The material structure described by AlSO2Cl3 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of one AlSO2Cl3 cluster. Al(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one Cl(1), and one Cl(3) atom. S(1) is bonded in a distorted trigonal non-coplanar geometry to one O(1), one O(2), and one Cl(2) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to one Al(1) and one S(1) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one Al(1) and one S(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one Al(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one S(1) atom. In the third Cl site, Cl(3) is bonded in a single-bond geometry to one Al(1) atom. is represented by the CIF card [CIF]
data_AlSCl3O2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.487
_cell_length_b   7.788
_cell_length_c   8.083
_cell_angle_alpha   93.408
_cell_angle_beta   106.132
_cell_angle_gamma   109.942
_symmetry_Int_Tables_number   1
_cell_volume   363.333
_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
  Al  Al0  1  0.703  0.196  0.845  1.0
  Al  Al1  1  0.297  0.804  0.155  1.0
  S  S2  1  0.390  0.764  0.778  1.0
  S  S3  1  0.610  0.236  0.222  1.0
  Cl  Cl4  1  0.936  0.723  0.091  1.0
  Cl  Cl5  1  0.084  0.798  0.641  1.0
  Cl  Cl6  1  0.064  0.277  0.909  1.0
  Cl  Cl7  1  0.458  0.679  0.347  1.0
  Cl  Cl8  1  0.916  0.202  0.359  1.0
  Cl  Cl9  1  0.542  0.321  0.653  1.0
  O  O10  1  0.577  0.944  0.776  1.0
  O  O11  1  0.620  0.231  0.037  1.0
  O  O12  1  0.380  0.769  0.963  1.0
  O  O13  1  0.423  0.056  0.224  1.0
[/CIF]
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The material structure described by AlSO2Cl3 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of one AlSO2Cl3 cluster. Al(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one Cl(1), and one Cl(3) atom. S(1) is bonded in a distorted trigonal non-coplanar geometry to one O(1), one O(2), and one Cl(2) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to one Al(1) and one S(1) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one Al(1) and one S(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one Al(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one S(1) atom. In the third Cl site, Cl(3) is bonded in a single-bond geometry to one Al(1) atom. is represented by the CIF card [CIF]
data_AlSCl3O2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.487
_cell_length_b   7.788
_cell_length_c   8.083
_cell_angle_alpha   93.408
_cell_angle_beta   106.132
_cell_angle_gamma   109.942
_symmetry_Int_Tables_number   1
_cell_volume   363.333
_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
  Al  Al0  1  0.703  0.196  0.845  1.0
  Al  Al1  1  0.297  0.804  0.155  1.0
  S  S2  1  0.390  0.764  0.778  1.0
  S  S3  1  0.610  0.236  0.222  1.0
  Cl  Cl4  1  0.936  0.723  0.091  1.0
  Cl  Cl5  1  0.084  0.798  0.641  1.0
  Cl  Cl6  1  0.064  0.277  0.909  1.0
  Cl  Cl7  1  0.458  0.679  0.347  1.0
  Cl  Cl8  1  0.916  0.202  0.359  1.0
  Cl  Cl9  1  0.542  0.321  0.653  1.0
  O  O10  1  0.577  0.944  0.776  1.0
  O  O11  1  0.620  0.231  0.037  1.0
  O  O12  1  0.380  0.769  0.963  1.0
  O  O13  1  0.423  0.056  0.224  1.0
[/CIF]
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