data_V2O2F3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.6
_cell_length_b   5.6
_cell_length_c   7.26
_cell_angle_alpha   108.64
_cell_angle_beta   108.64
_cell_angle_gamma   54.54
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2O2F3
_chemical_formula_sum   'V4 O4 F6'
_cell_volume   173.15
_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  0.68  0.06  0.95  1.0
  V  V1  1  0.31  0.05  0.2  1.0
  V  V2  1  0.98  0.94  0.56  1.0
  V  V3  1  0.61  0.95  0.81  1.0
  O  O4  1  0.64  0.16  0.78  1.0
  O  O5  1  0.95  0.84  0.39  1.0
  O  O6  1  0.43  0.03  0.34  1.0
  O  O7  1  0.73  0.97  0.96  1.0
  F  F8  1  0.67  0.37  0.51  1.0
  F  F9  1  0.97  0.63  0.12  1.0
  F  F10  1  0.99  0.57  0.07  1.0
  F  F11  1  0.29  0.43  0.69  1.0
  F  F12  1  0.31  0.4  0.67  1.0
  F  F13  1  0.61  0.6  0.28  1.0

data_V2O2F3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.13
_cell_length_b   5.6
_cell_length_c   7.26
_cell_angle_alpha   108.64
_cell_angle_beta   90.0
_cell_angle_gamma   117.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2O2F3
_chemical_formula_sum   'V4 O4 F6'
_cell_volume   173.15
_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  0.05  0.44  0.19  1.0
  V  V1  1  0.06  0.08  0.44  1.0
  V  V2  1  0.94  0.26  0.05  1.0
  V  V3  1  0.95  0.64  0.8  1.0
  O  O4  1  0.03  0.3  0.04  1.0
  O  O5  1  0.16  0.21  0.61  1.0
  O  O6  1  0.84  0.2  0.22  1.0
  O  O7  1  0.97  0.54  0.66  1.0
  F  F8  1  0.37  0.4  0.88  1.0
  F  F9  1  0.4  0.78  0.72  1.0
  F  F10  1  0.43  0.44  0.93  1.0
  F  F11  1  0.57  0.28  0.31  1.0
  F  F12  1  0.6  0.3  0.33  1.0
  F  F13  1  0.63  0.97  0.49  1.0

V V V V O O O O F F F F F F