data_[Cs6Zr9Tl3O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Zr  1.3300  1.5500  0.8600
  Tl  1.6200  1.9000  1.3325
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [6.6470]
_cell_length_b [6.6470]
_cell_length_c [21.9010]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Cs2Zr3TlO8]
_chemical_formula_sum '[Cs6 Zr9 Tl3 O24]'
_cell_volume [838.0023]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.1314  1.0
  Cs  Cs1  3  0.0000  0.0000  0.4977  1.0
  Zr  Zr2  9  0.0067  0.5034  0.9987  1.0
  Tl  Tl3  3  0.0000  0.0000  0.9103  1.0
  O  O4  9  0.0346  0.5173  0.2779  1.0
  O  O5  9  0.1852  0.3704  0.0448  1.0
  O  O6  3  0.0000  0.0000  0.2793  1.0
  O  O7  3  0.0000  0.0000  0.7098  1.0
]