The material described by AuCrS2 crystallizes in the trigonal R-3m space group. Cr(1) is bonded to six equivalent S(1) atoms to form edge-sharing CrS6 octahedra. Au(1) is bonded in a linear geometry to two equivalent S(1) atoms. S(1) is bonded in a 4-coordinate geometry to three equivalent Cr(1) and one Au(1) atom. is represented by the CIF card [CIF]
data_CrAuS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.396
_cell_length_b   7.396
_cell_length_c   7.396
_cell_angle_alpha   27.702
_cell_angle_beta   27.702
_cell_angle_gamma   27.702
_symmetry_Int_Tables_number   1
_cell_volume   77.195
_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
  Cr  Cr0  1  0.500  0.500  0.500  1.0
  Au  Au1  1  0.000  0.000  0.000  1.0
  S  S2  1  0.892  0.892  0.892  1.0
  S  S3  1  0.108  0.108  0.108  1.0
[/CIF]
.
The material described by AuCrS2 crystallizes in the trigonal R-3m space group. Cr(1) is bonded to six equivalent S(1) atoms to form edge-sharing CrS6 octahedra. Au(1) is bonded in a linear geometry to two equivalent S(1) atoms. S(1) is bonded in a 4-coordinate geometry to three equivalent Cr(1) and one Au(1) atom. is represented by the CIF card [CIF]
data_CrAuS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.396
_cell_length_b   7.396
_cell_length_c   7.396
_cell_angle_alpha   27.702
_cell_angle_beta   27.702
_cell_angle_gamma   27.702
_symmetry_Int_Tables_number   1
_cell_volume   77.195
_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
  Cr  Cr0  1  0.500  0.500  0.500  1.0
  Au  Au1  1  0.000  0.000  0.000  1.0
  S  S2  1  0.892  0.892  0.892  1.0
  S  S3  1  0.108  0.108  0.108  1.0
[/CIF]
.