The material structure described by DyTlS2O9 crystallizes in the monoclinic P2_1/c space group. Dy(1) is bonded in a 8-coordinate geometry to one O(2), one O(3), one O(4), one O(5), one O(6), one O(7), one O(8), and one O(9) atom. Tl(1) is bonded in a single-bond geometry to one O(1) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in a tetrahedral geometry to one O(2), one O(6), one O(7), and one O(8) atom. In the second S site, S(2) is bonded in a tetrahedral geometry to one O(1), one O(3), one O(4), and one O(9) atom. There are nine inequivalent O sites. In the first O site, O(5) is bonded in a single-bond geometry to one Dy(1) atom. In the second O site, O(6) is bonded in a distorted water-like geometry to one Dy(1) and one S(1) atom. In the third O site, O(7) is bonded in a distorted water-like geometry to one Dy(1) and one S(1) atom. In the fourth O site, O(8) is bonded in a bent 150 degrees geometry to one Dy(1) and one S(1) atom. In the fifth O site, O(1) is bonded in a single-bond geometry to one Tl(1) and one S(2) atom. In the sixth O site, O(9) is bonded in a bent 150 degrees geometry to one Dy(1) and one S(2) atom. In the seventh O site, O(2) is bonded in a distorted bent 150 degrees geometry to one Dy(1) and one S(1) atom. In the eighth O site, O(3) is bonded in a bent 150 degrees geometry to one Dy(1) and one S(2) atom. In the ninth O site, O(4) is bonded in a distorted bent 120 degrees geometry to one Dy(1) and one S(2) atom. is represented by the CIF card [CIF]
data_DyTlS2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.525
_cell_length_b   10.487
_cell_length_c   10.177
_cell_angle_alpha   119.833
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   789.236
_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
  Dy  Dy0  1  0.363  0.963  0.717  1.0
  Dy  Dy1  1  0.637  0.037  0.283  1.0
  Dy  Dy2  1  0.863  0.537  0.783  1.0
  Dy  Dy3  1  0.137  0.463  0.217  1.0
  Tl  Tl4  1  0.333  0.687  0.965  1.0
  Tl  Tl5  1  0.667  0.313  0.035  1.0
  Tl  Tl6  1  0.833  0.813  0.535  1.0
  Tl  Tl7  1  0.167  0.187  0.465  1.0
  S  S8  1  0.130  0.316  0.873  1.0
  S  S9  1  0.870  0.684  0.127  1.0
  S  S10  1  0.630  0.184  0.627  1.0
  S  S11  1  0.370  0.816  0.373  1.0
  S  S12  1  0.199  0.603  0.599  1.0
  S  S13  1  0.801  0.397  0.401  1.0
  S  S14  1  0.699  0.897  0.901  1.0
  S  S15  1  0.301  0.103  0.099  1.0
  O  O16  1  0.784  0.038  0.968  1.0
  O  O17  1  0.216  0.962  0.032  1.0
  O  O18  1  0.284  0.462  0.532  1.0
  O  O19  1  0.716  0.538  0.468  1.0
  O  O20  1  0.204  0.175  0.762  1.0
  O  O21  1  0.796  0.825  0.238  1.0
  O  O22  1  0.704  0.325  0.738  1.0
  O  O23  1  0.296  0.675  0.262  1.0
  O  O24  1  0.310  0.730  0.676  1.0
  O  O25  1  0.690  0.270  0.324  1.0
  O  O26  1  0.810  0.770  0.824  1.0
  O  O27  1  0.190  0.230  0.176  1.0
  O  O28  1  0.385  0.116  0.977  1.0
  O  O29  1  0.615  0.884  0.023  1.0
  O  O30  1  0.885  0.384  0.523  1.0
  O  O31  1  0.115  0.616  0.477  1.0
  O  O32  1  0.094  0.944  0.769  1.0
  O  O33  1  0.906  0.056  0.231  1.0
  O  O34  1  0.594  0.556  0.731  1.0
  O  O35  1  0.406  0.444  0.269  1.0
  O  O36  1  0.250  0.420  0.982  1.0
  O  O37  1  0.750  0.580  0.018  1.0
  O  O38  1  0.750  0.080  0.518  1.0
  O  O39  1  0.250  0.920  0.482  1.0
  O  O40  1  0.011  0.299  0.971  1.0
  O  O41  1  0.989  0.701  0.029  1.0
  O  O42  1  0.511  0.201  0.529  1.0
  O  O43  1  0.489  0.799  0.471  1.0
  O  O44  1  0.057  0.380  0.786  1.0
  O  O45  1  0.943  0.620  0.214  1.0
  O  O46  1  0.557  0.120  0.714  1.0
  O  O47  1  0.443  0.880  0.286  1.0
  O  O48  1  0.587  0.885  0.784  1.0
  O  O49  1  0.413  0.115  0.216  1.0
  O  O50  1  0.087  0.615  0.716  1.0
  O  O51  1  0.913  0.385  0.284  1.0
[/CIF]
.
The material structure described by DyTlS2O9 crystallizes in the monoclinic P2_1/c space group. Dy(1) is bonded in a 8-coordinate geometry to one O(2), one O(3), one O(4), one O(5), one O(6), one O(7), one O(8), and one O(9) atom. Tl(1) is bonded in a single-bond geometry to one O(1) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in a tetrahedral geometry to one O(2), one O(6), one O(7), and one O(8) atom. In the second S site, S(2) is bonded in a tetrahedral geometry to one O(1), one O(3), one O(4), and one O(9) atom. There are nine inequivalent O sites. In the first O site, O(5) is bonded in a single-bond geometry to one Dy(1) atom. In the second O site, O(6) is bonded in a distorted water-like geometry to one Dy(1) and one S(1) atom. In the third O site, O(7) is bonded in a distorted water-like geometry to one Dy(1) and one S(1) atom. In the fourth O site, O(8) is bonded in a bent 150 degrees geometry to one Dy(1) and one S(1) atom. In the fifth O site, O(1) is bonded in a single-bond geometry to one Tl(1) and one S(2) atom. In the sixth O site, O(9) is bonded in a bent 150 degrees geometry to one Dy(1) and one S(2) atom. In the seventh O site, O(2) is bonded in a distorted bent 150 degrees geometry to one Dy(1) and one S(1) atom. In the eighth O site, O(3) is bonded in a bent 150 degrees geometry to one Dy(1) and one S(2) atom. In the ninth O site, O(4) is bonded in a distorted bent 120 degrees geometry to one Dy(1) and one S(2) atom. is represented by the CIF card [CIF]
data_DyTlS2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.525
_cell_length_b   10.487
_cell_length_c   10.177
_cell_angle_alpha   119.833
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   789.236
_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
  Dy  Dy0  1  0.363  0.963  0.717  1.0
  Dy  Dy1  1  0.637  0.037  0.283  1.0
  Dy  Dy2  1  0.863  0.537  0.783  1.0
  Dy  Dy3  1  0.137  0.463  0.217  1.0
  Tl  Tl4  1  0.333  0.687  0.965  1.0
  Tl  Tl5  1  0.667  0.313  0.035  1.0
  Tl  Tl6  1  0.833  0.813  0.535  1.0
  Tl  Tl7  1  0.167  0.187  0.465  1.0
  S  S8  1  0.130  0.316  0.873  1.0
  S  S9  1  0.870  0.684  0.127  1.0
  S  S10  1  0.630  0.184  0.627  1.0
  S  S11  1  0.370  0.816  0.373  1.0
  S  S12  1  0.199  0.603  0.599  1.0
  S  S13  1  0.801  0.397  0.401  1.0
  S  S14  1  0.699  0.897  0.901  1.0
  S  S15  1  0.301  0.103  0.099  1.0
  O  O16  1  0.784  0.038  0.968  1.0
  O  O17  1  0.216  0.962  0.032  1.0
  O  O18  1  0.284  0.462  0.532  1.0
  O  O19  1  0.716  0.538  0.468  1.0
  O  O20  1  0.204  0.175  0.762  1.0
  O  O21  1  0.796  0.825  0.238  1.0
  O  O22  1  0.704  0.325  0.738  1.0
  O  O23  1  0.296  0.675  0.262  1.0
  O  O24  1  0.310  0.730  0.676  1.0
  O  O25  1  0.690  0.270  0.324  1.0
  O  O26  1  0.810  0.770  0.824  1.0
  O  O27  1  0.190  0.230  0.176  1.0
  O  O28  1  0.385  0.116  0.977  1.0
  O  O29  1  0.615  0.884  0.023  1.0
  O  O30  1  0.885  0.384  0.523  1.0
  O  O31  1  0.115  0.616  0.477  1.0
  O  O32  1  0.094  0.944  0.769  1.0
  O  O33  1  0.906  0.056  0.231  1.0
  O  O34  1  0.594  0.556  0.731  1.0
  O  O35  1  0.406  0.444  0.269  1.0
  O  O36  1  0.250  0.420  0.982  1.0
  O  O37  1  0.750  0.580  0.018  1.0
  O  O38  1  0.750  0.080  0.518  1.0
  O  O39  1  0.250  0.920  0.482  1.0
  O  O40  1  0.011  0.299  0.971  1.0
  O  O41  1  0.989  0.701  0.029  1.0
  O  O42  1  0.511  0.201  0.529  1.0
  O  O43  1  0.489  0.799  0.471  1.0
  O  O44  1  0.057  0.380  0.786  1.0
  O  O45  1  0.943  0.620  0.214  1.0
  O  O46  1  0.557  0.120  0.714  1.0
  O  O47  1  0.443  0.880  0.286  1.0
  O  O48  1  0.587  0.885  0.784  1.0
  O  O49  1  0.413  0.115  0.216  1.0
  O  O50  1  0.087  0.615  0.716  1.0
  O  O51  1  0.913  0.385  0.284  1.0
[/CIF]
.