data_[Ba1Ag1H2F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ag  1.9300  1.6000  1.0867
  H  2.2000  0.2500  0.0000
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.5584]
_cell_length_b [4.5989]
_cell_length_c [8.9211]
_cell_angle_alpha [81.4644]
_cell_angle_beta [89.5888]
_cell_angle_gamma [68.4940]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [BaAgH2F8]
_chemical_formula_sum '[Ba1 Ag1 H2 F8]'
_cell_volume [171.8457]
_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  0.0000  0.5000  1.0
  Ag  Ag1  1  0.0000  0.0000  0.0000  1.0
  H  H2  2  0.4775  0.4864  0.2156  1.0
  F  F3  2  0.1963  0.7722  0.2051  1.0
  F  F4  2  0.2525  0.2568  0.9959  1.0
  F  F5  2  0.3370  0.7156  0.7698  1.0
  F  F6  2  0.3490  0.3495  0.5170  1.0
]