data_[Cs6Te12O36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Te  2.1000  1.4000  1.2933
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.3021]
_cell_length_b [7.3021]
_cell_length_c [18.3459]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Cs(TeO3)2]
_chemical_formula_sum '[Cs6 Te12 O36]'
_cell_volume [847.1577]
_cell_formula_units_Z [6]
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  6  0.0000  0.0000  0.1228  1
  Te  Te1  9  0.0000  0.5000  0.0000  1
  Te  Te2  3  -0.0000  -0.0000  0.5000  1
  O  O3  18  0.0613  0.5307  0.1014  1
  O  O4  18  0.0735  0.5367  0.3520  1
]