data_[Hf2Pa2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Pa  1.5000  1.8000  1.0400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.0267]
_cell_length_b [5.0848]
_cell_length_c [6.0366]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.2825]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [HfPaO4]
_chemical_formula_sum '[Hf2 Pa2 O8]'
_cell_volume [173.5185]
_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
[
  Hf  Hf0  2  0.0000  0.0000  0.0000  1
  Pa  Pa1  2  0.5000  0.0000  0.5000  1
  O  O2  4  0.1356  0.7072  0.8258  1
  O  O3  4  0.3342  0.1698  0.1313  1
]