data_[Au2Cl13]
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 [P-1]
_cell_length_a [7.6936]
_cell_length_b [8.1548]
_cell_length_c [9.4273]
_cell_angle_alpha [113.7034]
_cell_angle_beta [102.7890]
_cell_angle_gamma [95.2616]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Au2Cl13]
_chemical_formula_sum '[Au2 Cl13]'
_cell_volume [517.2123]
_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
[
  Au  Au0  2  0.1768  0.8115  0.2919  1.0
  Cl  Cl1  2  0.0975  0.0753  0.2710  1.0
  Cl  Cl2  2  0.1087  0.2694  0.6896  1.0
  Cl  Cl3  2  0.2581  0.5625  0.3251  1.0
  Cl  Cl4  2  0.3566  0.6975  0.6911  1.0
  Cl  Cl5  2  0.4068  0.7742  0.9309  1.0
  Cl  Cl6  2  0.4644  0.8802  0.2636  1.0
  Cl  Cl7  1  0.0000  0.0000  0.0000  1.0
]