The crystal structure described by CuSCN crystallizes in the orthorhombic Pbca space group. Cu(1) is bonded to one N(1) and three equivalent S(1) atoms to form corner-sharing CuS3N tetrahedra. C(1) is bonded in a distorted linear geometry to one N(1) and one S(1) atom. N(1) is bonded in a linear geometry to one Cu(1) and one C(1) atom. S(1) is bonded to three equivalent Cu(1) and one C(1) atom to form corner-sharing SCu3C tetrahedra. is represented by the CIF card [CIF]
data_CuCSN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.659
_cell_length_b   7.223
_cell_length_c   11.005
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   529.276
_cell_formula_units_Z   8
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  0.636  0.844  0.684  1.0
  Cu  Cu1  1  0.636  0.344  0.816  1.0
  Cu  Cu2  1  0.864  0.344  0.316  1.0
  Cu  Cu3  1  0.364  0.156  0.316  1.0
  Cu  Cu4  1  0.136  0.156  0.816  1.0
  Cu  Cu5  1  0.364  0.656  0.184  1.0
  Cu  Cu6  1  0.136  0.656  0.684  1.0
  Cu  Cu7  1  0.864  0.844  0.184  1.0
  C  C8  1  0.640  0.205  0.078  1.0
  C  C9  1  0.860  0.205  0.578  1.0
  C  C10  1  0.860  0.705  0.922  1.0
  C  C11  1  0.140  0.795  0.422  1.0
  C  C12  1  0.640  0.705  0.422  1.0
  C  C13  1  0.360  0.795  0.922  1.0
  C  C14  1  0.360  0.295  0.578  1.0
  C  C15  1  0.140  0.295  0.078  1.0
  S  S16  1  0.174  0.382  0.216  1.0
  S  S17  1  0.826  0.618  0.784  1.0
  S  S18  1  0.674  0.118  0.216  1.0
  S  S19  1  0.826  0.118  0.716  1.0
  S  S20  1  0.326  0.882  0.784  1.0
  S  S21  1  0.674  0.618  0.284  1.0
  S  S22  1  0.326  0.382  0.716  1.0
  S  S23  1  0.174  0.882  0.284  1.0
  N  N24  1  0.382  0.732  0.019  1.0
  N  N25  1  0.882  0.768  0.019  1.0
  N  N26  1  0.882  0.268  0.481  1.0
  N  N27  1  0.618  0.268  0.981  1.0
  N  N28  1  0.118  0.732  0.519  1.0
  N  N29  1  0.618  0.768  0.519  1.0
  N  N30  1  0.382  0.232  0.481  1.0
  N  N31  1  0.118  0.232  0.981  1.0
[/CIF]
.
The crystal structure described by CuSCN crystallizes in the orthorhombic Pbca space group. Cu(1) is bonded to one N(1) and three equivalent S(1) atoms to form corner-sharing CuS3N tetrahedra. C(1) is bonded in a distorted linear geometry to one N(1) and one S(1) atom. N(1) is bonded in a linear geometry to one Cu(1) and one C(1) atom. S(1) is bonded to three equivalent Cu(1) and one C(1) atom to form corner-sharing SCu3C tetrahedra. is represented by the CIF card [CIF]
data_CuCSN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.659
_cell_length_b   7.223
_cell_length_c   11.005
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   529.276
_cell_formula_units_Z   8
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  0.636  0.844  0.684  1.0
  Cu  Cu1  1  0.636  0.344  0.816  1.0
  Cu  Cu2  1  0.864  0.344  0.316  1.0
  Cu  Cu3  1  0.364  0.156  0.316  1.0
  Cu  Cu4  1  0.136  0.156  0.816  1.0
  Cu  Cu5  1  0.364  0.656  0.184  1.0
  Cu  Cu6  1  0.136  0.656  0.684  1.0
  Cu  Cu7  1  0.864  0.844  0.184  1.0
  C  C8  1  0.640  0.205  0.078  1.0
  C  C9  1  0.860  0.205  0.578  1.0
  C  C10  1  0.860  0.705  0.922  1.0
  C  C11  1  0.140  0.795  0.422  1.0
  C  C12  1  0.640  0.705  0.422  1.0
  C  C13  1  0.360  0.795  0.922  1.0
  C  C14  1  0.360  0.295  0.578  1.0
  C  C15  1  0.140  0.295  0.078  1.0
  S  S16  1  0.174  0.382  0.216  1.0
  S  S17  1  0.826  0.618  0.784  1.0
  S  S18  1  0.674  0.118  0.216  1.0
  S  S19  1  0.826  0.118  0.716  1.0
  S  S20  1  0.326  0.882  0.784  1.0
  S  S21  1  0.674  0.618  0.284  1.0
  S  S22  1  0.326  0.382  0.716  1.0
  S  S23  1  0.174  0.882  0.284  1.0
  N  N24  1  0.382  0.732  0.019  1.0
  N  N25  1  0.882  0.768  0.019  1.0
  N  N26  1  0.882  0.268  0.481  1.0
  N  N27  1  0.618  0.268  0.981  1.0
  N  N28  1  0.118  0.732  0.519  1.0
  N  N29  1  0.618  0.768  0.519  1.0
  N  N30  1  0.382  0.232  0.481  1.0
  N  N31  1  0.118  0.232  0.981  1.0
[/CIF]
.