data_[Na2Cd2In2Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.5157]
_cell_length_b [7.8000]
_cell_length_c [8.8045]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.0412]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [NaCdInBr4]
_chemical_formula_sum '[Na2 Cd2 In2 Br8]'
_cell_volume [496.0467]
_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  2  0.2133  0.2500  0.5583  1.0
  Cd  Cd1  2  0.2535  0.7500  0.3239  1.0
  In  In2  2  0.2250  0.2500  0.0570  1.0
  Br  Br3  4  0.0070  0.0030  0.2740  1.0
  Br  Br4  2  0.4689  0.7500  0.1357  1.0
  Br  Br5  2  0.4857  0.7500  0.6080  1.0
]