data_[Cs2Br2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Br  2.9600  1.1500  0.8825
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.1592]
_cell_length_b [6.4721]
_cell_length_c [7.9954]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.0777]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsBrO3]
_chemical_formula_sum '[Cs2 Br2 O6]'
_cell_volume [253.7950]
_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  0.3543  0.7500  0.6948  1.0
  Br  Br1  2  0.0461  0.7500  0.1630  1.0
  O  O2  4  0.1460  0.5418  0.2945  1.0
  O  O3  2  0.2967  0.2500  0.8981  1.0
]