data_[Ba1V1Ag2F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  V  1.6300  1.3500  0.7775
  Ag  1.9300  1.6000  1.0867
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.6253]
_cell_length_b [7.6993]
_cell_length_c [5.6919]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.1365]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [BaVAg2F8]
_chemical_formula_sum '[Ba1 V1 Ag2 F8]'
_cell_volume [202.5562]
_cell_formula_units_Z [1]
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
[
  Ba  Ba0  1  0.0000  0.5000  0.0000  1.0
  V  V1  1  0.0000  0.0000  0.0000  1.0
  Ag  Ag2  2  0.5000  0.2466  0.5000  1.0
  F  F3  4  0.1468  0.1835  0.8098  1.0
  F  F4  2  0.3175  0.0000  0.2053  1.0
  F  F5  2  0.4905  0.5000  0.2512  1.0
]