data_[Cs2Cu2H4F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cu  1.9000  1.3500  0.8200
  H  2.2000  0.2500  0.0000
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.8939]
_cell_length_b [5.4076]
_cell_length_c [8.3312]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.9869]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsCuH2F8]
_chemical_formula_sum '[Cs2 Cu2 H4 F16]'
_cell_volume [387.0577]
_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  0.5000  1.0
  Cu  Cu1  2  0.0000  0.0000  0.0000  1.0
  H  H2  4  0.2219  0.5000  0.7504  1.0
  F  F3  8  0.0007  0.2325  0.8444  1.0
  F  F4  4  0.1814  0.5000  0.6290  1.0
  F  F5  4  0.2111  0.0000  0.0631  1.0
]