data_[Tl4Cd2Pb2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  Pb  2.3300  1.8000  1.1225
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [11.1886]
_cell_length_b [6.5250]
_cell_length_c [6.6131]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.0293]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [Tl2CdPbF6]
_chemical_formula_sum '[Tl4 Cd2 Pb2 F12]'
_cell_volume [395.3376]
_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
[
  Tl  Tl0  4  0.2478  0.5021  0.7284  1.0
  Cd  Cd1  2  0.0000  0.0000  0.5000  1.0
  Pb  Pb2  2  0.0000  0.5006  0.0000  1.0
  F  F3  4  0.0549  0.2414  0.3154  1.0
  F  F4  4  0.0562  0.7583  0.3164  1.0
  F  F5  4  0.2376  0.9855  0.8279  1.0
]