data_[Bi1O6F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.6264]
_cell_length_b [6.8792]
_cell_length_c [7.0058]
_cell_angle_alpha [62.4008]
_cell_angle_beta [80.0681]
_cell_angle_gamma [88.2539]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Bi(O3F)2]
_chemical_formula_sum '[Bi1 O6 F2]'
_cell_volume [152.3183]
_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
[
  Bi  Bi0  1  0.0000  0.0000  0.0000  1
  O  O1  2  0.0178  0.7163  0.9931  1
  O  O2  2  0.2355  0.2595  0.3188  1
  O  O3  2  0.2622  0.4392  0.3089  1
  F  F4  2  0.4268  0.8897  0.2261  1
]