data_[Pa6O14F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [7.0525]
_cell_length_b [12.1111]
_cell_length_c [4.2137]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Pa3O7F]
_chemical_formula_sum '[Pa6 O14 F2]'
_cell_volume [359.9089]
_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
[
  Pa  Pa0  4  0.0000  0.3048  0.0000  1
  Pa  Pa1  2  0.0000  0.0000  0.0000  1
  O  O2  8  0.1883  0.1478  0.0000  1
  O  O3  4  0.0000  0.3085  0.5000  1
  O  O4  2  0.0000  0.0000  0.5000  1
  F  F5  2  0.0000  0.5000  0.0000  1
]