The compound described by KAgTeS3 crystallizes in the monoclinic P2_1/c space group. K(1) is bonded in a 7-coordinate geometry to two equivalent S(2), three equivalent S(1), and three equivalent S(3) atoms. Ag(1) is bonded to one S(1), one S(3), and two equivalent S(2) atoms to form corner-sharing AgS4 tetrahedra. Te(1) is bonded in a trigonal non-coplanar geometry to one S(1), one S(2), and one S(3) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded in a 5-coordinate geometry to three equivalent K(1), one Ag(1), and one Te(1) atom. In the second S site, S(2) is bonded to two equivalent K(1), two equivalent Ag(1), and one Te(1) atom to form edge-sharing SK2Ag2Te square pyramids. In the third S site, S(3) is bonded in a 5-coordinate geometry to three equivalent K(1), one Ag(1), and one Te(1) atom. is represented by the CIF file [CIF]
data_KAgTeS3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.943
_cell_length_b   7.471
_cell_length_c   8.668
_cell_angle_alpha   73.661
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   680.054
_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
  K  K0  1  0.249  0.475  0.884  1.0
  K  K1  1  0.751  0.525  0.116  1.0
  K  K2  1  0.749  0.525  0.616  1.0
  K  K3  1  0.251  0.475  0.384  1.0
  Ag  Ag4  1  0.251  0.920  0.519  1.0
  Ag  Ag5  1  0.749  0.080  0.481  1.0
  Ag  Ag6  1  0.751  0.080  0.981  1.0
  Ag  Ag7  1  0.249  0.920  0.019  1.0
  Te  Te8  1  0.505  0.914  0.772  1.0
  Te  Te9  1  0.495  0.086  0.228  1.0
  Te  Te10  1  0.005  0.086  0.728  1.0
  Te  Te11  1  0.995  0.914  0.272  1.0
  S  S12  1  0.054  0.731  0.533  1.0
  S  S13  1  0.946  0.269  0.467  1.0
  S  S14  1  0.554  0.269  0.967  1.0
  S  S15  1  0.446  0.731  0.033  1.0
  S  S16  1  0.724  0.862  0.784  1.0
  S  S17  1  0.276  0.138  0.216  1.0
  S  S18  1  0.224  0.138  0.716  1.0
  S  S19  1  0.776  0.862  0.284  1.0
  S  S20  1  0.445  0.722  0.606  1.0
  S  S21  1  0.555  0.278  0.394  1.0
  S  S22  1  0.945  0.278  0.894  1.0
  S  S23  1  0.055  0.722  0.106  1.0
[/CIF]
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The compound described by KAgTeS3 crystallizes in the monoclinic P2_1/c space group. K(1) is bonded in a 7-coordinate geometry to two equivalent S(2), three equivalent S(1), and three equivalent S(3) atoms. Ag(1) is bonded to one S(1), one S(3), and two equivalent S(2) atoms to form corner-sharing AgS4 tetrahedra. Te(1) is bonded in a trigonal non-coplanar geometry to one S(1), one S(2), and one S(3) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded in a 5-coordinate geometry to three equivalent K(1), one Ag(1), and one Te(1) atom. In the second S site, S(2) is bonded to two equivalent K(1), two equivalent Ag(1), and one Te(1) atom to form edge-sharing SK2Ag2Te square pyramids. In the third S site, S(3) is bonded in a 5-coordinate geometry to three equivalent K(1), one Ag(1), and one Te(1) atom. is represented by the CIF file [CIF]
data_KAgTeS3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.943
_cell_length_b   7.471
_cell_length_c   8.668
_cell_angle_alpha   73.661
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   680.054
_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
  K  K0  1  0.249  0.475  0.884  1.0
  K  K1  1  0.751  0.525  0.116  1.0
  K  K2  1  0.749  0.525  0.616  1.0
  K  K3  1  0.251  0.475  0.384  1.0
  Ag  Ag4  1  0.251  0.920  0.519  1.0
  Ag  Ag5  1  0.749  0.080  0.481  1.0
  Ag  Ag6  1  0.751  0.080  0.981  1.0
  Ag  Ag7  1  0.249  0.920  0.019  1.0
  Te  Te8  1  0.505  0.914  0.772  1.0
  Te  Te9  1  0.495  0.086  0.228  1.0
  Te  Te10  1  0.005  0.086  0.728  1.0
  Te  Te11  1  0.995  0.914  0.272  1.0
  S  S12  1  0.054  0.731  0.533  1.0
  S  S13  1  0.946  0.269  0.467  1.0
  S  S14  1  0.554  0.269  0.967  1.0
  S  S15  1  0.446  0.731  0.033  1.0
  S  S16  1  0.724  0.862  0.784  1.0
  S  S17  1  0.276  0.138  0.216  1.0
  S  S18  1  0.224  0.138  0.716  1.0
  S  S19  1  0.776  0.862  0.284  1.0
  S  S20  1  0.445  0.722  0.606  1.0
  S  S21  1  0.555  0.278  0.394  1.0
  S  S22  1  0.945  0.278  0.894  1.0
  S  S23  1  0.055  0.722  0.106  1.0
[/CIF]
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