data_[K24P8O24F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Fmm2]
_cell_length_a [10.6592]
_cell_length_b [11.2650]
_cell_length_c [10.2781]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [42]
_chemical_formula_structural [K3PO3F2]
_chemical_formula_sum '[K24 P8 O24 F16]'
_cell_volume [1234.1471]
_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  8  0.1975  0.0000  0.5096  1.0
  K  K1  8  0.2500  0.2500  0.2480  1.0
  K  K2  4  0.0000  0.0000  0.1820  1.0
  K  K3  4  0.0000  0.0000  0.8105  1.0
  P  P4  8  0.0000  0.2447  0.0094  1.0
  O  O5  16  0.1196  0.1716  0.9998  1.0
  O  O6  8  0.0000  0.1567  0.6106  1.0
  F  F7  8  0.0000  0.1768  0.3693  1.0
  F  F8  8  0.2380  0.0000  0.2573  1.0
]