The compound described by BaSbF5 crystallizes in the orthorhombic Pbcm space group. Ba(1) is bonded in a distorted q6 geometry to two equivalent F(2), four equivalent F(1), and four equivalent F(3) atoms. Sb(1) is bonded in a distorted square pyramidal geometry to one F(2), two equivalent F(1), and two equivalent F(3) atoms. There are three inequivalent F sites. In the first F site, F(1) is bonded in a 3-coordinate geometry to two equivalent Ba(1) and one Sb(1) atom. In the second F site, F(2) is bonded in a distorted single-bond geometry to two equivalent Ba(1) and one Sb(1) atom. In the third F site, F(3) is bonded in a 3-coordinate geometry to two equivalent Ba(1) and one Sb(1) atom. is represented by the CIF file [CIF]
data_BaSbF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.716
_cell_length_b   9.326
_cell_length_c   11.165
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   491.054
_cell_formula_units_Z   4
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  0.033  0.250  0.500  1.0
  Ba  Ba1  1  0.967  0.750  0.000  1.0
  Ba  Ba2  1  0.967  0.750  0.500  1.0
  Ba  Ba3  1  0.033  0.250  0.000  1.0
  Sb  Sb4  1  0.588  0.951  0.750  1.0
  Sb  Sb5  1  0.588  0.549  0.250  1.0
  Sb  Sb6  1  0.412  0.451  0.750  1.0
  Sb  Sb7  1  0.412  0.049  0.250  1.0
  F  F8  1  0.126  0.986  0.384  1.0
  F  F9  1  0.126  0.514  0.616  1.0
  F  F10  1  0.874  0.486  0.116  1.0
  F  F11  1  0.874  0.014  0.884  1.0
  F  F12  1  0.874  0.014  0.616  1.0
  F  F13  1  0.874  0.486  0.384  1.0
  F  F14  1  0.126  0.514  0.884  1.0
  F  F15  1  0.126  0.986  0.116  1.0
  F  F16  1  0.119  0.204  0.250  1.0
  F  F17  1  0.119  0.296  0.750  1.0
  F  F18  1  0.881  0.704  0.250  1.0
  F  F19  1  0.881  0.796  0.750  1.0
  F  F20  1  0.453  0.689  0.116  1.0
  F  F21  1  0.453  0.811  0.884  1.0
  F  F22  1  0.547  0.189  0.384  1.0
  F  F23  1  0.547  0.311  0.616  1.0
  F  F24  1  0.547  0.311  0.884  1.0
  F  F25  1  0.547  0.189  0.116  1.0
  F  F26  1  0.453  0.811  0.616  1.0
  F  F27  1  0.453  0.689  0.384  1.0
[/CIF]
.
The compound described by BaSbF5 crystallizes in the orthorhombic Pbcm space group. Ba(1) is bonded in a distorted q6 geometry to two equivalent F(2), four equivalent F(1), and four equivalent F(3) atoms. Sb(1) is bonded in a distorted square pyramidal geometry to one F(2), two equivalent F(1), and two equivalent F(3) atoms. There are three inequivalent F sites. In the first F site, F(1) is bonded in a 3-coordinate geometry to two equivalent Ba(1) and one Sb(1) atom. In the second F site, F(2) is bonded in a distorted single-bond geometry to two equivalent Ba(1) and one Sb(1) atom. In the third F site, F(3) is bonded in a 3-coordinate geometry to two equivalent Ba(1) and one Sb(1) atom. is represented by the CIF file [CIF]
data_BaSbF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.716
_cell_length_b   9.326
_cell_length_c   11.165
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   491.054
_cell_formula_units_Z   4
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  0.033  0.250  0.500  1.0
  Ba  Ba1  1  0.967  0.750  0.000  1.0
  Ba  Ba2  1  0.967  0.750  0.500  1.0
  Ba  Ba3  1  0.033  0.250  0.000  1.0
  Sb  Sb4  1  0.588  0.951  0.750  1.0
  Sb  Sb5  1  0.588  0.549  0.250  1.0
  Sb  Sb6  1  0.412  0.451  0.750  1.0
  Sb  Sb7  1  0.412  0.049  0.250  1.0
  F  F8  1  0.126  0.986  0.384  1.0
  F  F9  1  0.126  0.514  0.616  1.0
  F  F10  1  0.874  0.486  0.116  1.0
  F  F11  1  0.874  0.014  0.884  1.0
  F  F12  1  0.874  0.014  0.616  1.0
  F  F13  1  0.874  0.486  0.384  1.0
  F  F14  1  0.126  0.514  0.884  1.0
  F  F15  1  0.126  0.986  0.116  1.0
  F  F16  1  0.119  0.204  0.250  1.0
  F  F17  1  0.119  0.296  0.750  1.0
  F  F18  1  0.881  0.704  0.250  1.0
  F  F19  1  0.881  0.796  0.750  1.0
  F  F20  1  0.453  0.689  0.116  1.0
  F  F21  1  0.453  0.811  0.884  1.0
  F  F22  1  0.547  0.189  0.384  1.0
  F  F23  1  0.547  0.311  0.616  1.0
  F  F24  1  0.547  0.311  0.884  1.0
  F  F25  1  0.547  0.189  0.116  1.0
  F  F26  1  0.453  0.811  0.616  1.0
  F  F27  1  0.453  0.689  0.384  1.0
[/CIF]
.