data_[Cs2Ti2F10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ti  1.5400  1.4000  0.8517
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [8.1619]
_cell_length_b [9.5489]
_cell_length_c [4.0598]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [CsTiF5]
_chemical_formula_sum '[Cs2 Ti2 F10]'
_cell_volume [316.4111]
_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
[
  Cs  Cs0  2  0.0000  0.0000  0.0065  1
  Ti  Ti1  2  0.0000  0.5000  0.0253  1
  F  F2  4  0.0000  0.3081  0.9711  1
  F  F3  4  0.2289  0.5000  0.0019  1
  F  F4  2  0.0000  0.5000  0.4913  1
]