data_[Cs4W4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.1261]
_cell_length_b [5.3952]
_cell_length_c [7.6748]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.9889]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsWO3]
_chemical_formula_sum '[Cs4 W4 O12]'
_cell_volume [345.2408]
_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  0.1250  0.5000  0.3727  1
  W  W1  4  0.1563  0.0000  0.9989  1
  O  O2  8  0.1946  0.2490  0.8316  1
  O  O3  4  0.0669  0.0000  0.1982  1
]