The compound described by Ag5SbS4 crystallizes in the orthorhombic Cmc2_1 space group. There are three inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a 3-coordinate geometry to one S(1), one S(2), and one S(3) atom. In the second Ag site, Ag(2) is bonded in a 3-coordinate geometry to one S(1), one S(2), and one S(3) atom. In the third Ag site, Ag(3) is bonded in a trigonal planar geometry to one S(3) and two equivalent S(1) atoms. Sb(1) is bonded in a distorted T-shaped geometry to one S(2) and two equivalent S(1) atoms. There are three inequivalent S sites. In the first S site, S(1) is bonded to one Ag(1), one Ag(2), one Ag(3), and one Sb(1) atom to form distorted corner-sharing SAg3Sb tetrahedra. In the second S site, S(2) is bonded in a distorted pentagonal planar geometry to two equivalent Ag(1), two equivalent Ag(2), and one Sb(1) atom. In the third S site, S(3) is bonded in a 5-coordinate geometry to one Ag(3), two equivalent Ag(1), and two equivalent Ag(2) atoms. is represented by the CIF card [CIF]
data_Ag5SbS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.374
_cell_length_b   7.374
_cell_length_c   9.122
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   116.275
_symmetry_Int_Tables_number   1
_cell_volume   444.785
_cell_formula_units_Z   2
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
  Ag  Ag0  1  0.261  0.132  0.820  1.0
  Ag  Ag1  1  0.805  0.571  0.509  1.0
  Ag  Ag2  1  0.571  0.805  0.009  1.0
  Ag  Ag3  1  0.429  0.195  0.509  1.0
  Ag  Ag4  1  0.868  0.739  0.820  1.0
  Ag  Ag5  1  0.132  0.261  0.320  1.0
  Ag  Ag6  1  0.863  0.137  0.678  1.0
  Ag  Ag7  1  0.137  0.863  0.178  1.0
  Ag  Ag8  1  0.195  0.429  0.009  1.0
  Ag  Ag9  1  0.739  0.868  0.320  1.0
  Sb  Sb10  1  0.325  0.675  0.617  1.0
  Sb  Sb11  1  0.675  0.325  0.117  1.0
  S  S12  1  0.504  0.966  0.782  1.0
  S  S13  1  0.496  0.034  0.282  1.0
  S  S14  1  0.518  0.482  0.697  1.0
  S  S15  1  0.482  0.518  0.197  1.0
  S  S16  1  0.018  0.982  0.510  1.0
  S  S17  1  0.982  0.018  0.010  1.0
  S  S18  1  0.034  0.496  0.782  1.0
  S  S19  1  0.966  0.504  0.282  1.0
[/CIF]
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The compound described by Ag5SbS4 crystallizes in the orthorhombic Cmc2_1 space group. There are three inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a 3-coordinate geometry to one S(1), one S(2), and one S(3) atom. In the second Ag site, Ag(2) is bonded in a 3-coordinate geometry to one S(1), one S(2), and one S(3) atom. In the third Ag site, Ag(3) is bonded in a trigonal planar geometry to one S(3) and two equivalent S(1) atoms. Sb(1) is bonded in a distorted T-shaped geometry to one S(2) and two equivalent S(1) atoms. There are three inequivalent S sites. In the first S site, S(1) is bonded to one Ag(1), one Ag(2), one Ag(3), and one Sb(1) atom to form distorted corner-sharing SAg3Sb tetrahedra. In the second S site, S(2) is bonded in a distorted pentagonal planar geometry to two equivalent Ag(1), two equivalent Ag(2), and one Sb(1) atom. In the third S site, S(3) is bonded in a 5-coordinate geometry to one Ag(3), two equivalent Ag(1), and two equivalent Ag(2) atoms. is represented by the CIF card [CIF]
data_Ag5SbS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.374
_cell_length_b   7.374
_cell_length_c   9.122
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   116.275
_symmetry_Int_Tables_number   1
_cell_volume   444.785
_cell_formula_units_Z   2
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
  Ag  Ag0  1  0.261  0.132  0.820  1.0
  Ag  Ag1  1  0.805  0.571  0.509  1.0
  Ag  Ag2  1  0.571  0.805  0.009  1.0
  Ag  Ag3  1  0.429  0.195  0.509  1.0
  Ag  Ag4  1  0.868  0.739  0.820  1.0
  Ag  Ag5  1  0.132  0.261  0.320  1.0
  Ag  Ag6  1  0.863  0.137  0.678  1.0
  Ag  Ag7  1  0.137  0.863  0.178  1.0
  Ag  Ag8  1  0.195  0.429  0.009  1.0
  Ag  Ag9  1  0.739  0.868  0.320  1.0
  Sb  Sb10  1  0.325  0.675  0.617  1.0
  Sb  Sb11  1  0.675  0.325  0.117  1.0
  S  S12  1  0.504  0.966  0.782  1.0
  S  S13  1  0.496  0.034  0.282  1.0
  S  S14  1  0.518  0.482  0.697  1.0
  S  S15  1  0.482  0.518  0.197  1.0
  S  S16  1  0.018  0.982  0.510  1.0
  S  S17  1  0.982  0.018  0.010  1.0
  S  S18  1  0.034  0.496  0.782  1.0
  S  S19  1  0.966  0.504  0.282  1.0
[/CIF]
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