The material structure described by CsLu(SO4)2 crystallizes in the monoclinic P2/c space group. Cs(1) is bonded in a 10-coordinate geometry to two equivalent O(1), two equivalent O(4), and six equivalent O(2) atoms. Lu(1) is bonded in a 6-coordinate geometry to two equivalent O(1), two equivalent O(3), and two equivalent O(4) 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 bent 150 degrees geometry to one Cs(1), one Lu(1), and one S(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to three equivalent Cs(1) and one S(1) atom. In the third O site, O(3) is bonded in a 1-coordinate geometry to one Lu(1) and one S(1) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Cs(1), one Lu(1), and one S(1) atom. is represented by the CIF card [CIF]
data_CsLu(SO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.540
_cell_length_b   9.526
_cell_length_c   8.236
_cell_angle_alpha   92.568
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   355.840
_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
  Cs  Cs0  1  0.427  0.500  0.750  1.0
  Cs  Cs1  1  0.573  0.500  0.250  1.0
  Lu  Lu2  1  0.543  0.000  0.750  1.0
  Lu  Lu3  1  0.457  0.000  0.250  1.0
  S  S4  1  0.961  0.804  0.466  1.0
  S  S5  1  0.039  0.196  0.534  1.0
  S  S6  1  0.961  0.196  0.034  1.0
  S  S7  1  0.039  0.804  0.966  1.0
  O  O8  1  0.774  0.838  0.323  1.0
  O  O9  1  0.226  0.162  0.677  1.0
  O  O10  1  0.774  0.162  0.177  1.0
  O  O11  1  0.226  0.838  0.823  1.0
  O  O12  1  0.938  0.658  0.950  1.0
  O  O13  1  0.062  0.342  0.050  1.0
  O  O14  1  0.938  0.342  0.550  1.0
  O  O15  1  0.062  0.658  0.450  1.0
  O  O16  1  0.778  0.902  0.972  1.0
  O  O17  1  0.222  0.098  0.028  1.0
  O  O18  1  0.778  0.098  0.528  1.0
  O  O19  1  0.222  0.902  0.472  1.0
  O  O20  1  0.776  0.825  0.615  1.0
  O  O21  1  0.224  0.175  0.385  1.0
  O  O22  1  0.776  0.175  0.885  1.0
  O  O23  1  0.224  0.825  0.115  1.0
[/CIF]
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The material structure described by CsLu(SO4)2 crystallizes in the monoclinic P2/c space group. Cs(1) is bonded in a 10-coordinate geometry to two equivalent O(1), two equivalent O(4), and six equivalent O(2) atoms. Lu(1) is bonded in a 6-coordinate geometry to two equivalent O(1), two equivalent O(3), and two equivalent O(4) 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 bent 150 degrees geometry to one Cs(1), one Lu(1), and one S(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to three equivalent Cs(1) and one S(1) atom. In the third O site, O(3) is bonded in a 1-coordinate geometry to one Lu(1) and one S(1) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Cs(1), one Lu(1), and one S(1) atom. is represented by the CIF card [CIF]
data_CsLu(SO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.540
_cell_length_b   9.526
_cell_length_c   8.236
_cell_angle_alpha   92.568
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   355.840
_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
  Cs  Cs0  1  0.427  0.500  0.750  1.0
  Cs  Cs1  1  0.573  0.500  0.250  1.0
  Lu  Lu2  1  0.543  0.000  0.750  1.0
  Lu  Lu3  1  0.457  0.000  0.250  1.0
  S  S4  1  0.961  0.804  0.466  1.0
  S  S5  1  0.039  0.196  0.534  1.0
  S  S6  1  0.961  0.196  0.034  1.0
  S  S7  1  0.039  0.804  0.966  1.0
  O  O8  1  0.774  0.838  0.323  1.0
  O  O9  1  0.226  0.162  0.677  1.0
  O  O10  1  0.774  0.162  0.177  1.0
  O  O11  1  0.226  0.838  0.823  1.0
  O  O12  1  0.938  0.658  0.950  1.0
  O  O13  1  0.062  0.342  0.050  1.0
  O  O14  1  0.938  0.342  0.550  1.0
  O  O15  1  0.062  0.658  0.450  1.0
  O  O16  1  0.778  0.902  0.972  1.0
  O  O17  1  0.222  0.098  0.028  1.0
  O  O18  1  0.778  0.098  0.528  1.0
  O  O19  1  0.222  0.902  0.472  1.0
  O  O20  1  0.776  0.825  0.615  1.0
  O  O21  1  0.224  0.175  0.385  1.0
  O  O22  1  0.776  0.175  0.885  1.0
  O  O23  1  0.224  0.825  0.115  1.0
[/CIF]
.