The compound described by CsSO4 crystallizes in the monoclinic P2_1/c space group. Cs(1) is bonded in a 11-coordinate geometry to two equivalent O(1), two equivalent O(3), three equivalent O(4), and four equivalent O(2) atoms. S(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one O(3), and one O(4) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to two equivalent Cs(1) and one S(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to four equivalent Cs(1) and one S(1) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to two equivalent Cs(1) and one S(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one S(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_CsSO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.548
_cell_length_b   6.669
_cell_length_c   9.928
_cell_angle_alpha   56.675
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   472.886
_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
  Cs  Cs0  1  0.380  0.077  0.653  1.0
  Cs  Cs1  1  0.120  0.077  0.153  1.0
  Cs  Cs2  1  0.620  0.923  0.347  1.0
  Cs  Cs3  1  0.880  0.923  0.847  1.0
  S  S4  1  0.142  0.563  0.640  1.0
  S  S5  1  0.358  0.563  0.140  1.0
  S  S6  1  0.858  0.437  0.360  1.0
  S  S7  1  0.642  0.437  0.860  1.0
  O  O8  1  0.987  0.585  0.528  1.0
  O  O9  1  0.513  0.585  0.028  1.0
  O  O10  1  0.013  0.415  0.472  1.0
  O  O11  1  0.487  0.415  0.972  1.0
  O  O12  1  0.278  0.647  0.534  1.0
  O  O13  1  0.222  0.647  0.034  1.0
  O  O14  1  0.722  0.353  0.466  1.0
  O  O15  1  0.778  0.353  0.966  1.0
  O  O16  1  0.086  0.726  0.683  1.0
  O  O17  1  0.414  0.726  0.183  1.0
  O  O18  1  0.914  0.274  0.317  1.0
  O  O19  1  0.586  0.274  0.817  1.0
  O  O20  1  0.150  0.310  0.772  1.0
  O  O21  1  0.350  0.310  0.272  1.0
  O  O22  1  0.850  0.690  0.228  1.0
  O  O23  1  0.650  0.690  0.728  1.0
[/CIF]
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The compound described by CsSO4 crystallizes in the monoclinic P2_1/c space group. Cs(1) is bonded in a 11-coordinate geometry to two equivalent O(1), two equivalent O(3), three equivalent O(4), and four equivalent O(2) atoms. S(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one O(3), and one O(4) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to two equivalent Cs(1) and one S(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to four equivalent Cs(1) and one S(1) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to two equivalent Cs(1) and one S(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one S(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_CsSO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.548
_cell_length_b   6.669
_cell_length_c   9.928
_cell_angle_alpha   56.675
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   472.886
_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
  Cs  Cs0  1  0.380  0.077  0.653  1.0
  Cs  Cs1  1  0.120  0.077  0.153  1.0
  Cs  Cs2  1  0.620  0.923  0.347  1.0
  Cs  Cs3  1  0.880  0.923  0.847  1.0
  S  S4  1  0.142  0.563  0.640  1.0
  S  S5  1  0.358  0.563  0.140  1.0
  S  S6  1  0.858  0.437  0.360  1.0
  S  S7  1  0.642  0.437  0.860  1.0
  O  O8  1  0.987  0.585  0.528  1.0
  O  O9  1  0.513  0.585  0.028  1.0
  O  O10  1  0.013  0.415  0.472  1.0
  O  O11  1  0.487  0.415  0.972  1.0
  O  O12  1  0.278  0.647  0.534  1.0
  O  O13  1  0.222  0.647  0.034  1.0
  O  O14  1  0.722  0.353  0.466  1.0
  O  O15  1  0.778  0.353  0.966  1.0
  O  O16  1  0.086  0.726  0.683  1.0
  O  O17  1  0.414  0.726  0.183  1.0
  O  O18  1  0.914  0.274  0.317  1.0
  O  O19  1  0.586  0.274  0.817  1.0
  O  O20  1  0.150  0.310  0.772  1.0
  O  O21  1  0.350  0.310  0.272  1.0
  O  O22  1  0.850  0.690  0.228  1.0
  O  O23  1  0.650  0.690  0.728  1.0
[/CIF]
.