data_[Ga1Au1Br1Cl3]
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
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.7823]
_cell_length_b [6.0532]
_cell_length_c [6.5095]
_cell_angle_alpha [111.9746]
_cell_angle_beta [115.1700]
_cell_angle_gamma [92.6006]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [GaAuBrCl3]
_chemical_formula_sum '[Ga1 Au1 Br1 Cl3]'
_cell_volume [185.4607]
_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  0.2544  0.7467  0.4972  1
  Au  Au1  1  0.0675  0.0777  0.1373  1
  Br  Br2  1  0.8471  0.4174  0.2324  1
  Cl  Cl3  1  0.1683  0.0756  0.7112  1
  Cl  Cl4  1  0.3450  0.8085  0.2133  1
  Cl  Cl5  1  0.5676  0.6240  0.7086  1
]