The crystal structure described by CuClCu2TeS3 crystallizes in the trigonal R3m space group. Cu(1) is bonded to three equivalent S(1) and one Cl(1) atom to form corner-sharing CuS3Cl tetrahedra. Te(1) is bonded in a distorted trigonal non-coplanar geometry to three equivalent S(1) atoms. S(1) is bonded to three equivalent Cu(1) and one Te(1) atom to form corner-sharing SCu3Te tetrahedra. Cl(1) is bonded in a trigonal planar geometry to three equivalent Cu(1) atoms. is represented by the CIF file [CIF]
data_Cu3TeS3Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.482
_cell_length_b   5.482
_cell_length_c   5.482
_cell_angle_alpha   85.050
_cell_angle_beta   85.050
_cell_angle_gamma   85.050
_symmetry_Int_Tables_number   1
_cell_volume   162.984
_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
  Cu  Cu0  1  0.229  0.229  0.804  1.0
  Cu  Cu1  1  0.229  0.804  0.229  1.0
  Cu  Cu2  1  0.804  0.229  0.229  1.0
  Te  Te3  1  0.748  0.748  0.748  1.0
  S  S4  1  0.528  0.029  0.029  1.0
  S  S5  1  0.029  0.528  0.029  1.0
  S  S6  1  0.029  0.029  0.528  1.0
  Cl  Cl7  1  0.432  0.432  0.432  1.0
[/CIF]
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The crystal structure described by CuClCu2TeS3 crystallizes in the trigonal R3m space group. Cu(1) is bonded to three equivalent S(1) and one Cl(1) atom to form corner-sharing CuS3Cl tetrahedra. Te(1) is bonded in a distorted trigonal non-coplanar geometry to three equivalent S(1) atoms. S(1) is bonded to three equivalent Cu(1) and one Te(1) atom to form corner-sharing SCu3Te tetrahedra. Cl(1) is bonded in a trigonal planar geometry to three equivalent Cu(1) atoms. is represented by the CIF file [CIF]
data_Cu3TeS3Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.482
_cell_length_b   5.482
_cell_length_c   5.482
_cell_angle_alpha   85.050
_cell_angle_beta   85.050
_cell_angle_gamma   85.050
_symmetry_Int_Tables_number   1
_cell_volume   162.984
_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
  Cu  Cu0  1  0.229  0.229  0.804  1.0
  Cu  Cu1  1  0.229  0.804  0.229  1.0
  Cu  Cu2  1  0.804  0.229  0.229  1.0
  Te  Te3  1  0.748  0.748  0.748  1.0
  S  S4  1  0.528  0.029  0.029  1.0
  S  S5  1  0.029  0.528  0.029  1.0
  S  S6  1  0.029  0.029  0.528  1.0
  Cl  Cl7  1  0.432  0.432  0.432  1.0
[/CIF]
.