data_[Cs4Sr4Au4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Sr  0.9500  2.0000  1.3200
  Au  2.5400  1.3500  1.0700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.0769]
_cell_length_b [4.0277]
_cell_length_c [8.5071]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.6497]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsSrAuO3]
_chemical_formula_sum '[Cs4 Sr4 Au4 O12]'
_cell_volume [464.4465]
_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
[
  Cs  Cs0  4  0.1476  0.5000  0.0707  1.0
  Sr  Sr1  4  0.1568  0.5000  0.5773  1.0
  Au  Au2  4  0.0065  0.0000  0.2872  1.0
  O  O3  4  0.0050  0.5000  0.3325  1.0
  O  O4  4  0.1440  0.0000  0.7747  1.0
  O  O5  4  0.1588  0.0000  0.3695  1.0
]