data_[Pu5Ru4Rh1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Ru  2.2000  1.3000  0.6610
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.3350]
_cell_length_b [3.3350]
_cell_length_c [17.4843]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Pu5Ru4Rh]
_chemical_formula_sum '[Pu5 Ru4 Rh1]'
_cell_volume [194.4597]
_cell_formula_units_Z [1]
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  2  0.5000  0.5000  0.1019  1
  Pu  Pu1  2  0.5000  0.5000  0.3011  1
  Pu  Pu2  1  0.5000  0.5000  0.5000  1
  Ru  Ru3  2  0.0000  0.0000  0.2009  1
  Ru  Ru4  2  0.0000  0.0000  0.4007  1
  Rh  Rh5  1  0.0000  0.0000  0.0000  1
]