data_[Pu12Sb2Pd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [5.4485]
_cell_length_b [6.0267]
_cell_length_c [16.2356]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Pu6SbPd5]
_chemical_formula_sum '[Pu12 Sb2 Pd10]'
_cell_volume [533.1237]
_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  8  0.0000  0.2531  0.8280  1
  Pu  Pu1  4  0.0000  0.2424  0.5000  1
  Sb  Sb2  2  0.0000  0.0000  0.0000  1
  Pd  Pd3  4  0.0000  0.0000  0.3337  1
  Pd  Pd4  4  0.0000  0.5000  0.3354  1
  Pd  Pd5  2  0.0000  0.5000  0.0000  1
]