data_[Cs4As2H2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  As  2.1800  1.1500  0.6600
  H  2.2000  0.2500  0.0000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.2347]
_cell_length_b [11.6354]
_cell_length_c [7.1424]
_cell_angle_alpha [90.0000]
_cell_angle_beta [132.2711]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Cs2AsHCl6]
_chemical_formula_sum '[Cs4 As2 H2 Cl12]'
_cell_volume [629.3858]
_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  4  0.0104  0.2609  0.5142  1.0
  As  As1  2  0.4979  0.5000  0.0053  1.0
  H  H2  2  0.2933  0.0000  0.7915  1.0
  Cl  Cl3  4  0.0099  0.7844  0.0132  1.0
  Cl  Cl4  2  0.2853  0.0000  0.5421  1.0
  Cl  Cl5  2  0.2891  0.5000  0.5660  1.0
  Cl  Cl6  2  0.2972  0.5000  0.0479  1.0
  Cl  Cl7  2  0.2975  0.0000  0.9968  1.0
]