data_[Ba2Sr2Ce2W2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sr  0.9500  2.0000  1.3200
  Ce  1.1200  1.8500  1.0800
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.0395]
_cell_length_b [6.0688]
_cell_length_c [8.5120]
_cell_angle_alpha [90.0548]
_cell_angle_beta [90.2435]
_cell_angle_gamma [90.0436]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [BaSrCeWO6]
_chemical_formula_sum '[Ba2 Sr2 Ce2 W2 O12]'
_cell_volume [311.9853]
_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
[
  Ba  Ba0  2  0.4926  0.4741  0.7503  1
  Sr  Sr1  2  0.0075  0.9649  0.7491  1
  Ce  Ce2  1  0.0000  0.5000  0.0000  1
  Ce  Ce3  1  0.5000  0.0000  0.5000  1
  W  W4  1  0.0000  0.5000  0.5000  1
  W  W5  1  0.5000  0.0000  0.0000  1
  O  O6  2  0.0586  0.4725  0.2623  1
  O  O7  2  0.1984  0.2256  0.5387  1
  O  O8  2  0.2183  0.2087  0.9605  1
  O  O9  2  0.2731  0.7190  0.5323  1
  O  O10  2  0.2907  0.7347  0.9652  1
  O  O11  2  0.4205  0.9972  0.2371  1
]