data_[Ga4Cu8Au2]
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 [P1]
_cell_length_a [5.0220]
_cell_length_b [6.4962]
_cell_length_c [6.6442]
_cell_angle_alpha [79.3581]
_cell_angle_beta [72.7893]
_cell_angle_gamma [81.2666]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Ga2Cu4Au]
_chemical_formula_sum '[Ga4 Cu8 Au2]'
_cell_volume [202.3969]
_cell_formula_units_Z [2]
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  0.3202  0.8999  0.3453  1.0
  Ga  Ga1  1  0.3694  0.2513  0.6124  1.0
  Ga  Ga2  1  0.4092  0.5071  0.9637  1.0
  Ga  Ga3  1  0.9746  0.3400  0.3438  1.0
  Cu  Cu4  1  0.0710  0.5866  0.5577  1.0
  Cu  Cu5  1  0.1533  0.1443  0.0361  1.0
  Cu  Cu6  1  0.5882  0.5966  0.5364  1.0
  Cu  Cu7  1  0.6140  0.1976  0.1888  1.0
  Cu  Cu8  1  0.7702  0.9654  0.5123  1.0
  Cu  Cu9  1  0.8161  0.2493  0.7586  1.0
  Cu  Cu10  1  0.9037  0.5030  0.9760  1.0
  Cu  Cu11  1  0.9660  0.7613  0.2009  1.0
  Au  Au12  1  0.1829  0.8680  0.7618  1.0
  Au  Au13  1  0.6113  0.8795  0.9562  1.0
]