data_[Pu6Cd6Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Cd  1.6900  1.5500  1.0900
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.5510]
_cell_length_b [4.1100]
_cell_length_c [12.9731]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.1267]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [PuCdPt]
_chemical_formula_sum '[Pu6 Cd6 Pt6]'
_cell_volume [402.6139]
_cell_formula_units_Z [6]
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  0.0536  0.2500  0.2847  1
  Pu  Pu1  2  0.3423  0.7500  0.9159  1
  Pu  Pu2  2  0.4524  0.7500  0.6204  1
  Cd  Cd3  2  0.0034  0.7500  0.0859  1
  Cd  Cd4  2  0.1299  0.2500  0.5419  1
  Cd  Cd5  2  0.3822  0.7500  0.2047  1
  Pt  Pt6  2  0.2458  0.2500  0.7500  1
  Pt  Pt7  2  0.2616  0.7500  0.4113  1
  Pt  Pt8  2  0.2635  0.2500  0.0748  1
]