data_[Ga1Au1Cl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [4.4294]
_cell_length_b [7.4210]
_cell_length_c [19.7557]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [GaAuCl4]
_chemical_formula_sum '[Ga1 Au1 Cl4]'
_cell_volume [649.3805]
_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
[
  Ga  Ga0  1  0.5853  0.0000  0.5595  1
  Au  Au1  1  0.4068  0.5000  0.3625  1
  Cl  Cl2  2  0.7194  0.2478  0.6032  1
  Cl  Cl3  1  0.2707  0.0000  0.4772  1
  Cl  Cl4  1  0.9068  0.5000  0.3945  1
]