data_[Ba2Li2Ag4F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Li  0.9800  1.4500  0.9000
  Ag  1.9300  1.6000  1.0867
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.2167]
_cell_length_b [5.9856]
_cell_length_c [5.8739]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.1096]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [BaLiAg2F6]
_chemical_formula_sum '[Ba2 Li2 Ag4 F12]'
_cell_volume [325.2564]
_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
[
  Ba  Ba0  2  0.0000  0.0000  0.5000  1
  Li  Li1  2  0.0000  0.5000  0.0000  1
  Ag  Ag2  4  0.2342  0.5000  0.7734  1
  F  F3  8  0.0951  0.2674  0.8868  1
  F  F4  4  0.2500  0.2500  0.5000  1
]