5533  0.0884  0.5370  1
  Cl  Cl4  2  0.3869  0.2084  0.7502  1
  Cl  Cl5  2  0.4259  0.3958  0.7083  1
  Cl  Cl6  2  0.4691  0.3998  0.1528  1
  Cl  Cl7  2  0.6172  0.2790  0.5862  1
]