data_[Pr2Pu2Cd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Pu  1.2800  1.7500  0.9675
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [3.5258]
_cell_length_b [3.5258]
_cell_length_c [14.1331]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [PrPuCd]
_chemical_formula_sum '[Pr2 Pu2 Cd2]'
_cell_volume [175.6874]
_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
[
  Pr  Pr0  2  0.0000  0.0000  0.3257  1
  Pu  Pu1  2  0.0000  0.0000  0.0100  1
  Cd  Cd2  2  0.0000  0.0000  0.6643  1
]