data_[Na4H8S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  H  2.2000  0.2500  0.0000
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.3552]
_cell_length_b [11.7801]
_cell_length_c [8.3482]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.2784]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Na(HS3)2]
_chemical_formula_sum '[Na4 H8 S24]'
_cell_volume [819.3855]
_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
[
  Na  Na0  4  0.0000  0.1049  0.2500  1
  H  H1  8  0.1052  0.3729  0.9931  1
  S  S2  8  0.0392  0.3028  0.5118  1
  S  S3  8  0.1706  0.3989  0.3645  1
  S  S4  8  0.2137  0.0250  0.0105  1
]