data_[K4Li4Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Li  0.9800  1.4500  0.9000
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8791]
_cell_length_b [4.5461]
_cell_length_c [11.5153]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.3877]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [KLiGe]
_chemical_formula_sum '[K4 Li4 Ge4]'
_cell_volume [399.5346]
_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
[
  K  K0  4  0.2232  0.0000  0.6979  1.0
  Li  Li1  4  0.1577  0.5000  0.9764  1.0
  Ge  Ge2  4  0.0387  0.0000  0.1061  1.0
]