data_[V8O12F4]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Pna2_1]
_cell_length_a [10.4641]
_cell_length_b [4.8349]
_cell_length_c [5.6802]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [33]
_chemical_formula_structural [V2O3F]
_chemical_formula_sum '[V8 O12 F4]'
_cell_volume [287.3789]
_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  0.0305  0.0758  0.5089  1
  V  V1  4  0.2353  0.5688  0.7402  1
  O  O2  4  0.0865  0.8134  0.7543  1
  O  O3  4  0.0969  0.8638  0.2481  1
  O  O4  4  0.1635  0.3019  0.4990  1
  F  F5  4  0.1736  0.3095  0.9935  1
]