data_[V56O48F72]
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 [Aea2]
_cell_length_a [9.9524]
_cell_length_b [35.9321]
_cell_length_c [5.0963]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [41]
_chemical_formula_structural [V7(O2F3)3]
_chemical_formula_sum '[V56 O48 F72]'
_cell_volume [1822.4959]
_cell_formula_units_Z [8]
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  8  0.1003  0.3948  0.7084  1
  V  V1  8  0.1014  0.4642  0.2773  1
  V  V2  8  0.1016  0.1044  0.7102  1
  V  V3  8  0.1019  0.0354  0.2782  1
  V  V4  8  0.1033  0.3261  0.2630  1
  V  V5  8  0.1053  0.2541  0.7079  1
  V  V6  8  0.1078  0.1732  0.2920  1
  O  O7  8  0.0138  0.2858  0.9936  1
  O  O8  8  0.0182  0.1439  0.9935  1
  O  O9  8  0.0194  0.3588  0.9951  1
  O  O10  8  0.0195  0.4288  0.9854  1
  O  O11  8  0.0196  0.0717  0.9874  1
  O  O12  4  0.0000  0.0000  0.0305  1
  O  O13  4  0.0000  0.0000  0.5320  1
  F  F14  8  0.0347  0.2152  0.9874  1
  F  F15  8  0.2034  0.3076  0.6097  1
  F  F16  8  0.2144  0.2479  0.3681  1
  F  F17  8  0.2154  0.1238  0.3704  1
  F  F18  8  0.2170  0.1855  0.6216  1
  F  F19  8  0.2198  0.3717  0.3636  1
  F  F20  8  0.2230  0.0607  0.5985  1
  F  F21  8  0.2245  0.4370  0.5928  1
  F  F22  8  0.2484  0.4990  0.8505  1
]