data_[Li4In4S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  In  1.7800  1.5500  0.9400
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [14.8210]
_cell_length_b [4.0354]
_cell_length_c [7.0668]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.8581]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LiInS2]
_chemical_formula_sum '[Li4 In4 S8]'
_cell_volume [373.6732]
_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  2  0.0547  0.5000  0.6203  1
  Li  Li1  2  0.3093  0.5000  0.5229  1
  In  In2  2  0.0680  0.0000  0.1261  1
  In  In3  2  0.3151  0.0000  0.0726  1
  S  S4  2  0.1210  0.5000  0.3583  1
  S  S5  2  0.1249  0.0000  0.8474  1
  S  S6  2  0.3720  0.5000  0.9272  1
  S  S7  2  0.3723  0.0000  0.4501  1
]