data_[Cs4H24S4N8]
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
  S  2.5800  1.0000  0.8800
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [6.5860]
_cell_length_b [20.0558]
_cell_length_c [5.1118]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.9015]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsH6SN2]
_chemical_formula_sum '[Cs4 H24 S4 N8]'
_cell_volume [573.2216]
_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  0.0000  0.0789  0.2500  1.0
  H  H1  8  0.0585  0.2980  0.0768  1.0
  H  H2  8  0.1422  0.3728  0.0420  1.0
  H  H3  8  0.2064  0.1932  0.9494  1.0
  S  S4  4  0.0000  0.4850  0.7500  1.0
  N  N5  8  0.2066  0.3270  0.1487  1.0
]