data_[K24H16S4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  H  2.2000  0.2500  0.0000
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.2375]
_cell_length_b [13.2708]
_cell_length_c [20.1919]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [K6H4S]
_chemical_formula_sum '[K24 H16 S4]'
_cell_volume [1135.5032]
_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
[
  K  K0  8  0.0000  0.0529  0.1605  1
  K  K1  8  0.0000  0.2285  0.5866  1
  K  K2  4  0.0000  0.3260  0.2500  1
  K  K3  4  0.0000  0.5000  0.0000  1
  H  H4  8  0.0000  0.1381  0.0393  1
  H  H5  8  0.0000  0.4075  0.1242  1
  S  S6  4  0.0000  0.3374  0.7500  1
]