data_[Cs4H4Cl8]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [6.6765]
_cell_length_b [6.0492]
_cell_length_c [17.1578]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.3602]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [CsHCl2]
_chemical_formula_sum '[Cs4 H4 Cl8]'
_cell_volume [685.6013]
_cell_formula_units_Z [4]
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  4  0.3104  0.2381  0.8754  1.0
  H  H1  4  0.3001  0.0951  0.1288  1.0
  Cl  Cl2  4  0.2000  0.0909  0.6713  1.0
  Cl  Cl3  4  0.4184  0.2672  0.0831  1.0
]