data_[Pu6Tc1Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Tc  1.9000  1.3500  0.7417
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-31m]
_cell_length_a [7.6919]
_cell_length_b [7.6919]
_cell_length_c [2.8940]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [162]
_chemical_formula_structural [Pu6TcRh2]
_chemical_formula_sum '[Pu6 Tc1 Rh2]'
_cell_volume [148.2809]
_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  6  0.0000  0.3230  0.0831  1
  Tc  Tc1  1  0.0000  0.0000  0.5000  1
  Rh  Rh2  2  0.3333  0.6667  0.5000  1
]