data_[Au1Cl7]
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 [P2]
_cell_length_a [6.4794]
_cell_length_b [19.4738]
_cell_length_c [7.1877]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.4469]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [3]
_chemical_formula_structural [AuCl7]
_chemical_formula_sum '[Au1 Cl7]'
_cell_volume [902.8314]
_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  1  0.0000  0.5283  0.5000  1
  Cl  Cl1  2  0.1807  0.4162  0.3346  1
  Cl  Cl2  2  0.2142  0.5302  0.7792  1
  Cl  Cl3  2  0.4558  0.4664  0.2725  1
  Cl  Cl4  1  0.0000  0.6459  0.5000  1
]