data_[K8Cd8F24]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.1822]
_cell_length_b [9.2179]
_cell_length_c [9.4065]
_cell_angle_alpha [81.3954]
_cell_angle_beta [76.9063]
_cell_angle_gamma [76.0503]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KCdF3]
_chemical_formula_sum '[K8 Cd8 F24]'
_cell_volume [585.6894]
_cell_formula_units_Z [8]
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  0.0397  0.8758  0.3936  1
  K  K1  2  0.2368  0.5558  0.4927  1
  K  K2  2  0.2903  0.9602  0.0529  1
  K  K3  2  0.4086  0.1469  0.6049  1
  Cd  Cd4  2  0.0214  0.3417  0.8982  1
  Cd  Cd5  2  0.2323  0.7998  0.7671  1
  Cd  Cd6  2  0.2683  0.2838  0.2319  1
  Cd  Cd7  2  0.4619  0.4298  0.8436  1
  F  F8  2  0.0568  0.1064  0.8634  1
  F  F9  2  0.0687  0.6023  0.8724  1
  F  F10  2  0.0757  0.1225  0.2529  1
  F  F11  2  0.1311  0.3154  0.4593  1
  F  F12  2  0.2140  0.5319  0.2153  1
  F  F13  2  0.2553  0.3835  0.7141  1
  F  F14  2  0.2633  0.9273  0.5494  1
  F  F15  2  0.3077  0.2556  0.9927  1
  F  F16  2  0.3630  0.7626  0.2684  1
  F  F17  2  0.3819  0.6508  0.9516  1
  F  F18  2  0.4713  0.6257  0.6514  1
  F  F19  2  0.4756  0.9102  0.7862  1
]