data_[Y4Pu2Rh6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Pu  1.2800  1.7500  0.9675
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [4.8527]
_cell_length_b [4.8527]
_cell_length_c [11.9430]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Y2PuRh3]
_chemical_formula_sum '[Y4 Pu2 Rh6]'
_cell_volume [243.5669]
_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
[
  Y  Y0  2  0.3333  0.6667  0.1658  1
  Y  Y1  1  0.0000  0.0000  0.0000  1
  Y  Y2  1  0.0000  0.0000  0.5000  1
  Pu  Pu3  2  0.3333  0.6667  0.6654  1
  Rh  Rh4  2  0.0000  0.0000  0.2518  1
  Rh  Rh5  2  0.3333  0.6667  0.4155  1
  Rh  Rh6  2  0.3333  0.6667  0.9153  1
]