data_[Cs6Pr4Tl2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Pr  1.1300  1.8500  1.0600
  Tl  1.6200  1.9000  1.3325
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.4032]
_cell_length_b [11.0708]
_cell_length_c [7.2700]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.1295]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs3Pr2TlO6]
_chemical_formula_sum '[Cs6 Pr4 Tl2 O12]'
_cell_volume [492.4984]
_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  4  0.0000  0.1642  0.5000  1.0
  Cs  Cs1  2  0.0000  0.5000  0.5000  1.0
  Pr  Pr2  4  0.0000  0.3335  0.0000  1.0
  Tl  Tl3  2  0.0000  0.0000  0.0000  1.0
  O  O4  8  0.2237  0.1654  0.1739  1.0
  O  O5  4  0.2253  0.5000  0.1760  1.0
]