data_[V4O2F12]
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 [P1]
_cell_length_a [5.2741]
_cell_length_b [6.8493]
_cell_length_c [8.4268]
_cell_angle_alpha [69.9097]
_cell_angle_beta [79.4109]
_cell_angle_gamma [88.0287]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [V2OF6]
_chemical_formula_sum '[V4 O2 F12]'
_cell_volume [280.8809]
_cell_formula_units_Z [2]
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  0.1559  0.4794  0.3341  1.0
  V  V1  1  0.2816  0.2690  0.8246  1.0
  V  V2  1  0.7048  0.7218  0.1941  1.0
  V  V3  1  0.8169  0.5249  0.6762  1.0
  O  O4  1  0.8453  0.5706  0.4184  1.0
  O  O5  1  0.9674  0.4061  0.8528  1.0
  F  F6  1  0.0498  0.6192  0.1160  1.0
  F  F7  1  0.1019  0.2225  0.3560  1.0
  F  F8  1  0.1824  0.0272  0.8249  1.0
  F  F9  1  0.2095  0.4198  0.5705  1.0
  F  F10  1  0.3398  0.1801  0.0377  1.0
  F  F11  1  0.3448  0.7510  0.2911  1.0
  F  F12  1  0.4616  0.5543  0.7668  1.0
  F  F13  1  0.5344  0.4490  0.2435  1.0
  F  F14  1  0.6327  0.2561  0.7043  1.0
  F  F15  1  0.6421  0.7877  0.9828  1.0
  F  F16  1  0.8140  0.9563  0.2024  1.0
  F  F17  1  0.9074  0.7941  0.6138  1.0
]