The material structure described by Cs3Ag9(SbS3)4 crystallizes in the tetragonal I-4 space group. There are two inequivalent Cs sites. In the first Cs site, Cs(1) is bonded in a body-centered cubic geometry to four equivalent S(2) and four equivalent S(3) atoms. In the second Cs site, Cs(2) is bonded in a 8-coordinate geometry to two equivalent S(2), two equivalent S(3), and four equivalent S(1) atoms. There are three inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a 4-coordinate geometry to four equivalent S(3) atoms. In the second Ag site, Ag(2) is bonded in a distorted trigonal planar geometry to one S(1), one S(2), and two equivalent S(3) atoms. In the third Ag site, Ag(3) is bonded in a trigonal planar geometry to one S(1) and two equivalent S(2) atoms. Sb(1) is bonded in a distorted 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 two equivalent Cs(2), one Ag(2), one Ag(3), and one Sb(1) atom. In the second S site, S(2) is bonded in a 6-coordinate geometry to one Cs(1), one Cs(2), one Ag(2), two equivalent Ag(3), and one Sb(1) atom. In the third S site, S(3) is bonded in a 6-coordinate geometry to one Cs(1), one Cs(2), one Ag(1), two equivalent Ag(2), and one Sb(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cs3Ag9(SbS3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.983
_cell_length_b   9.983
_cell_length_c   9.983
_cell_angle_alpha   111.309
_cell_angle_beta   111.309
_cell_angle_gamma   105.856
_symmetry_Int_Tables_number   1
_cell_volume   763.670
_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
  Cs  Cs0  1  0.000  0.000  0.000  1.0
  Cs  Cs1  1  0.326  0.326  0.000  1.0
  Cs  Cs2  1  0.674  0.674  0.000  1.0
  Ag  Ag3  1  0.250  0.750  0.500  1.0
  Ag  Ag4  1  0.332  0.486  0.489  1.0
  Ag  Ag5  1  0.998  0.843  0.511  1.0
  Ag  Ag6  1  0.499  0.009  0.169  1.0
  Ag  Ag7  1  0.841  0.330  0.831  1.0
  Ag  Ag8  1  0.670  0.501  0.510  1.0
  Ag  Ag9  1  0.991  0.159  0.490  1.0
  Ag  Ag10  1  0.514  0.002  0.846  1.0
  Ag  Ag11  1  0.157  0.668  0.154  1.0
  Sb  Sb12  1  0.125  0.607  0.744  1.0
  Sb  Sb13  1  0.864  0.382  0.256  1.0
  Sb  Sb14  1  0.618  0.875  0.482  1.0
  Sb  Sb15  1  0.393  0.136  0.518  1.0
  S  S16  1  0.670  0.304  0.970  1.0
  S  S17  1  0.334  0.700  0.030  1.0
  S  S18  1  0.300  0.330  0.634  1.0
  S  S19  1  0.696  0.666  0.366  1.0
  S  S20  1  0.425  0.216  0.320  1.0
  S  S21  1  0.896  0.105  0.680  1.0
  S  S22  1  0.215  0.884  0.780  1.0
  S  S23  1  0.105  0.435  0.220  1.0
  S  S24  1  0.565  0.785  0.669  1.0
  S  S25  1  0.116  0.895  0.331  1.0
  S  S26  1  0.784  0.104  0.209  1.0
  S  S27  1  0.895  0.575  0.791  1.0
[/CIF]
.
The material structure described by Cs3Ag9(SbS3)4 crystallizes in the tetragonal I-4 space group. There are two inequivalent Cs sites. In the first Cs site, Cs(1) is bonded in a body-centered cubic geometry to four equivalent S(2) and four equivalent S(3) atoms. In the second Cs site, Cs(2) is bonded in a 8-coordinate geometry to two equivalent S(2), two equivalent S(3), and four equivalent S(1) atoms. There are three inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a 4-coordinate geometry to four equivalent S(3) atoms. In the second Ag site, Ag(2) is bonded in a distorted trigonal planar geometry to one S(1), one S(2), and two equivalent S(3) atoms. In the third Ag site, Ag(3) is bonded in a trigonal planar geometry to one S(1) and two equivalent S(2) atoms. Sb(1) is bonded in a distorted 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 two equivalent Cs(2), one Ag(2), one Ag(3), and one Sb(1) atom. In the second S site, S(2) is bonded in a 6-coordinate geometry to one Cs(1), one Cs(2), one Ag(2), two equivalent Ag(3), and one Sb(1) atom. In the third S site, S(3) is bonded in a 6-coordinate geometry to one Cs(1), one Cs(2), one Ag(1), two equivalent Ag(2), and one Sb(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Cs3Ag9(SbS3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.983
_cell_length_b   9.983
_cell_length_c   9.983
_cell_angle_alpha   111.309
_cell_angle_beta   111.309
_cell_angle_gamma   105.856
_symmetry_Int_Tables_number   1
_cell_volume   763.670
_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
  Cs  Cs0  1  0.000  0.000  0.000  1.0
  Cs  Cs1  1  0.326  0.326  0.000  1.0
  Cs  Cs2  1  0.674  0.674  0.000  1.0
  Ag  Ag3  1  0.250  0.750  0.500  1.0
  Ag  Ag4  1  0.332  0.486  0.489  1.0
  Ag  Ag5  1  0.998  0.843  0.511  1.0
  Ag  Ag6  1  0.499  0.009  0.169  1.0
  Ag  Ag7  1  0.841  0.330  0.831  1.0
  Ag  Ag8  1  0.670  0.501  0.510  1.0
  Ag  Ag9  1  0.991  0.159  0.490  1.0
  Ag  Ag10  1  0.514  0.002  0.846  1.0
  Ag  Ag11  1  0.157  0.668  0.154  1.0
  Sb  Sb12  1  0.125  0.607  0.744  1.0
  Sb  Sb13  1  0.864  0.382  0.256  1.0
  Sb  Sb14  1  0.618  0.875  0.482  1.0
  Sb  Sb15  1  0.393  0.136  0.518  1.0
  S  S16  1  0.670  0.304  0.970  1.0
  S  S17  1  0.334  0.700  0.030  1.0
  S  S18  1  0.300  0.330  0.634  1.0
  S  S19  1  0.696  0.666  0.366  1.0
  S  S20  1  0.425  0.216  0.320  1.0
  S  S21  1  0.896  0.105  0.680  1.0
  S  S22  1  0.215  0.884  0.780  1.0
  S  S23  1  0.105  0.435  0.220  1.0
  S  S24  1  0.565  0.785  0.669  1.0
  S  S25  1  0.116  0.895  0.331  1.0
  S  S26  1  0.784  0.104  0.209  1.0
  S  S27  1  0.895  0.575  0.791  1.0
[/CIF]
.