The material structure described by KCoCuS2 crystallizes in the tetragonal I-4m2 space group. K(1) is bonded in a body-centered cubic geometry to eight equivalent S(1) atoms. Co(1) is bonded to four equivalent S(1) atoms to form CoS4 tetrahedra that share corners with four equivalent Co(1)S4 tetrahedra and edges with four equivalent Cu(1)S4 tetrahedra. Cu(1) is bonded to four equivalent S(1) atoms to form CuS4 tetrahedra that share corners with four equivalent Cu(1)S4 tetrahedra and edges with four equivalent Co(1)S4 tetrahedra. S(1) is bonded in a 8-coordinate geometry to four equivalent K(1), two equivalent Co(1), and two equivalent Cu(1) atoms. is represented by the CIF file [CIF]
data_KCoCuS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.035
_cell_length_b   7.035
_cell_length_c   7.035
_cell_angle_alpha   148.494
_cell_angle_beta   148.494
_cell_angle_gamma   45.156
_symmetry_Int_Tables_number   1
_cell_volume   94.767
_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
  K  K0  1  0.000  0.000  0.000  1.0
  Co  Co1  1  0.750  0.250  0.500  1.0
  Cu  Cu2  1  0.250  0.750  0.500  1.0
  S  S3  1  0.648  0.648  0.000  1.0
  S  S4  1  0.352  0.352  0.000  1.0
[/CIF]
.
The material structure described by KCoCuS2 crystallizes in the tetragonal I-4m2 space group. K(1) is bonded in a body-centered cubic geometry to eight equivalent S(1) atoms. Co(1) is bonded to four equivalent S(1) atoms to form CoS4 tetrahedra that share corners with four equivalent Co(1)S4 tetrahedra and edges with four equivalent Cu(1)S4 tetrahedra. Cu(1) is bonded to four equivalent S(1) atoms to form CuS4 tetrahedra that share corners with four equivalent Cu(1)S4 tetrahedra and edges with four equivalent Co(1)S4 tetrahedra. S(1) is bonded in a 8-coordinate geometry to four equivalent K(1), two equivalent Co(1), and two equivalent Cu(1) atoms. is represented by the CIF file [CIF]
data_KCoCuS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.035
_cell_length_b   7.035
_cell_length_c   7.035
_cell_angle_alpha   148.494
_cell_angle_beta   148.494
_cell_angle_gamma   45.156
_symmetry_Int_Tables_number   1
_cell_volume   94.767
_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
  K  K0  1  0.000  0.000  0.000  1.0
  Co  Co1  1  0.750  0.250  0.500  1.0
  Cu  Cu2  1  0.250  0.750  0.500  1.0
  S  S3  1  0.648  0.648  0.000  1.0
  S  S4  1  0.352  0.352  0.000  1.0
[/CIF]
.