data_[K2Cd2In2Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  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 [7.8203]
_cell_length_b [7.7894]
_cell_length_c [9.0277]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.7838]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KCdInBr4]
_chemical_formula_sum '[K2 Cd2 In2 Br8]'
_cell_volume [523.6494]
_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
[
  K  K0  2  0.2171  0.2500  0.5611  1
  Cd  Cd1  2  0.2471  0.7500  0.3017  1
  In  In2  2  0.2456  0.2500  0.0651  1
  Br  Br3  4  0.0099  0.0049  0.2448  1
  Br  Br4  2  0.4421  0.7500  0.1137  1
  Br  Br5  2  0.4434  0.7500  0.5956  1
]