data_[Cs2Ga2Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ga  1.8100  1.3000  0.7600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1]
_cell_length_a [7.7088]
_cell_length_b [4.9998]
_cell_length_c [8.4924]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.1771]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [4]
_chemical_formula_structural [CsGaAu3]
_chemical_formula_sum '[Cs2 Ga2 Au6]'
_cell_volume [326.8123]
_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
[
  Cs  Cs0  2  0.2468  0.3186  0.3638  1.0
  Ga  Ga1  2  0.2460  0.0895  0.9289  1.0
  Au  Au2  2  0.0729  0.6517  0.9781  1.0
  Au  Au3  2  0.2644  0.8048  0.6821  1.0
  Au  Au4  2  0.4290  0.5133  0.9598  1.0
]