data_[Sr2Pu2H4F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Pu  1.2800  1.7500  0.9675
  H  2.2000  0.2500  0.0000
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.4321]
_cell_length_b [3.9185]
_cell_length_c [8.3290]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.0249]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SrPuH2F8]
_chemical_formula_sum '[Sr2 Pu2 H4 F16]'
_cell_volume [334.1879]
_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
[
  Sr  Sr0  2  0.0000  0.0000  0.5000  1
  Pu  Pu1  2  0.0000  0.0000  0.0000  1
  H  H2  4  0.2478  0.5000  0.6519  1
  F  F3  4  0.1013  0.0000  0.8049  1
  F  F4  4  0.1154  0.5000  0.0572  1
  F  F5  4  0.1427  0.5000  0.5680  1
  F  F6  4  0.1476  0.0000  0.2852  1
]