data_[Cs2P2H2O6F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  P  2.1900  1.0000  0.5500
  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 [5.5209]
_cell_length_b [6.0150]
_cell_length_c [7.9588]
_cell_angle_alpha [110.1495]
_cell_angle_beta [98.2780]
_cell_angle_gamma [91.2951]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsPHO3F]
_chemical_formula_sum '[Cs2 P2 H2 O6 F2]'
_cell_volume [244.7925]
_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  0.4062  0.1356  0.2726  1.0
  P  P1  2  0.1588  0.3711  0.7643  1.0
  H  H2  2  0.0274  0.6867  0.9680  1.0
  O  O3  2  0.1150  0.2287  0.8838  1.0
  O  O4  2  0.1303  0.6450  0.8612  1.0
  O  O5  2  0.3819  0.3340  0.6747  1.0
  F  F6  2  0.0758  0.7047  0.3964  1.0
]