data_[B3F10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  B  2.0400  0.8500  0.4100
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P31m]
_cell_length_a [7.3586]
_cell_length_b [7.3586]
_cell_length_c [18.3931]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [157]
_chemical_formula_structural [B3F10]
_chemical_formula_sum '[B3 F10]'
_cell_volume [862.5381]
_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
[
  B  B0  2  0.3333  0.6667  0.5610  1
  B  B1  1  0.0000  0.0000  0.4018  1
  F  F2  6  0.2292  0.4585  0.5612  1
  F  F3  3  0.0000  0.8191  0.3768  1
  F  F4  1  0.0000  0.0000  0.4785  1
]