data_[Ba2Ga2B2O6F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ga  1.8100  1.3000  0.7600
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P6_3/m]
_cell_length_a [4.9478]
_cell_length_b [4.9478]
_cell_length_c [9.8662]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [176]
_chemical_formula_structural [BaGaBO3F2]
_chemical_formula_sum '[Ba2 Ga2 B2 O6 F4]'
_cell_volume [209.1751]
_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  0.0000  1.0
  Ga  Ga1  2  0.3333  0.6667  0.7500  1.0
  B  B2  2  0.3333  0.6667  0.2500  1.0
  O  O3  6  0.0655  0.6889  0.2500  1.0
  F  F4  4  0.3333  0.6667  0.5477  1.0
]