data_[V4O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [2.9380]
_cell_length_b [4.9496]
_cell_length_c [9.3574]
_cell_angle_alpha [90.0350]
_cell_angle_beta [92.4162]
_cell_angle_gamma [90.3755]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [VO2]
_chemical_formula_sum '[V4 O8]'
_cell_volume [135.9509]
_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  1  0.2391  0.5771  0.3619  1.0
  V  V1  1  0.2438  0.9187  0.8599  1.0
  V  V2  1  0.7519  0.4182  0.6364  1.0
  V  V3  1  0.7626  0.0714  0.1332  1.0
  O  O4  1  0.2347  0.8949  0.2393  1.0
  O  O5  1  0.2383  0.6151  0.7382  1.0
  O  O6  1  0.2568  0.2891  0.5263  1.0
  O  O7  1  0.2661  0.2053  0.0218  1.0
  O  O8  1  0.7351  0.1178  0.7664  1.0
  O  O9  1  0.7411  0.7047  0.4771  1.0
  O  O10  1  0.7565  0.7950  0.9777  1.0
  O  O11  1  0.7740  0.3928  0.2619  1.0
]