data_[K2Sr1Cd1Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Sr  0.9500  2.0000  1.3200
  Cd  1.6900  1.5500  1.0900
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [8.0260]
_cell_length_b [8.0260]
_cell_length_c [6.2091]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [99]
_chemical_formula_structural [K2SrCdBr6]
_chemical_formula_sum '[K2 Sr1 Cd1 Br6]'
_cell_volume [399.9720]
_cell_formula_units_Z [1]
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  0.5000  0.0205  1.0
  Sr  Sr1  1  0.5000  0.5000  0.6347  1.0
  Cd  Cd2  1  0.0000  0.0000  0.5988  1.0
  Br  Br3  4  0.2379  0.2379  0.7108  1.0
  Br  Br4  1  0.0000  0.0000  0.1799  1.0
  Br  Br5  1  0.5000  0.5000  0.1494  1.0
]