data_[Ce16Pu4Os4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Pu  1.2800  1.7500  0.9675
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.0308]
_cell_length_b [8.4318]
_cell_length_c [12.0630]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.4832]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ce4PuOs]
_chemical_formula_sum '[Ce16 Pu4 Os4]'
_cell_volume [603.2373]
_cell_formula_units_Z [4]
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
[
  Ce  Ce0  4  0.0035  0.1234  0.3773  1
  Ce  Ce1  4  0.1369  0.2064  0.1596  1
  Ce  Ce2  4  0.3986  0.6716  0.8945  1
  Ce  Ce3  4  0.4246  0.5824  0.6154  1
  Pu  Pu4  4  0.1137  0.0545  0.8900  1
  Os  Os5  4  0.3610  0.5560  0.1140  1
]