The compound described by Re(CO)5 is Cubic alpha N2-like structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of eight Re(CO)5 clusters. Re(1) is bonded in a square pyramidal geometry to one C(1), one C(2), one C(3), one C(4), and one C(5) atom. There are five inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one Re(1) and one O(1,5) atom. In the second C site, C(2) is bonded in a linear geometry to one Re(1) and one O(2) atom. In the third C site, C(3) is bonded in a linear geometry to one Re(1) and one O(3) atom. In the fourth C site, C(4) is bonded in a linear geometry to one Re(1) and one O(4) atom. In the fifth C site, C(5) is bonded in a linear geometry to one Re(1) and one O(1,5) atom. There are four inequivalent O sites. In the first O site, O(1,5) is bonded in a single-bond geometry to one C(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to one C(2) atom. In the third O site, O(3) is bonded in a single-bond geometry to one C(3) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to one C(4) atom. is represented by the CIF card [CIF]
data_Re(CO)5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.896
_cell_length_b   9.896
_cell_length_c   15.211
_cell_angle_alpha   56.237
_cell_angle_beta   56.237
_cell_angle_gamma   43.745
_symmetry_Int_Tables_number   1
_cell_volume   824.904
_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
  Re  Re0  1  0.696  0.163  0.223  1.0
  Re  Re1  1  0.837  0.304  0.277  1.0
  Re  Re2  1  0.304  0.837  0.777  1.0
  Re  Re3  1  0.163  0.696  0.723  1.0
  C  C4  1  0.595  0.079  0.200  1.0
  C  C5  1  0.921  0.405  0.300  1.0
  C  C6  1  0.405  0.921  0.800  1.0
  C  C7  1  0.079  0.595  0.700  1.0
  C  C8  1  0.685  0.370  0.079  1.0
  C  C9  1  0.630  0.315  0.421  1.0
  C  C10  1  0.315  0.630  0.921  1.0
  C  C11  1  0.370  0.685  0.579  1.0
  C  C12  1  0.732  0.964  0.371  1.0
  C  C13  1  0.036  0.268  0.129  1.0
  C  C14  1  0.268  0.036  0.629  1.0
  C  C15  1  0.964  0.732  0.871  1.0
  C  C16  1  0.984  0.964  0.153  1.0
  C  C17  1  0.036  0.016  0.347  1.0
  C  C18  1  0.016  0.036  0.847  1.0
  C  C19  1  0.964  0.984  0.653  1.0
  C  C20  1  0.417  0.377  0.292  1.0
  C  C21  1  0.623  0.583  0.208  1.0
  C  C22  1  0.583  0.623  0.708  1.0
  C  C23  1  0.377  0.417  0.792  1.0
  O  O24  1  0.533  0.028  0.188  1.0
  O  O25  1  0.972  0.467  0.312  1.0
  O  O26  1  0.467  0.972  0.812  1.0
  O  O27  1  0.028  0.533  0.688  1.0
  O  O28  1  0.685  0.487  0.994  1.0
  O  O29  1  0.513  0.315  0.506  1.0
  O  O30  1  0.315  0.513  0.006  1.0
  O  O31  1  0.487  0.685  0.494  1.0
  O  O32  1  0.753  0.849  0.457  1.0
  O  O33  1  0.151  0.247  0.043  1.0
  O  O34  1  0.247  0.151  0.543  1.0
  O  O35  1  0.849  0.753  0.957  1.0
  O  O36  1  0.150  0.853  0.108  1.0
  O  O37  1  0.147  0.850  0.392  1.0
  O  O38  1  0.850  0.147  0.892  1.0
  O  O39  1  0.853  0.150  0.608  1.0
  O  O40  1  0.255  0.503  0.330  1.0
  O  O41  1  0.497  0.745  0.170  1.0
  O  O42  1  0.745  0.497  0.670  1.0
  O  O43  1  0.503  0.255  0.830  1.0
[/CIF]
.
The compound described by Re(CO)5 is Cubic alpha N2-like structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of eight Re(CO)5 clusters. Re(1) is bonded in a square pyramidal geometry to one C(1), one C(2), one C(3), one C(4), and one C(5) atom. There are five inequivalent C sites. In the first C site, C(1) is bonded in a linear geometry to one Re(1) and one O(1,5) atom. In the second C site, C(2) is bonded in a linear geometry to one Re(1) and one O(2) atom. In the third C site, C(3) is bonded in a linear geometry to one Re(1) and one O(3) atom. In the fourth C site, C(4) is bonded in a linear geometry to one Re(1) and one O(4) atom. In the fifth C site, C(5) is bonded in a linear geometry to one Re(1) and one O(1,5) atom. There are four inequivalent O sites. In the first O site, O(1,5) is bonded in a single-bond geometry to one C(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to one C(2) atom. In the third O site, O(3) is bonded in a single-bond geometry to one C(3) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to one C(4) atom. is represented by the CIF card [CIF]
data_Re(CO)5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.896
_cell_length_b   9.896
_cell_length_c   15.211
_cell_angle_alpha   56.237
_cell_angle_beta   56.237
_cell_angle_gamma   43.745
_symmetry_Int_Tables_number   1
_cell_volume   824.904
_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
  Re  Re0  1  0.696  0.163  0.223  1.0
  Re  Re1  1  0.837  0.304  0.277  1.0
  Re  Re2  1  0.304  0.837  0.777  1.0
  Re  Re3  1  0.163  0.696  0.723  1.0
  C  C4  1  0.595  0.079  0.200  1.0
  C  C5  1  0.921  0.405  0.300  1.0
  C  C6  1  0.405  0.921  0.800  1.0
  C  C7  1  0.079  0.595  0.700  1.0
  C  C8  1  0.685  0.370  0.079  1.0
  C  C9  1  0.630  0.315  0.421  1.0
  C  C10  1  0.315  0.630  0.921  1.0
  C  C11  1  0.370  0.685  0.579  1.0
  C  C12  1  0.732  0.964  0.371  1.0
  C  C13  1  0.036  0.268  0.129  1.0
  C  C14  1  0.268  0.036  0.629  1.0
  C  C15  1  0.964  0.732  0.871  1.0
  C  C16  1  0.984  0.964  0.153  1.0
  C  C17  1  0.036  0.016  0.347  1.0
  C  C18  1  0.016  0.036  0.847  1.0
  C  C19  1  0.964  0.984  0.653  1.0
  C  C20  1  0.417  0.377  0.292  1.0
  C  C21  1  0.623  0.583  0.208  1.0
  C  C22  1  0.583  0.623  0.708  1.0
  C  C23  1  0.377  0.417  0.792  1.0
  O  O24  1  0.533  0.028  0.188  1.0
  O  O25  1  0.972  0.467  0.312  1.0
  O  O26  1  0.467  0.972  0.812  1.0
  O  O27  1  0.028  0.533  0.688  1.0
  O  O28  1  0.685  0.487  0.994  1.0
  O  O29  1  0.513  0.315  0.506  1.0
  O  O30  1  0.315  0.513  0.006  1.0
  O  O31  1  0.487  0.685  0.494  1.0
  O  O32  1  0.753  0.849  0.457  1.0
  O  O33  1  0.151  0.247  0.043  1.0
  O  O34  1  0.247  0.151  0.543  1.0
  O  O35  1  0.849  0.753  0.957  1.0
  O  O36  1  0.150  0.853  0.108  1.0
  O  O37  1  0.147  0.850  0.392  1.0
  O  O38  1  0.850  0.147  0.892  1.0
  O  O39  1  0.853  0.150  0.608  1.0
  O  O40  1  0.255  0.503  0.330  1.0
  O  O41  1  0.497  0.745  0.170  1.0
  O  O42  1  0.745  0.497  0.670  1.0
  O  O43  1  0.503  0.255  0.830  1.0
[/CIF]
.