data_[Li8Ge8]
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
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [10.7820]
_cell_length_b [4.3087]
_cell_length_c [5.7143]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [LiGe]
_chemical_formula_sum '[Li8 Ge8]'
_cell_volume [265.4671]
_cell_formula_units_Z [8]
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  0.0682  0.2500  0.1639  1.0
  Li  Li1  4  0.1641  0.7500  0.4099  1.0
  Ge  Ge2  4  0.1009  0.2500  0.6732  1.0
  Ge  Ge3  4  0.1775  0.7500  0.9221  1.0
]