data_[La8Pu12Rh16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pu  1.2800  1.7500  0.9675
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [6.1351]
_cell_length_b [16.2994]
_cell_length_c [8.2369]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [La2Pu3Rh4]
_chemical_formula_sum '[La8 Pu12 Rh16]'
_cell_volume [823.6845]
_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
[
  La  La0  8  0.0000  0.1101  0.4041  1
  Pu  Pu1  8  0.2500  0.2083  0.7500  1
  Pu  Pu2  4  0.0000  0.0000  0.0000  1
  Rh  Rh3  8  0.0000  0.1831  0.0497  1
  Rh  Rh4  8  0.2500  0.0394  0.7500  1
]