The material described by SbCl4F is Indium-like structured and crystallizes in the tetragonal I-4 space group. The structure is zero-dimensional and consists of two SbCl4F clusters. Sb(1) is bonded to one Cl(1), one Cl(2), one Cl(3), one Cl(4), and two equivalent F(1) atoms to form corner-sharing SbCl4F2 octahedra. The corner-sharing octahedral tilt angles are 11°. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one Sb(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one Sb(1) atom. In the third Cl site, Cl(3) is bonded in a single-bond geometry to one Sb(1) atom. In the fourth Cl site, Cl(4) is bonded in a single-bond geometry to one Sb(1) atom. F(1) is bonded in a linear geometry to two equivalent Sb(1) atoms. is represented by the CIF card [CIF]
data_SbCl4F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.068
_cell_length_b   10.069
_cell_length_c   10.073
_cell_angle_alpha   99.005
_cell_angle_beta   98.973
_cell_angle_gamma   133.414
_symmetry_Int_Tables_number   1
_cell_volume   681.343
_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
  Sb  Sb0  1  0.194  0.020  0.267  1.0
  Sb  Sb1  1  0.980  0.247  0.174  1.0
  Sb  Sb2  1  0.072  0.806  0.826  1.0
  Sb  Sb3  1  0.754  0.928  0.733  1.0
  Cl  Cl4  1  0.484  0.304  0.260  1.0
  Cl  Cl5  1  0.044  0.224  0.739  1.0
  Cl  Cl6  1  0.776  0.516  0.820  1.0
  Cl  Cl7  1  0.696  0.956  0.180  1.0
  Cl  Cl8  1  0.657  0.752  0.498  1.0
  Cl  Cl9  1  0.248  0.745  0.905  1.0
  Cl  Cl10  1  0.840  0.343  0.095  1.0
  Cl  Cl11  1  0.255  0.160  0.503  1.0
  Cl  Cl12  1  0.117  0.416  0.420  1.0
  Cl  Cl13  1  0.584  0.005  0.701  1.0
  Cl  Cl14  1  0.304  0.883  0.299  1.0
  Cl  Cl15  1  0.995  0.696  0.579  1.0
  Cl  Cl16  1  0.522  0.656  0.789  1.0
  Cl  Cl17  1  0.344  0.134  0.867  1.0
  Cl  Cl18  1  0.267  0.478  0.133  1.0
  Cl  Cl19  1  0.866  0.733  0.211  1.0
  F  F20  1  0.925  0.884  0.800  1.0
  F  F21  1  0.084  0.125  0.200  1.0
  F  F22  1  0.874  0.074  0.958  1.0
  F  F23  1  0.116  0.916  0.042  1.0
[/CIF]
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The material described by SbCl4F is Indium-like structured and crystallizes in the tetragonal I-4 space group. The structure is zero-dimensional and consists of two SbCl4F clusters. Sb(1) is bonded to one Cl(1), one Cl(2), one Cl(3), one Cl(4), and two equivalent F(1) atoms to form corner-sharing SbCl4F2 octahedra. The corner-sharing octahedral tilt angles are 11°. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one Sb(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one Sb(1) atom. In the third Cl site, Cl(3) is bonded in a single-bond geometry to one Sb(1) atom. In the fourth Cl site, Cl(4) is bonded in a single-bond geometry to one Sb(1) atom. F(1) is bonded in a linear geometry to two equivalent Sb(1) atoms. is represented by the CIF card [CIF]
data_SbCl4F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.068
_cell_length_b   10.069
_cell_length_c   10.073
_cell_angle_alpha   99.005
_cell_angle_beta   98.973
_cell_angle_gamma   133.414
_symmetry_Int_Tables_number   1
_cell_volume   681.343
_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
  Sb  Sb0  1  0.194  0.020  0.267  1.0
  Sb  Sb1  1  0.980  0.247  0.174  1.0
  Sb  Sb2  1  0.072  0.806  0.826  1.0
  Sb  Sb3  1  0.754  0.928  0.733  1.0
  Cl  Cl4  1  0.484  0.304  0.260  1.0
  Cl  Cl5  1  0.044  0.224  0.739  1.0
  Cl  Cl6  1  0.776  0.516  0.820  1.0
  Cl  Cl7  1  0.696  0.956  0.180  1.0
  Cl  Cl8  1  0.657  0.752  0.498  1.0
  Cl  Cl9  1  0.248  0.745  0.905  1.0
  Cl  Cl10  1  0.840  0.343  0.095  1.0
  Cl  Cl11  1  0.255  0.160  0.503  1.0
  Cl  Cl12  1  0.117  0.416  0.420  1.0
  Cl  Cl13  1  0.584  0.005  0.701  1.0
  Cl  Cl14  1  0.304  0.883  0.299  1.0
  Cl  Cl15  1  0.995  0.696  0.579  1.0
  Cl  Cl16  1  0.522  0.656  0.789  1.0
  Cl  Cl17  1  0.344  0.134  0.867  1.0
  Cl  Cl18  1  0.267  0.478  0.133  1.0
  Cl  Cl19  1  0.866  0.733  0.211  1.0
  F  F20  1  0.925  0.884  0.800  1.0
  F  F21  1  0.084  0.125  0.200  1.0
  F  F22  1  0.874  0.074  0.958  1.0
  F  F23  1  0.116  0.916  0.042  1.0
[/CIF]
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