data_[Cs1H2Ru1F8]
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
  Ru  2.2000  1.3000  0.6610
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0394]
_cell_length_b [5.0521]
_cell_length_c [8.3994]
_cell_angle_alpha [90.3930]
_cell_angle_beta [103.0369]
_cell_angle_gamma [108.6590]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsH2RuF8]
_chemical_formula_sum '[Cs1 H2 Ru1 F8]'
_cell_volume [196.6546]
_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  1  0.0000  0.0000  0.5000  1.0
  H  H1  2  0.3068  0.5139  0.2819  1.0
  Ru  Ru2  1  0.0000  0.0000  0.0000  1.0
  F  F3  2  0.1884  0.2215  0.8515  1.0
  F  F4  2  0.2316  0.7708  0.0061  1.0
  F  F5  2  0.2761  0.2342  0.1863  1.0
  F  F6  2  0.3299  0.6438  0.3739  1.0
]