data_[Ga4Cu12Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Cu  1.9000  1.3500  0.8200
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [3.9955]
_cell_length_b [12.1418]
_cell_length_c [7.2453]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [GaCu3Au2]
_chemical_formula_sum '[Ga4 Cu12 Au8]'
_cell_volume [351.4925]
_cell_formula_units_Z [4]
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  4  0.0000  0.3372  0.0000  1.0
  Cu  Cu1  8  0.0000  0.1722  0.2382  1.0
  Cu  Cu2  4  0.0000  0.5000  0.2469  1.0
  Au  Au3  4  0.0000  0.3336  0.5000  1.0
  Au  Au4  2  0.0000  0.0000  0.0000  1.0
  Au  Au5  2  0.0000  0.0000  0.5000  1.0
]