data_[Zn8H8F24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  H  2.2000  0.2500  0.0000
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.4954]
_cell_length_b [7.4636]
_cell_length_c [5.9227]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.4126]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [ZnHF3]
_chemical_formula_sum '[Zn8 H8 F24]'
_cell_volume [461.0400]
_cell_formula_units_Z [8]
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
[
  Zn  Zn0  4  0.0000  0.0605  0.7500  1.0
  Zn  Zn1  4  0.0000  0.3882  0.2500  1.0
  H  H2  8  0.1598  0.2992  0.6506  1.0
  F  F3  8  0.0502  0.1620  0.0695  1.0
  F  F4  8  0.1123  0.4510  0.5690  1.0
  F  F5  8  0.1806  0.1691  0.7029  1.0
]