The crystal structure described by Ag5PS4Cl2 crystallizes in the orthorhombic Amm2 space group. There are two inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a 5-coordinate geometry to one S(1), two equivalent S(2), and two equivalent Cl(1) atoms. In the second Ag site, Ag(2) is bonded to two equivalent S(1) and two equivalent Cl(1) atoms to form AgS2Cl2 tetrahedra that share corners with two equivalent P(1)S4 tetrahedra. P(1) is bonded to two equivalent S(1) and two equivalent S(2) atoms to form PS4 tetrahedra that share corners with two equivalent Ag(2)S2Cl2 tetrahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded to one Ag(2), two equivalent Ag(1), and one P(1) atom to form corner-sharing SAg3P tetrahedra. In the second S site, S(2) is bonded in a 5-coordinate geometry to four equivalent Ag(1) and one P(1) atom. Cl(1) is bonded in a 5-coordinate geometry to one Ag(2) and four equivalent Ag(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Ag5P(S2Cl)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.334
_cell_length_b   6.453
_cell_length_c   7.488
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   119.392
_symmetry_Int_Tables_number   1
_cell_volume   266.608
_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
  Ag  Ag0  1  0.938  0.618  0.781  1.0
  Ag  Ag1  1  0.595  0.000  0.500  1.0
  Ag  Ag2  1  0.938  0.618  0.219  1.0
  Ag  Ag3  1  0.320  0.382  0.219  1.0
  Ag  Ag4  1  0.320  0.382  0.781  1.0
  P  P5  1  0.539  0.000  0.000  1.0
  S  S6  1  0.350  0.000  0.772  1.0
  S  S7  1  0.350  0.000  0.228  1.0
  S  S8  1  0.589  0.704  0.000  1.0
  S  S9  1  0.885  0.296  0.000  1.0
  Cl  Cl10  1  0.057  0.345  0.500  1.0
  Cl  Cl11  1  0.712  0.655  0.500  1.0
[/CIF]
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The crystal structure described by Ag5PS4Cl2 crystallizes in the orthorhombic Amm2 space group. There are two inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a 5-coordinate geometry to one S(1), two equivalent S(2), and two equivalent Cl(1) atoms. In the second Ag site, Ag(2) is bonded to two equivalent S(1) and two equivalent Cl(1) atoms to form AgS2Cl2 tetrahedra that share corners with two equivalent P(1)S4 tetrahedra. P(1) is bonded to two equivalent S(1) and two equivalent S(2) atoms to form PS4 tetrahedra that share corners with two equivalent Ag(2)S2Cl2 tetrahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded to one Ag(2), two equivalent Ag(1), and one P(1) atom to form corner-sharing SAg3P tetrahedra. In the second S site, S(2) is bonded in a 5-coordinate geometry to four equivalent Ag(1) and one P(1) atom. Cl(1) is bonded in a 5-coordinate geometry to one Ag(2) and four equivalent Ag(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Ag5P(S2Cl)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.334
_cell_length_b   6.453
_cell_length_c   7.488
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   119.392
_symmetry_Int_Tables_number   1
_cell_volume   266.608
_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
  Ag  Ag0  1  0.938  0.618  0.781  1.0
  Ag  Ag1  1  0.595  0.000  0.500  1.0
  Ag  Ag2  1  0.938  0.618  0.219  1.0
  Ag  Ag3  1  0.320  0.382  0.219  1.0
  Ag  Ag4  1  0.320  0.382  0.781  1.0
  P  P5  1  0.539  0.000  0.000  1.0
  S  S6  1  0.350  0.000  0.772  1.0
  S  S7  1  0.350  0.000  0.228  1.0
  S  S8  1  0.589  0.704  0.000  1.0
  S  S9  1  0.885  0.296  0.000  1.0
  Cl  Cl10  1  0.057  0.345  0.500  1.0
  Cl  Cl11  1  0.712  0.655  0.500  1.0
[/CIF]
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