The material structure described by K2Re3CNS5 crystallizes in the orthorhombic Pmna space group. There are two inequivalent K sites. In the first K site, K(1) is bonded to two equivalent C(1), two equivalent N(1), one S(2), and two equivalent S(3) atoms to form distorted KC2S3N2 pentagonal bipyramids that share corners with six equivalent Re(2)S5 square pyramids, edges with two equivalent K(1)C2S3N2 pentagonal bipyramids, and edges with two equivalent Re(1)CS4 square pyramids. In the second K site, K(2) is bonded in a 6-coordinate geometry to two equivalent N(1), one S(1), one S(4), and two equivalent S(2) atoms. There are two inequivalent Re sites. In the first Re site, Re(1) is bonded to one C(1), one S(1), one S(4), and two equivalent S(3) atoms to form distorted ReCS4 square pyramids that share edges with two equivalent K(1)C2S3N2 pentagonal bipyramids and edges with four equivalent Re(2)S5 square pyramids. In the second Re site, Re(2) is bonded to one S(1), one S(2), one S(4), and two equivalent S(3) atoms to form distorted ReS5 square pyramids that share corners with three equivalent K(1)C2S3N2 pentagonal bipyramids,  a cornercorner with one Re(2)S5 square pyramid, edges with two equivalent Re(1)CS4 square pyramids, and edges with two equivalent Re(2)S5 square pyramids. C(1) is bonded in a distorted linear geometry to two equivalent K(1), one Re(1), and one N(1) atom. N(1) is bonded in a distorted single-bond geometry to two equivalent K(1), two equivalent K(2), and one C(1) atom. There are four inequivalent S sites. In the first S site, S(4) is bonded in a 4-coordinate geometry to one K(2), one Re(1), and two equivalent Re(2) atoms. In the second S site, S(1) is bonded in a 4-coordinate geometry to one K(2), one Re(1), and two equivalent Re(2) atoms. In the third S site, S(2) is bonded in a 5-coordinate geometry to one K(1), two equivalent K(2), and two equivalent Re(2) atoms. In the fourth S site, S(3) is bonded in a distorted rectangular see-saw-like geometry to one K(1), one Re(1), and two equivalent Re(2) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_K2Re3CS5N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.256
_cell_length_b   10.240
_cell_length_c   11.379
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1078.487
_cell_formula_units_Z   4
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  0.046  0.750  0.250  1.0
  K  K1  1  0.046  0.750  0.750  1.0
  K  K2  1  0.223  0.072  0.000  1.0
  K  K3  1  0.223  0.428  0.500  1.0
  K  K4  1  0.777  0.572  0.500  1.0
  K  K5  1  0.777  0.928  0.000  1.0
  K  K6  1  0.954  0.250  0.250  1.0
  K  K7  1  0.954  0.250  0.750  1.0
  Re  Re8  1  0.337  0.604  0.000  1.0
  Re  Re9  1  0.337  0.896  0.500  1.0
  Re  Re10  1  0.419  0.106  0.385  1.0
  Re  Re11  1  0.419  0.106  0.615  1.0
  Re  Re12  1  0.419  0.394  0.115  1.0
  Re  Re13  1  0.419  0.394  0.885  1.0
  Re  Re14  1  0.581  0.606  0.115  1.0
  Re  Re15  1  0.581  0.606  0.885  1.0
  Re  Re16  1  0.581  0.894  0.385  1.0
  Re  Re17  1  0.581  0.894  0.615  1.0
  Re  Re18  1  0.663  0.104  0.500  1.0
  Re  Re19  1  0.663  0.396  0.000  1.0
  C  C20  1  0.166  0.762  0.500  1.0
  C  C21  1  0.166  0.738  0.000  1.0
  C  C22  1  0.834  0.238  0.500  1.0
  C  C23  1  0.834  0.262  0.000  1.0
  S  S24  1  0.197  0.094  0.500  1.0
  S  S25  1  0.197  0.406  0.000  1.0
  S  S26  1  0.288  0.250  0.250  1.0
  S  S27  1  0.288  0.250  0.750  1.0
  S  S28  1  0.350  0.592  0.787  1.0
  S  S29  1  0.350  0.908  0.713  1.0
  S  S30  1  0.350  0.592  0.213  1.0
  S  S31  1  0.350  0.908  0.287  1.0
  S  S32  1  0.492  0.711  0.500  1.0
  S  S33  1  0.492  0.789  0.000  1.0
  S  S34  1  0.508  0.211  0.000  1.0
  S  S35  1  0.508  0.289  0.500  1.0
  S  S36  1  0.650  0.092  0.287  1.0
  S  S37  1  0.650  0.092  0.713  1.0
  S  S38  1  0.650  0.408  0.787  1.0
  S  S39  1  0.650  0.408  0.213  1.0
  S  S40  1  0.712  0.750  0.250  1.0
  S  S41  1  0.712  0.750  0.750  1.0
  S  S42  1  0.803  0.594  0.000  1.0
  S  S43  1  0.803  0.906  0.500  1.0
  N  N44  1  0.079  0.822  0.000  1.0
  N  N45  1  0.079  0.678  0.500  1.0
  N  N46  1  0.921  0.178  0.000  1.0
  N  N47  1  0.921  0.322  0.500  1.0
[/CIF]
.
The material structure described by K2Re3CNS5 crystallizes in the orthorhombic Pmna space group. There are two inequivalent K sites. In the first K site, K(1) is bonded to two equivalent C(1), two equivalent N(1), one S(2), and two equivalent S(3) atoms to form distorted KC2S3N2 pentagonal bipyramids that share corners with six equivalent Re(2)S5 square pyramids, edges with two equivalent K(1)C2S3N2 pentagonal bipyramids, and edges with two equivalent Re(1)CS4 square pyramids. In the second K site, K(2) is bonded in a 6-coordinate geometry to two equivalent N(1), one S(1), one S(4), and two equivalent S(2) atoms. There are two inequivalent Re sites. In the first Re site, Re(1) is bonded to one C(1), one S(1), one S(4), and two equivalent S(3) atoms to form distorted ReCS4 square pyramids that share edges with two equivalent K(1)C2S3N2 pentagonal bipyramids and edges with four equivalent Re(2)S5 square pyramids. In the second Re site, Re(2) is bonded to one S(1), one S(2), one S(4), and two equivalent S(3) atoms to form distorted ReS5 square pyramids that share corners with three equivalent K(1)C2S3N2 pentagonal bipyramids,  a cornercorner with one Re(2)S5 square pyramid, edges with two equivalent Re(1)CS4 square pyramids, and edges with two equivalent Re(2)S5 square pyramids. C(1) is bonded in a distorted linear geometry to two equivalent K(1), one Re(1), and one N(1) atom. N(1) is bonded in a distorted single-bond geometry to two equivalent K(1), two equivalent K(2), and one C(1) atom. There are four inequivalent S sites. In the first S site, S(4) is bonded in a 4-coordinate geometry to one K(2), one Re(1), and two equivalent Re(2) atoms. In the second S site, S(1) is bonded in a 4-coordinate geometry to one K(2), one Re(1), and two equivalent Re(2) atoms. In the third S site, S(2) is bonded in a 5-coordinate geometry to one K(1), two equivalent K(2), and two equivalent Re(2) atoms. In the fourth S site, S(3) is bonded in a distorted rectangular see-saw-like geometry to one K(1), one Re(1), and two equivalent Re(2) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_K2Re3CS5N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.256
_cell_length_b   10.240
_cell_length_c   11.379
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1078.487
_cell_formula_units_Z   4
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  0.046  0.750  0.250  1.0
  K  K1  1  0.046  0.750  0.750  1.0
  K  K2  1  0.223  0.072  0.000  1.0
  K  K3  1  0.223  0.428  0.500  1.0
  K  K4  1  0.777  0.572  0.500  1.0
  K  K5  1  0.777  0.928  0.000  1.0
  K  K6  1  0.954  0.250  0.250  1.0
  K  K7  1  0.954  0.250  0.750  1.0
  Re  Re8  1  0.337  0.604  0.000  1.0
  Re  Re9  1  0.337  0.896  0.500  1.0
  Re  Re10  1  0.419  0.106  0.385  1.0
  Re  Re11  1  0.419  0.106  0.615  1.0
  Re  Re12  1  0.419  0.394  0.115  1.0
  Re  Re13  1  0.419  0.394  0.885  1.0
  Re  Re14  1  0.581  0.606  0.115  1.0
  Re  Re15  1  0.581  0.606  0.885  1.0
  Re  Re16  1  0.581  0.894  0.385  1.0
  Re  Re17  1  0.581  0.894  0.615  1.0
  Re  Re18  1  0.663  0.104  0.500  1.0
  Re  Re19  1  0.663  0.396  0.000  1.0
  C  C20  1  0.166  0.762  0.500  1.0
  C  C21  1  0.166  0.738  0.000  1.0
  C  C22  1  0.834  0.238  0.500  1.0
  C  C23  1  0.834  0.262  0.000  1.0
  S  S24  1  0.197  0.094  0.500  1.0
  S  S25  1  0.197  0.406  0.000  1.0
  S  S26  1  0.288  0.250  0.250  1.0
  S  S27  1  0.288  0.250  0.750  1.0
  S  S28  1  0.350  0.592  0.787  1.0
  S  S29  1  0.350  0.908  0.713  1.0
  S  S30  1  0.350  0.592  0.213  1.0
  S  S31  1  0.350  0.908  0.287  1.0
  S  S32  1  0.492  0.711  0.500  1.0
  S  S33  1  0.492  0.789  0.000  1.0
  S  S34  1  0.508  0.211  0.000  1.0
  S  S35  1  0.508  0.289  0.500  1.0
  S  S36  1  0.650  0.092  0.287  1.0
  S  S37  1  0.650  0.092  0.713  1.0
  S  S38  1  0.650  0.408  0.787  1.0
  S  S39  1  0.650  0.408  0.213  1.0
  S  S40  1  0.712  0.750  0.250  1.0
  S  S41  1  0.712  0.750  0.750  1.0
  S  S42  1  0.803  0.594  0.000  1.0
  S  S43  1  0.803  0.906  0.500  1.0
  N  N44  1  0.079  0.822  0.000  1.0
  N  N45  1  0.079  0.678  0.500  1.0
  N  N46  1  0.921  0.178  0.000  1.0
  N  N47  1  0.921  0.322  0.500  1.0
[/CIF]
.