data_[Na24Tl4Cd10]
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 [12.3429]
_cell_length_b [11.1245]
_cell_length_c [8.7758]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.3353]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na12Tl2Cd5]
_chemical_formula_sum '[Na24 Tl4 Cd10]'
_cell_volume [1167.4776]
_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  8  0.1082  0.2619  0.3934  1.0
  Na  Na1  8  0.1817  0.1707  0.8187  1.0
  Na  Na2  4  0.0999  0.0000  0.1650  1.0
  Na  Na3  4  0.1117  0.5000  0.7404  1.0
  Tl  Tl4  4  0.0000  0.2650  0.0000  1.0
  Cd  Cd5  4  0.1082  0.5000  0.1402  1.0
  Cd  Cd6  4  0.2409  0.0000  0.5340  1.0
  Cd  Cd7  2  0.0000  0.0000  0.5000  1.0
]