data_[V2Ag6Br4F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Ag  1.9300  1.6000  1.0867
  Br  2.9600  1.1500  0.8825
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.8898]
_cell_length_b [6.9540]
_cell_length_c [5.0424]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.6318]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [VAg3(BrF3)2]
_chemical_formula_sum '[V2 Ag6 Br4 F12]'
_cell_volume [484.6951]
_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  2  0.0000  0.0000  0.5000  1.0
  Ag  Ag1  4  0.2500  0.2500  0.5000  1.0
  Ag  Ag2  2  0.0000  0.5000  0.0000  1.0
  Br  Br3  4  0.1875  0.5000  0.1457  1.0
  F  F4  8  0.0590  0.1876  0.7124  1.0
  F  F5  4  0.1040  0.0000  0.3036  1.0
]