data_[Cs2K1Tl6Cd1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  K  0.8200  2.2000  1.5200
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.7671]
_cell_length_b [8.7964]
_cell_length_c [8.9544]
_cell_angle_alpha [82.4439]
_cell_angle_beta [68.3881]
_cell_angle_gamma [67.6594]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cs2KTl6Cd]
_chemical_formula_sum '[Cs2 K1 Tl6 Cd1]'
_cell_volume [458.3312]
_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  2  0.2452  0.3059  0.2040  1.0
  K  K1  1  0.0000  0.0000  0.0000  1.0
  Tl  Tl2  2  0.2265  0.7425  0.2916  1.0
  Tl  Tl3  2  0.2512  0.9570  0.5467  1.0
  Tl  Tl4  2  0.2676  0.2579  0.7170  1.0
  Cd  Cd5  1  0.5000  0.5000  0.5000  1.0
]