data_[V4O8F4]
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 [P2_1/c]
_cell_length_a [7.1010]
_cell_length_b [5.3230]
_cell_length_c [5.7450]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.1331]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [VO2F]
_chemical_formula_sum '[V4 O8 F4]'
_cell_volume [214.3978]
_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  0.3231  0.6041  0.7538  1.0
  O  O1  4  0.2190  0.6369  0.4723  1.0
  O  O2  4  0.4982  0.6208  0.2424  1.0
  F  F3  4  0.1616  0.0904  0.3792  1.0
]