data_[Li10Sb2S2]
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 [Pmma]
_cell_length_a [12.8217]
_cell_length_b [4.3063]
_cell_length_c [4.3077]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [51]
_chemical_formula_structural [Li5SbS]
_chemical_formula_sum '[Li10 Sb2 S2]'
_cell_volume [237.8436]
_cell_formula_units_Z [2]
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  0.1064  0.5000  0.4900  1.0
  Li  Li1  4  0.1065  0.0000  0.9906  1.0
  Li  Li2  2  0.2500  0.0000  0.4865  1.0
  Sb  Sb3  2  0.2500  0.5000  0.9903  1.0
  S  S4  2  0.0000  0.0000  0.5000  1.0
]