data_[Pu10Th2Rh10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Th  1.3000  1.8000  1.0800
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.8916]
_cell_length_b [5.5636]
_cell_length_c [7.6739]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.3562]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pu5ThRh5]
_chemical_formula_sum '[Pu10 Th2 Rh10]'
_cell_volume [528.1326]
_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
[
  Pu  Pu0  4  0.1503  0.5000  0.3357  1
  Pu  Pu1  4  0.1744  0.5000  0.8374  1
  Pu  Pu2  2  0.0000  0.0000  0.5000  1
  Th  Th3  2  0.0000  0.0000  0.0000  1
  Rh  Rh4  4  0.1682  0.0000  0.8104  1
  Rh  Rh5  4  0.1693  0.0000  0.3703  1
  Rh  Rh6  2  0.0000  0.5000  0.0000  1
]