data_[As4Au2Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  As  2.1800  1.1500  0.6600
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.8049]
_cell_length_b [9.0359]
_cell_length_c [8.8980]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.7141]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [As2AuCl8]
_chemical_formula_sum '[As4 Au2 Cl16]'
_cell_volume [1001.5169]
_cell_formula_units_Z [2]
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
[
  As  As0  4  0.1791  0.0000  0.6284  1.0
  Au  Au1  2  0.0000  0.0000  0.0000  1.0
  Cl  Cl2  8  0.1428  0.1864  0.7472  1.0
  Cl  Cl3  4  0.1447  0.5000  0.2031  1.0
  Cl  Cl4  4  0.1654  0.0000  0.2469  1.0
]