data_[Cs8Li4Cd4Br20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Li  0.9800  1.4500  0.9000
  Cd  1.6900  1.5500  1.0900
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.5070]
_cell_length_b [21.0037]
_cell_length_c [14.5963]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Cs2LiCdBr5]
_chemical_formula_sum '[Cs8 Li4 Cd4 Br20]'
_cell_volume [1381.7458]
_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
[
  Cs  Cs0  4  0.0000  0.1184  0.6947  1.0
  Cs  Cs1  4  0.0000  0.1258  0.3073  1.0
  Li  Li2  4  0.0000  0.4223  0.4400  1.0
  Cd  Cd3  4  0.0000  0.2094  0.0187  1.0
  Br  Br4  4  0.0000  0.0789  0.0296  1.0
  Br  Br5  4  0.0000  0.2888  0.6455  1.0
  Br  Br6  4  0.0000  0.3045  0.3829  1.0
  Br  Br7  4  0.0000  0.3363  0.0020  1.0
  Br  Br8  4  0.0000  0.4919  0.3034  1.0
]