data_[Pr24Y8Pu4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Y  1.2200  1.8000  1.0400
  Pu  1.2800  1.7500  0.9675
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [28.4117]
_cell_length_b [6.4195]
_cell_length_c [6.9138]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.4429]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Pr6Y2Pu]
_chemical_formula_sum '[Pr24 Y8 Pu4]'
_cell_volume [1250.3706]
_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
[
  Pr  Pr0  8  0.0547  0.4089  0.6296  1
  Pr  Pr1  8  0.1092  0.0888  0.0359  1
  Pr  Pr2  8  0.1680  0.4183  0.4240  1
  Y  Y3  8  0.2227  0.0824  0.8076  1
  Pu  Pu4  4  0.0000  0.0714  0.2500  1
]