The compound described by Cd2TeS is Enargite-like structured and crystallizes in the trigonal P3m1 space group. There are two inequivalent Cd sites. In the first Cd site, Cd(1) is bonded to three equivalent Te(1) and one S(1) atom to form CdTe3S tetrahedra that share corners with six equivalent Cd(1)Te3S tetrahedra and corners with six equivalent Cd(2)TeS3 tetrahedra. In the second Cd site, Cd(2) is bonded to one Te(1) and three equivalent S(1) atoms to form CdTeS3 tetrahedra that share corners with six equivalent Cd(1)Te3S tetrahedra and corners with six equivalent Cd(2)TeS3 tetrahedra. Te(1) is bonded to one Cd(2) and three equivalent Cd(1) atoms to form TeCd4 tetrahedra that share corners with six equivalent Te(1)Cd4 tetrahedra and corners with six equivalent S(1)Cd4 tetrahedra. S(1) is bonded to one Cd(1) and three equivalent Cd(2) atoms to form SCd4 tetrahedra that share corners with six equivalent Te(1)Cd4 tetrahedra and corners with six equivalent S(1)Cd4 tetrahedra. is represented by the CIF card [CIF]
data_Cd2TeS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.442
_cell_length_b   4.442
_cell_length_c   7.270
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   124.235
_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  0.667  0.333  0.474  1.0
  Cd  Cd1  1  0.000  0.000  0.024  1.0
  Te  Te2  1  0.000  0.000  0.630  1.0
  S  S3  1  0.667  0.333  0.120  1.0
[/CIF]
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The compound described by Cd2TeS is Enargite-like structured and crystallizes in the trigonal P3m1 space group. There are two inequivalent Cd sites. In the first Cd site, Cd(1) is bonded to three equivalent Te(1) and one S(1) atom to form CdTe3S tetrahedra that share corners with six equivalent Cd(1)Te3S tetrahedra and corners with six equivalent Cd(2)TeS3 tetrahedra. In the second Cd site, Cd(2) is bonded to one Te(1) and three equivalent S(1) atoms to form CdTeS3 tetrahedra that share corners with six equivalent Cd(1)Te3S tetrahedra and corners with six equivalent Cd(2)TeS3 tetrahedra. Te(1) is bonded to one Cd(2) and three equivalent Cd(1) atoms to form TeCd4 tetrahedra that share corners with six equivalent Te(1)Cd4 tetrahedra and corners with six equivalent S(1)Cd4 tetrahedra. S(1) is bonded to one Cd(1) and three equivalent Cd(2) atoms to form SCd4 tetrahedra that share corners with six equivalent Te(1)Cd4 tetrahedra and corners with six equivalent S(1)Cd4 tetrahedra. is represented by the CIF card [CIF]
data_Cd2TeS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.442
_cell_length_b   4.442
_cell_length_c   7.270
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   124.235
_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  0.667  0.333  0.474  1.0
  Cd  Cd1  1  0.000  0.000  0.024  1.0
  Te  Te2  1  0.000  0.000  0.630  1.0
  S  S3  1  0.667  0.333  0.120  1.0
[/CIF]
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