data_[Pu2Cr1F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Cr  1.6600  1.4000  0.9400
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.8382]
_cell_length_b [5.5504]
_cell_length_c [8.0514]
_cell_angle_alpha [81.6427]
_cell_angle_beta [76.4570]
_cell_angle_gamma [82.3922]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Pu2CrF8]
_chemical_formula_sum '[Pu2 Cr1 F8]'
_cell_volume [164.1209]
_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  2  0.1278  0.5790  0.7201  1
  Cr  Cr1  1  0.5000  0.0000  0.0000  1
  F  F2  2  0.0634  0.2591  0.9948  1
  F  F3  2  0.2810  0.3281  0.5010  1
  F  F4  2  0.3517  0.6562  0.2250  1
  F  F5  2  0.4638  0.1485  0.2211  1
]