data_[Cs1Be2Tl2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Be  1.5700  1.0500  0.5900
  Tl  1.6200  1.9000  1.3325
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.8363]
_cell_length_b [5.8395]
_cell_length_c [7.3047]
_cell_angle_alpha [111.1609]
_cell_angle_beta [112.1585]
_cell_angle_gamma [90.2681]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsBe2Tl2O6]
_chemical_formula_sum '[Cs1 Be2 Tl2 O6]'
_cell_volume [212.1406]
_cell_formula_units_Z [1]
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  1  0.5000  0.5000  0.0000  1
  Be  Be1  2  0.2283  0.2499  0.3311  1
  Tl  Tl2  2  0.2218  0.8266  0.4410  1
  O  O3  2  0.1092  0.1946  0.4735  1
  O  O4  2  0.2047  0.4571  0.2504  1
  O  O5  2  0.3932  0.0418  0.2862  1
]