data_[Pa8Pd20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [5.8115]
_cell_length_b [11.7441]
_cell_length_c [8.0940]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [Pa2Pd5]
_chemical_formula_sum '[Pa8 Pd20]'
_cell_volume [552.4184]
_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
[
  Pa  Pa0  8  0.2285  0.8826  0.5000  1
  Pd  Pd1  8  0.0000  0.2547  0.2500  1
  Pd  Pd2  8  0.2458  0.1234  0.5000  1
  Pd  Pd3  4  0.0000  0.5000  0.2500  1
]