data_[K2Ce2In2Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ce  1.1200  1.8500  1.0800
  In  1.7800  1.5500  0.9400
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P4_2nm]
_cell_length_a [7.3375]
_cell_length_b [7.3375]
_cell_length_c [14.0185]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [KCeInBr6]
_chemical_formula_sum '[K2 Ce2 In2 Br12]'
_cell_volume [754.7376]
_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  0.0000  0.0000  0.6692  1.0
  Ce  Ce1  2  0.0000  0.0000  0.3340  1.0
  In  In2  2  0.0000  0.0000  0.0008  1.0
  Br  Br3  4  0.1804  0.8196  0.1825  1.0
  Br  Br4  4  0.1907  0.8093  0.4771  1.0
  Br  Br5  4  0.2289  0.7711  0.8384  1.0
]