data_[Li8In4Ge4S16]
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
  Ge  2.0100  1.2500  0.7700
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Fmm2]
_cell_length_a [7.6700]
_cell_length_b [8.6462]
_cell_length_c [10.7057]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [42]
_chemical_formula_structural [Li2InGeS4]
_chemical_formula_sum '[Li8 In4 Ge4 S16]'
_cell_volume [709.9640]
_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  0.2500  0.2500  0.2550  1.0
  In  In1  4  0.0000  0.0000  0.0179  1.0
  Ge  Ge2  4  0.0000  0.0000  0.5036  1.0
  S  S3  8  0.0000  0.2302  0.6158  1.0
  S  S4  8  0.2336  0.0000  0.3684  1.0
]