data_[Li8S4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.5732]
_cell_length_b [5.5592]
_cell_length_c [6.3015]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.1485]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Li2SO4]
_chemical_formula_sum '[Li8 S4 O16]'
_cell_volume [289.8937]
_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
[
  Li  Li0  4  0.0894  0.0594  0.2105  1
  Li  Li1  4  0.4895  0.2342  0.5090  1
  S  S2  4  0.2582  0.5579  0.1961  1
  O  O3  4  0.0874  0.1673  0.9083  1
  O  O4  4  0.2551  0.1473  0.8919  1
  O  O5  4  0.2565  0.7039  0.8062  1
  O  O6  4  0.4395  0.5096  0.2172  1
]