data_[Li3Ag12Sb9S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ag  1.9300  1.6000  1.0867
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.7187]
_cell_length_b [7.7187]
_cell_length_c [18.9321]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [LiAg4Sb3S8]
_chemical_formula_sum '[Li3 Ag12 Sb9 S24]'
_cell_volume [976.8196]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.0000  1.0
  Ag  Ag1  9  0.0000  0.5000  0.5000  1.0
  Ag  Ag2  3  -0.0000  -0.0000  0.5000  1.0
  Sb  Sb3  9  0.0000  0.5000  0.0000  1.0
  S  S4  18  0.0043  0.5021  0.7471  1.0
  S  S5  6  0.0000  0.0000  0.2487  1.0
]