data_[Pa8Hg6O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  Hg  2.0000  1.5000  1.2450
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Im-3]
_cell_length_a [8.5855]
_cell_length_b [8.5855]
_cell_length_c [8.5855]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [204]
_chemical_formula_structural [Pa4(HgO4)3]
_chemical_formula_sum '[Pa8 Hg6 O24]'
_cell_volume [632.8551]
_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  8  0.2500  0.2500  0.2500  1
  Hg  Hg1  6  0.0000  0.0000  0.5000  1
  O  O2  24  0.0000  0.2116  0.2889  1
]