data_[V20Ge12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [9.5758]
_cell_length_b [9.5758]
_cell_length_c [4.8531]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [V5Ge3]
_chemical_formula_sum '[V20 Ge12]'
_cell_volume [445.0020]
_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
[
  V  V0  16  0.0749  0.2286  0.0000  1.0
  V  V1  4  0.0000  0.5000  0.2500  1.0
  Ge  Ge2  8  0.1664  0.3336  0.5000  1.0
  Ge  Ge3  4  0.0000  0.0000  0.2500  1.0
]