data_[V8Cr4Ge12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Cr  1.6600  1.4000  0.9400
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.5521]
_cell_length_b [9.7824]
_cell_length_c [7.7729]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [V2CrGe3]
_chemical_formula_sum '[V8 Cr4 Ge12]'
_cell_volume [346.1342]
_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  4  0.0000  0.1654  0.7500  1
  V  V1  4  0.0000  0.4996  0.7500  1
  Cr  Cr2  4  0.0000  0.1627  0.2500  1
  Ge  Ge3  8  0.0000  0.3310  0.0032  1
  Ge  Ge4  4  0.0000  0.0000  0.0000  1
]