data_[Al4P8O24F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  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 [C2/c]
_cell_length_a [11.0361]
_cell_length_b [11.9940]
_cell_length_c [4.1792]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.6540]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [AlP2O6F]
_chemical_formula_sum '[Al4 P8 O24 F4]'
_cell_volume [514.1502]
_cell_formula_units_Z [4]
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
[
  Al  Al0  4  0.0000  0.2389  0.2500  1.0
  P  P1  8  0.2424  0.4181  0.5696  1.0
  O  O2  8  0.1252  0.1275  0.3684  1.0
  O  O3  8  0.1268  0.3489  0.3748  1.0
  O  O4  8  0.2303  0.4567  0.9203  1.0
  F  F5  4  0.0000  0.2396  0.7500  1.0
]