data_[Cs2H2O1F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  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 [P-1]
_cell_length_a [4.4700]
_cell_length_b [4.8157]
_cell_length_c [6.8354]
_cell_angle_alpha [85.3383]
_cell_angle_beta [78.1164]
_cell_angle_gamma [81.1308]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cs2H2OF2]
_chemical_formula_sum '[Cs2 H2 O1 F2]'
_cell_volume [142.0806]
_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
[
  Cs  Cs0  2  0.3378  0.2982  0.2635  1.0
  H  H1  2  0.0966  0.1182  0.8783  1.0
  O  O2  1  0.0000  0.0000  0.0000  1.0
  F  F3  2  0.2437  0.2708  0.7067  1.0
]