The structure described by CdPbS2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. Cd(1) is bonded to six equivalent S(1) atoms to form CdS6 octahedra that share corners with six equivalent Pb(1)S6 octahedra, edges with six equivalent Cd(1)S6 octahedra, and edges with six equivalent Pb(1)S6 octahedra. The corner-sharing octahedral tilt angles are 6°. Pb(1) is bonded to six equivalent S(1) atoms to form PbS6 octahedra that share corners with six equivalent Cd(1)S6 octahedra, edges with six equivalent Cd(1)S6 octahedra, and edges with six equivalent Pb(1)S6 octahedra. The corner-sharing octahedral tilt angles are 6°. S(1) is bonded to three equivalent Cd(1) and three equivalent Pb(1) atoms to form a mixture of corner and edge-sharing SCd3Pb3 octahedra. The corner-sharing octahedra are not tilted. is represented by the CIF card [CIF]
data_CdPbS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.029
_cell_length_b   7.029
_cell_length_c   7.029
_cell_angle_alpha   33.732
_cell_angle_beta   33.732
_cell_angle_gamma   33.732
_symmetry_Int_Tables_number   1
_cell_volume   95.406
_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
  Cd  Cd0  1  0.000  0.000  0.000  1.0
  Pb  Pb1  1  0.500  0.500  0.500  1.0
  S  S2  1  0.259  0.259  0.259  1.0
  S  S3  1  0.741  0.741  0.741  1.0
[/CIF]
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The structure described by CdPbS2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. Cd(1) is bonded to six equivalent S(1) atoms to form CdS6 octahedra that share corners with six equivalent Pb(1)S6 octahedra, edges with six equivalent Cd(1)S6 octahedra, and edges with six equivalent Pb(1)S6 octahedra. The corner-sharing octahedral tilt angles are 6°. Pb(1) is bonded to six equivalent S(1) atoms to form PbS6 octahedra that share corners with six equivalent Cd(1)S6 octahedra, edges with six equivalent Cd(1)S6 octahedra, and edges with six equivalent Pb(1)S6 octahedra. The corner-sharing octahedral tilt angles are 6°. S(1) is bonded to three equivalent Cd(1) and three equivalent Pb(1) atoms to form a mixture of corner and edge-sharing SCd3Pb3 octahedra. The corner-sharing octahedra are not tilted. is represented by the CIF card [CIF]
data_CdPbS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.029
_cell_length_b   7.029
_cell_length_c   7.029
_cell_angle_alpha   33.732
_cell_angle_beta   33.732
_cell_angle_gamma   33.732
_symmetry_Int_Tables_number   1
_cell_volume   95.406
_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
  Cd  Cd0  1  0.000  0.000  0.000  1.0
  Pb  Pb1  1  0.500  0.500  0.500  1.0
  S  S2  1  0.259  0.259  0.259  1.0
  S  S3  1  0.741  0.741  0.741  1.0
[/CIF]
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