data_[Na6Tl6Rh2Cl16]
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
  Rh  2.2800  1.3500  0.7450
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.3257]
_cell_length_b [8.1410]
_cell_length_c [8.8093]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.7756]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na3Tl3RhCl8]
_chemical_formula_sum '[Na6 Tl6 Rh2 Cl16]'
_cell_volume [863.8226]
_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  0.2500  0.2500  0.5000  1
  Na  Na1  2  0.0000  0.5000  0.5000  1
  Tl  Tl2  4  0.2500  0.2500  0.0000  1
  Tl  Tl3  2  0.0000  0.0000  0.0000  1
  Rh  Rh4  2  0.0000  0.0000  0.5000  1
  Cl  Cl5  8  0.0104  0.2118  0.3190  1
  Cl  Cl6  4  0.2361  0.5000  0.7095  1
  Cl  Cl7  4  0.2364  0.0000  0.7110  1
]