data_[Ti2H28O12F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.9511]
_cell_length_b [16.2047]
_cell_length_c [7.3811]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.9377]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [TiH14(OF)6]
_chemical_formula_sum '[Ti2 H28 O12 F12]'
_cell_volume [690.8406]
_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
[
  Ti  Ti0  2  0.0000  0.0000  0.0000  1
  H  H1  4  0.1729  0.2030  0.6764  1
  H  H2  4  0.1987  0.6985  0.4515  1
  H  H3  4  0.2742  0.1990  0.6329  1
  H  H4  4  0.3090  0.5702  0.2082  1
  H  H5  4  0.3563  0.6127  0.2028  1
  H  H6  4  0.4006  0.5507  0.7715  1
  H  H7  4  0.4554  0.0777  0.8945  1
  O  O8  4  0.0614  0.0373  0.2620  1
  O  O9  4  0.1930  0.6023  0.5503  1
  O  O10  4  0.4203  0.5960  0.6810  1
  F  F11  4  0.2277  0.7476  0.3884  1
  F  F12  4  0.2777  0.0553  0.9751  1
  F  F13  4  0.3022  0.0231  0.3671  1
]