data_[Pu2Bi4F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Bi  2.0200  1.6000  1.0350
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.5041]
_cell_length_b [3.9311]
_cell_length_c [5.5739]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.7152]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PuBi2F8]
_chemical_formula_sum '[Pu2 Bi4 F16]'
_cell_volume [325.3672]
_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  2  0.0000  0.5000  0.0000  1
  Bi  Bi1  4  0.1720  0.0000  0.6748  1
  F  F2  4  0.0309  0.0000  0.7907  1
  F  F3  4  0.0993  0.5000  0.4304  1
  F  F4  4  0.1511  0.5000  0.9376  1
  F  F5  4  0.2251  0.0000  0.3217  1
]