data_[Ce2H4F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  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 [10.9741]
_cell_length_b [4.9977]
_cell_length_c [5.6335]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.4427]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CeH2F8]
_chemical_formula_sum '[Ce2 H4 F16]'
_cell_volume [274.2012]
_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
[
  Ce  Ce0  2  0.0000  0.0000  0.0000  1.0
  H  H1  4  0.1904  0.5000  0.3909  1.0
  F  F2  8  0.1088  0.1955  0.7837  1.0
  F  F3  4  0.1051  0.5000  0.2150  1.0
  F  F4  4  0.1909  0.0000  0.3604  1.0
]