data_[Na8Tl10Cd6]
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
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.5377]
_cell_length_b [5.5983]
_cell_length_c [7.8195]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.5653]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na4Tl5Cd3]
_chemical_formula_sum '[Na8 Tl10 Cd6]'
_cell_volume [735.8735]
_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  0.0942  0.0000  0.9301  1.0
  Na  Na1  4  0.1665  0.0000  0.4169  1.0
  Tl  Tl2  4  0.1743  0.5000  0.7222  1.0
  Tl  Tl3  4  0.2223  0.5000  0.1514  1.0
  Tl  Tl4  2  0.0000  0.0000  0.5000  1.0
  Cd  Cd5  4  0.0523  0.5000  0.1813  1.0
  Cd  Cd6  2  0.0000  0.5000  0.5000  1.0
]