data_[Cs4Ga4Au6]
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 [C2/m]
_cell_length_a [13.9003]
_cell_length_b [4.3629]
_cell_length_c [8.6142]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.8397]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs2Ga2Au3]
_chemical_formula_sum '[Cs4 Ga4 Au6]'
_cell_volume [418.0982]
_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  4  0.1345  0.0000  0.7597  1.0
  Ga  Ga1  4  0.1264  0.0000  0.2192  1.0
  Au  Au2  4  0.1615  0.5000  0.4205  1.0
  Au  Au3  2  0.0000  0.5000  0.0000  1.0
]