data_[Cs4K2Cr4Cl14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  K  0.8200  2.2000  1.5200
  Cr  1.6600  1.4000  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [5.0703]
_cell_length_b [5.0703]
_cell_length_c [26.8908]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [139]
_chemical_formula_structural [Cs2KCr2Cl7]
_chemical_formula_sum '[Cs4 K2 Cr4 Cl14]'
_cell_volume [691.2992]
_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
[
  Cs  Cs0  4  0.0000  0.0000  0.1811  1.0
  K  K1  2  0.0000  0.0000  0.0000  1.0
  Cr  Cr2  4  0.0000  0.0000  0.4080  1.0
  Cl  Cl3  8  0.0000  0.5000  0.0891  1.0
  Cl  Cl4  4  0.0000  0.0000  0.3155  1.0
  Cl  Cl5  2  0.0000  0.0000  0.5000  1.0
]