The compound described by HoTlS2O9 crystallizes in the monoclinic P2_1/c space group. Ho(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 4-coordinate geometry to one O(1), one O(4), one O(5), and one O(8) 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 bent 150 degrees geometry to one Ho(1) and one Tl(1) atom. In the second O site, O(6) is bonded in a distorted L-shaped geometry to one Ho(1) and one S(1) atom. In the third O site, O(7) is bonded in a water-like geometry to one Ho(1) and one S(1) atom. In the fourth O site, O(8) is bonded in a distorted trigonal planar geometry to one Ho(1), one Tl(1), and one S(1) atom. In the fifth O site, O(1) is bonded in a water-like geometry to one Tl(1) and one S(2) atom. In the sixth O site, O(9) is bonded in a single-bond geometry to one Ho(1) and one S(2) atom. In the seventh O site, O(2) is bonded in a bent 150 degrees geometry to one Ho(1) and one S(1) atom. In the eighth O site, O(3) is bonded in a distorted single-bond geometry to one Ho(1) and one S(2) atom. In the ninth O site, O(4) is bonded in a 3-coordinate geometry to one Ho(1), one Tl(1), and one S(2) atom. is represented by the CIF card [CIF]
data_HoTlS2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.319
_cell_length_b   10.268
_cell_length_c   9.958
_cell_angle_alpha   120.268
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   734.635
_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
  Ho  Ho0  1  0.314  0.950  0.682  1.0
  Ho  Ho1  1  0.686  0.050  0.318  1.0
  Ho  Ho2  1  0.814  0.550  0.818  1.0
  Ho  Ho3  1  0.186  0.450  0.182  1.0
  Tl  Tl4  1  0.394  0.749  0.965  1.0
  Tl  Tl5  1  0.606  0.251  0.035  1.0
  Tl  Tl6  1  0.894  0.751  0.535  1.0
  Tl  Tl7  1  0.106  0.249  0.465  1.0
  S  S8  1  0.128  0.323  0.846  1.0
  S  S9  1  0.872  0.677  0.154  1.0
  S  S10  1  0.628  0.177  0.654  1.0
  S  S11  1  0.372  0.823  0.346  1.0
  S  S12  1  0.214  0.578  0.603  1.0
  S  S13  1  0.786  0.422  0.397  1.0
  S  S14  1  0.714  0.922  0.897  1.0
  S  S15  1  0.286  0.078  0.103  1.0
  O  O16  1  0.788  0.078  0.945  1.0
  O  O17  1  0.212  0.922  0.055  1.0
  O  O18  1  0.288  0.422  0.555  1.0
  O  O19  1  0.712  0.578  0.445  1.0
  O  O20  1  0.203  0.176  0.739  1.0
  O  O21  1  0.797  0.824  0.261  1.0
  O  O22  1  0.703  0.324  0.761  1.0
  O  O23  1  0.297  0.676  0.239  1.0
  O  O24  1  0.345  0.690  0.657  1.0
  O  O25  1  0.655  0.310  0.343  1.0
  O  O26  1  0.845  0.810  0.843  1.0
  O  O27  1  0.155  0.190  0.157  1.0
  O  O28  1  0.356  0.061  0.955  1.0
  O  O29  1  0.644  0.939  0.045  1.0
  O  O30  1  0.856  0.439  0.545  1.0
  O  O31  1  0.144  0.561  0.455  1.0
  O  O32  1  0.067  0.891  0.659  1.0
  O  O33  1  0.933  0.109  0.341  1.0
  O  O34  1  0.567  0.609  0.841  1.0
  O  O35  1  0.433  0.391  0.159  1.0
  O  O36  1  0.250  0.440  0.939  1.0
  O  O37  1  0.750  0.560  0.061  1.0
  O  O38  1  0.750  0.060  0.561  1.0
  O  O39  1  0.250  0.940  0.439  1.0
  O  O40  1  0.024  0.314  0.964  1.0
  O  O41  1  0.976  0.686  0.036  1.0
  O  O42  1  0.524  0.186  0.536  1.0
  O  O43  1  0.476  0.814  0.464  1.0
  O  O44  1  0.030  0.366  0.748  1.0
  O  O45  1  0.970  0.634  0.252  1.0
  O  O46  1  0.530  0.134  0.752  1.0
  O  O47  1  0.470  0.866  0.248  1.0
  O  O48  1  0.595  0.881  0.775  1.0
  O  O49  1  0.405  0.119  0.225  1.0
  O  O50  1  0.095  0.619  0.725  1.0
  O  O51  1  0.905  0.381  0.275  1.0
[/CIF]
.
The compound described by HoTlS2O9 crystallizes in the monoclinic P2_1/c space group. Ho(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 4-coordinate geometry to one O(1), one O(4), one O(5), and one O(8) 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 bent 150 degrees geometry to one Ho(1) and one Tl(1) atom. In the second O site, O(6) is bonded in a distorted L-shaped geometry to one Ho(1) and one S(1) atom. In the third O site, O(7) is bonded in a water-like geometry to one Ho(1) and one S(1) atom. In the fourth O site, O(8) is bonded in a distorted trigonal planar geometry to one Ho(1), one Tl(1), and one S(1) atom. In the fifth O site, O(1) is bonded in a water-like geometry to one Tl(1) and one S(2) atom. In the sixth O site, O(9) is bonded in a single-bond geometry to one Ho(1) and one S(2) atom. In the seventh O site, O(2) is bonded in a bent 150 degrees geometry to one Ho(1) and one S(1) atom. In the eighth O site, O(3) is bonded in a distorted single-bond geometry to one Ho(1) and one S(2) atom. In the ninth O site, O(4) is bonded in a 3-coordinate geometry to one Ho(1), one Tl(1), and one S(2) atom. is represented by the CIF card [CIF]
data_HoTlS2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.319
_cell_length_b   10.268
_cell_length_c   9.958
_cell_angle_alpha   120.268
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   734.635
_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
  Ho  Ho0  1  0.314  0.950  0.682  1.0
  Ho  Ho1  1  0.686  0.050  0.318  1.0
  Ho  Ho2  1  0.814  0.550  0.818  1.0
  Ho  Ho3  1  0.186  0.450  0.182  1.0
  Tl  Tl4  1  0.394  0.749  0.965  1.0
  Tl  Tl5  1  0.606  0.251  0.035  1.0
  Tl  Tl6  1  0.894  0.751  0.535  1.0
  Tl  Tl7  1  0.106  0.249  0.465  1.0
  S  S8  1  0.128  0.323  0.846  1.0
  S  S9  1  0.872  0.677  0.154  1.0
  S  S10  1  0.628  0.177  0.654  1.0
  S  S11  1  0.372  0.823  0.346  1.0
  S  S12  1  0.214  0.578  0.603  1.0
  S  S13  1  0.786  0.422  0.397  1.0
  S  S14  1  0.714  0.922  0.897  1.0
  S  S15  1  0.286  0.078  0.103  1.0
  O  O16  1  0.788  0.078  0.945  1.0
  O  O17  1  0.212  0.922  0.055  1.0
  O  O18  1  0.288  0.422  0.555  1.0
  O  O19  1  0.712  0.578  0.445  1.0
  O  O20  1  0.203  0.176  0.739  1.0
  O  O21  1  0.797  0.824  0.261  1.0
  O  O22  1  0.703  0.324  0.761  1.0
  O  O23  1  0.297  0.676  0.239  1.0
  O  O24  1  0.345  0.690  0.657  1.0
  O  O25  1  0.655  0.310  0.343  1.0
  O  O26  1  0.845  0.810  0.843  1.0
  O  O27  1  0.155  0.190  0.157  1.0
  O  O28  1  0.356  0.061  0.955  1.0
  O  O29  1  0.644  0.939  0.045  1.0
  O  O30  1  0.856  0.439  0.545  1.0
  O  O31  1  0.144  0.561  0.455  1.0
  O  O32  1  0.067  0.891  0.659  1.0
  O  O33  1  0.933  0.109  0.341  1.0
  O  O34  1  0.567  0.609  0.841  1.0
  O  O35  1  0.433  0.391  0.159  1.0
  O  O36  1  0.250  0.440  0.939  1.0
  O  O37  1  0.750  0.560  0.061  1.0
  O  O38  1  0.750  0.060  0.561  1.0
  O  O39  1  0.250  0.940  0.439  1.0
  O  O40  1  0.024  0.314  0.964  1.0
  O  O41  1  0.976  0.686  0.036  1.0
  O  O42  1  0.524  0.186  0.536  1.0
  O  O43  1  0.476  0.814  0.464  1.0
  O  O44  1  0.030  0.366  0.748  1.0
  O  O45  1  0.970  0.634  0.252  1.0
  O  O46  1  0.530  0.134  0.752  1.0
  O  O47  1  0.470  0.866  0.248  1.0
  O  O48  1  0.595  0.881  0.775  1.0
  O  O49  1  0.405  0.119  0.225  1.0
  O  O50  1  0.095  0.619  0.725  1.0
  O  O51  1  0.905  0.381  0.275  1.0
[/CIF]
.