The compound described by (Ce(SO4)2)4O2 crystallizes in the monoclinic Pm space group. The structure consists of one water atom inside a Ce(SO4)2 framework. In the Ce(SO4)2 framework, there are two inequivalent Ce sites. In the first Ce site, Ce(1) is bonded in a 7-coordinate geometry to one O(1), one O(3), one O(4), two equivalent O(2), and two equivalent O(5) atoms. In the second Ce site, Ce(2) is bonded in a 7-coordinate geometry to one O(10), one O(11), one O(7), two equivalent O(8), and two equivalent O(9) atoms. There are four inequivalent S sites. In the first S site, S(1) is bonded in a tetrahedral geometry to one O(1), one O(3), and two equivalent O(8) atoms. In the second S site, S(2) is bonded in a tetrahedral geometry to one O(10), one O(6), and two equivalent O(2) atoms. In the third S site, S(3) is bonded in a tetrahedral geometry to one O(11), one O(7), and two equivalent O(5) atoms. In the fourth S site, S(4) is bonded in a tetrahedral geometry to one O(12), one O(4), and two equivalent O(9) atoms. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 150 degrees geometry to one Ce(1) and one S(1) atom. In the second O site, O(2) is bonded in a distorted water-like geometry to one Ce(1) and one S(2) atom. In the third O site, O(3) is bonded in a linear geometry to one Ce(1) and one S(1) atom. In the fourth O site, O(4) is bonded in a distorted linear geometry to one Ce(1) and one S(4) atom. In the fifth O site, O(5) is bonded in a distorted bent 150 degrees geometry to one Ce(1) and one S(3) atom. In the sixth O site, O(6) is bonded in a single-bond geometry to one S(2) atom. In the seventh O site, O(7) is bonded in a distorted bent 150 degrees geometry to one Ce(2) and one S(3) atom. In the eighth O site, O(8) is bonded in a distorted bent 150 degrees geometry to one Ce(2) and one S(1) atom. In the ninth O site, O(9) is bonded in a water-like geometry to one Ce(2) and one S(4) atom. In the tenth O site, O(10) is bonded in a distorted linear geometry to one Ce(2) and one S(2) atom. In the eleventh O site, O(11) is bonded in a linear geometry to one Ce(2) and one S(3) atom. In the twelfth O site, O(12) is bonded in a single-bond geometry to one S(4) atom. is represented by the CIF card [CIF]
data_Ce2S4O17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.395
_cell_length_b   6.912
_cell_length_c   9.161
_cell_angle_alpha   80.705
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   337.115
_cell_formula_units_Z   1
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
  Ce  Ce0  1  0.500  0.794  0.063  1.0
  Ce  Ce1  1  0.000  0.183  0.521  1.0
  S  S2  1  0.500  0.263  0.231  1.0
  S  S3  1  0.000  0.801  0.869  1.0
  S  S4  1  0.000  0.715  0.352  1.0
  S  S5  1  0.500  0.169  0.711  1.0
  O  O6  1  0.500  0.435  0.114  1.0
  O  O7  1  0.772  0.678  0.888  1.0
  O  O8  1  0.228  0.678  0.888  1.0
  O  O9  1  0.500  0.082  0.164  1.0
  O  O10  1  0.500  0.050  0.861  1.0
  O  O11  1  0.225  0.714  0.259  1.0
  O  O12  1  0.775  0.714  0.259  1.0
  O  O13  1  0.000  0.923  0.990  1.0
  O  O14  1  0.000  0.541  0.469  1.0
  O  O15  1  0.276  0.265  0.325  1.0
  O  O16  1  0.724  0.265  0.325  1.0
  O  O17  1  0.273  0.294  0.693  1.0
  O  O18  1  0.727  0.294  0.693  1.0
  O  O19  1  0.000  0.922  0.720  1.0
  O  O20  1  0.000  0.895  0.421  1.0
  O  O21  1  0.500  0.046  0.592  1.0
  O  O22  1  0.000  0.300  0.980  1.0
[/CIF]
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The compound described by (Ce(SO4)2)4O2 crystallizes in the monoclinic Pm space group. The structure consists of one water atom inside a Ce(SO4)2 framework. In the Ce(SO4)2 framework, there are two inequivalent Ce sites. In the first Ce site, Ce(1) is bonded in a 7-coordinate geometry to one O(1), one O(3), one O(4), two equivalent O(2), and two equivalent O(5) atoms. In the second Ce site, Ce(2) is bonded in a 7-coordinate geometry to one O(10), one O(11), one O(7), two equivalent O(8), and two equivalent O(9) atoms. There are four inequivalent S sites. In the first S site, S(1) is bonded in a tetrahedral geometry to one O(1), one O(3), and two equivalent O(8) atoms. In the second S site, S(2) is bonded in a tetrahedral geometry to one O(10), one O(6), and two equivalent O(2) atoms. In the third S site, S(3) is bonded in a tetrahedral geometry to one O(11), one O(7), and two equivalent O(5) atoms. In the fourth S site, S(4) is bonded in a tetrahedral geometry to one O(12), one O(4), and two equivalent O(9) atoms. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 150 degrees geometry to one Ce(1) and one S(1) atom. In the second O site, O(2) is bonded in a distorted water-like geometry to one Ce(1) and one S(2) atom. In the third O site, O(3) is bonded in a linear geometry to one Ce(1) and one S(1) atom. In the fourth O site, O(4) is bonded in a distorted linear geometry to one Ce(1) and one S(4) atom. In the fifth O site, O(5) is bonded in a distorted bent 150 degrees geometry to one Ce(1) and one S(3) atom. In the sixth O site, O(6) is bonded in a single-bond geometry to one S(2) atom. In the seventh O site, O(7) is bonded in a distorted bent 150 degrees geometry to one Ce(2) and one S(3) atom. In the eighth O site, O(8) is bonded in a distorted bent 150 degrees geometry to one Ce(2) and one S(1) atom. In the ninth O site, O(9) is bonded in a water-like geometry to one Ce(2) and one S(4) atom. In the tenth O site, O(10) is bonded in a distorted linear geometry to one Ce(2) and one S(2) atom. In the eleventh O site, O(11) is bonded in a linear geometry to one Ce(2) and one S(3) atom. In the twelfth O site, O(12) is bonded in a single-bond geometry to one S(4) atom. is represented by the CIF card [CIF]
data_Ce2S4O17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.395
_cell_length_b   6.912
_cell_length_c   9.161
_cell_angle_alpha   80.705
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   337.115
_cell_formula_units_Z   1
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
  Ce  Ce0  1  0.500  0.794  0.063  1.0
  Ce  Ce1  1  0.000  0.183  0.521  1.0
  S  S2  1  0.500  0.263  0.231  1.0
  S  S3  1  0.000  0.801  0.869  1.0
  S  S4  1  0.000  0.715  0.352  1.0
  S  S5  1  0.500  0.169  0.711  1.0
  O  O6  1  0.500  0.435  0.114  1.0
  O  O7  1  0.772  0.678  0.888  1.0
  O  O8  1  0.228  0.678  0.888  1.0
  O  O9  1  0.500  0.082  0.164  1.0
  O  O10  1  0.500  0.050  0.861  1.0
  O  O11  1  0.225  0.714  0.259  1.0
  O  O12  1  0.775  0.714  0.259  1.0
  O  O13  1  0.000  0.923  0.990  1.0
  O  O14  1  0.000  0.541  0.469  1.0
  O  O15  1  0.276  0.265  0.325  1.0
  O  O16  1  0.724  0.265  0.325  1.0
  O  O17  1  0.273  0.294  0.693  1.0
  O  O18  1  0.727  0.294  0.693  1.0
  O  O19  1  0.000  0.922  0.720  1.0
  O  O20  1  0.000  0.895  0.421  1.0
  O  O21  1  0.500  0.046  0.592  1.0
  O  O22  1  0.000  0.300  0.980  1.0
[/CIF]
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