data_[Li12Ho4Ge8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ho  1.2300  1.7500  1.0410
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.4528]
_cell_length_b [4.2430]
_cell_length_c [7.9743]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.5427]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li3HoGe2]
_chemical_formula_sum '[Li12 Ho4 Ge8]'
_cell_volume [437.4700]
_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  0.0432  0.0000  0.3719  1
  Li  Li1  4  0.0995  0.5000  0.6938  1
  Li  Li2  4  0.1936  0.5000  0.4776  1
  Ho  Ho3  4  0.1481  0.0000  0.0528  1
  Ge  Ge4  4  0.0273  0.5000  0.1668  1
  Ge  Ge5  4  0.1981  0.0000  0.7218  1
]