data_[Li4Al8P4S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Al  1.6100  1.2500  0.6750
  P  2.1900  1.0000  0.5500
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.1230]
_cell_length_b [13.4682]
_cell_length_c [6.7818]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.8263]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiAl2PS6]
_chemical_formula_sum '[Li4 Al8 P4 S24]'
_cell_volume [1039.8657]
_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  0.0000  0.3456  0.7500  1
  Al  Al1  8  0.2243  0.4224  0.6358  1
  P  P2  4  0.0000  0.2049  0.2500  1
  S  S3  8  0.0864  0.1245  0.1190  1
  S  S4  8  0.1111  0.2775  0.5524  1
  S  S5  8  0.1779  0.4482  0.9110  1
]