data_[Pr4W4O16F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.9936]
_cell_length_b [7.6813]
_cell_length_c [7.2231]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.0173]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PrWO4F]
_chemical_formula_sum '[Pr4 W4 O16 F4]'
_cell_volume [527.2842]
_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
[
  Pr  Pr0  4  0.2049  0.0000  0.1092  1.0
  W  W1  4  0.1510  0.5000  0.2778  1.0
  O  O2  8  0.2064  0.3156  0.1584  1.0
  O  O3  4  0.0373  0.5000  0.7781  1.0
  O  O4  4  0.2348  0.5000  0.5367  1.0
  F  F5  4  0.0126  0.0000  0.8267  1.0
]