data_[H8S4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  H  2.2000  0.2500  0.0000
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.4593]
_cell_length_b [6.0933]
_cell_length_c [6.1652]
_cell_angle_alpha [83.6591]
_cell_angle_beta [88.2183]
_cell_angle_gamma [87.4525]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [H2S]
_chemical_formula_sum '[H8 S4]'
_cell_volume [203.5586]
_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
[
  H  H0  1  0.0743  0.1922  0.9082  1.0
  H  H1  1  0.0985  0.1853  0.5933  1.0
  H  H2  1  0.1135  0.9126  0.2145  1.0
  H  H3  1  0.3881  0.7645  0.0664  1.0
  H  H4  1  0.5840  0.1119  0.2137  1.0
  H  H5  1  0.6304  0.6994  0.6049  1.0
  H  H6  1  0.7028  0.3952  0.0690  1.0
  H  H7  1  0.9482  0.5998  0.7339  1.0
  S  S8  1  0.2381  0.2565  0.7466  1.0
  S  S9  1  0.2620  0.7302  0.2589  1.0
  S  S10  1  0.7428  0.2642  0.2581  1.0
  S  S11  1  0.7750  0.7640  0.7584  1.0
]