data_[Na10Tl24In4]
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
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.1022]
_cell_length_b [8.5533]
_cell_length_c [8.2525]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.6676]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na5(Tl6In)2]
_chemical_formula_sum '[Na10 Tl24 In4]'
_cell_volume [1132.8218]
_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  0.1592  0.5000  0.9460  1
  Na  Na1  4  0.2442  0.0000  0.5532  1
  Na  Na2  2  0.0000  0.0000  0.5000  1
  Tl  Tl3  8  0.1099  0.2985  0.6072  1
  Tl  Tl4  8  0.1799  0.2006  0.2266  1
  Tl  Tl5  4  0.0439  0.5000  0.2534  1
  Tl  Tl6  4  0.1492  0.0000  0.8711  1
  In  In7  4  0.0000  0.2020  0.0000  1
]