data_[Li4Cd4In8Br20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [Cmc2_1]
_cell_length_a [4.2259]
_cell_length_b [18.9591]
_cell_length_c [14.3317]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [LiCdIn2Br5]
_chemical_formula_sum '[Li4 Cd4 In8 Br20]'
_cell_volume [1148.2525]
_cell_formula_units_Z [4]
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
[
  Li  Li0  4  0.0000  0.4400  0.4398  1.0
  Cd  Cd1  4  0.0000  0.2087  0.0261  1.0
  In  In2  4  0.0000  0.0966  0.6663  1.0
  In  In3  4  0.0000  0.1286  0.3157  1.0
  Br  Br4  4  0.0000  0.0571  0.0393  1.0
  Br  Br5  4  0.0000  0.2816  0.6581  1.0
  Br  Br6  4  0.0000  0.3078  0.3926  1.0
  Br  Br7  4  0.0000  0.3553  0.0004  1.0
  Br  Br8  4  0.0000  0.4972  0.7857  1.0
]