data_[Li2Ge2Pb4S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ge  2.0100  1.2500  0.7700
  Pb  2.3300  1.8000  1.1225
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [8.0123]
_cell_length_b [8.8728]
_cell_length_c [5.9798]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [LiGe(PbS2)2]
_chemical_formula_sum '[Li2 Ge2 Pb4 S8]'
_cell_volume [425.1099]
_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  2  0.0000  0.1372  0.5177  1
  Ge  Ge1  2  0.0000  0.8470  0.0085  1
  Pb  Pb2  4  0.2382  0.3367  0.0494  1
  S  S3  4  0.2392  0.7034  0.0794  1
  S  S4  2  0.0000  0.1072  0.0994  1
  S  S5  2  0.0000  0.8639  0.6168  1
]