data_[Ac1H2F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  H  2.2000  0.2500  0.0000
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.9851]
_cell_length_b [6.4800]
_cell_length_c [6.8621]
_cell_angle_alpha [66.5270]
_cell_angle_beta [89.1556]
_cell_angle_gamma [73.4562]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [AcH2F8]
_chemical_formula_sum '[Ac1 H2 F8]'
_cell_volume [154.8285]
_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
[
  Ac  Ac0  1  0.5000  0.0000  0.0000  1
  H  H1  2  0.2207  0.5878  0.8242  1
  F  F2  2  0.0702  0.8492  0.2531  1
  F  F3  2  0.1583  0.7485  0.9078  1
  F  F4  2  0.2708  0.4528  0.7762  1
  F  F5  2  0.3880  0.9599  0.4454  1
]