data_[Pa4Al16Rh8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  Al  1.6100  1.2500  0.6750
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [17.1772]
_cell_length_b [4.2051]
_cell_length_c [6.6633]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Pa(Al2Rh)2]
_chemical_formula_sum '[Pa4 Al16 Rh8]'
_cell_volume [481.3007]
_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  4  0.1372  0.7500  0.5330  1
  Al  Al1  4  0.0355  0.2500  0.3296  1
  Al  Al2  4  0.0737  0.7500  0.0064  1
  Al  Al3  4  0.1855  0.2500  0.8483  1
  Al  Al4  4  0.1938  0.2500  0.2428  1
  Rh  Rh5  4  0.0411  0.2500  0.7407  1
  Rh  Rh6  4  0.2215  0.7500  0.0485  1
]