data_[Na4Tl6Cd2Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8450]
_cell_length_b [13.6418]
_cell_length_c [8.0121]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.8841]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na2Tl3CdBr6]
_chemical_formula_sum '[Na4 Tl6 Cd2 Br12]'
_cell_volume [811.3051]
_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
[
  Na  Na0  4  0.0000  0.3334  0.0000  1.0
  Tl  Tl1  4  0.0000  0.1664  0.5000  1.0
  Tl  Tl2  2  0.0000  0.5000  0.5000  1.0
  Cd  Cd3  2  0.0000  0.0000  0.0000  1.0
  Br  Br4  8  0.2458  0.8286  0.2226  1.0
  Br  Br5  4  0.2328  0.5000  0.2169  1.0
]