data_[Li20Sb4S4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [4.8451]
_cell_length_b [16.6794]
_cell_length_c [6.1765]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.7740]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li5SbS]
_chemical_formula_sum '[Li20 Sb4 S4]'
_cell_volume [498.9084]
_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  8  0.0065  0.1908  0.4946  1.0
  Li  Li1  8  0.2174  0.0377  0.0903  1.0
  Li  Li2  4  0.0000  0.3629  0.2500  1.0
  Sb  Sb3  4  0.0000  0.3326  0.7500  1.0
  S  S4  4  0.0000  0.0747  0.7500  1.0
]