The material described by Re(SeCl6)2 is Indium-like structured and crystallizes in the orthorhombic Fdd2 space group. The structure is zero-dimensional and consists of eight Re(SeCl6)2 clusters. Re(1) is bonded in an octahedral geometry to two equivalent Cl(2), two equivalent Cl(3), and two equivalent Cl(4) atoms. Se(1) is bonded in a 3-coordinate geometry to one Cl(1), one Cl(4), one Cl(5), and one Cl(6) atom. There are six inequivalent Cl sites. In the first Cl site, Cl(6) is bonded in a single-bond geometry to one Se(1) atom. In the second Cl site, Cl(1) is bonded in a single-bond geometry to one Se(1) atom. In the third Cl site, Cl(2) is bonded in a distorted single-bond geometry to one Re(1) atom. In the fourth Cl site, Cl(3) is bonded in a single-bond geometry to one Re(1) atom. In the fifth Cl site, Cl(4) is bonded in a distorted water-like geometry to one Re(1) and one Se(1) atom. In the sixth Cl site, Cl(5) is bonded in a single-bond geometry to one Se(1) atom. is represented by the CIF file [CIF]
data_Re(SeCl6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.863
_cell_length_b   8.863
_cell_length_c   12.503
_cell_angle_alpha   109.219
_cell_angle_beta   109.219
_cell_angle_gamma   94.085
_symmetry_Int_Tables_number   1
_cell_volume   857.653
_cell_formula_units_Z   2
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  0.420  0.920  0.840  1.0
  Re  Re1  1  0.670  0.670  0.340  1.0
  Se  Se2  1  0.218  0.271  0.005  1.0
  Se  Se3  1  0.788  0.734  0.005  1.0
  Se  Se4  1  0.021  0.468  0.505  1.0
  Se  Se5  1  0.484  0.038  0.505  1.0
  Cl  Cl6  1  0.895  0.233  0.354  1.0
  Cl  Cl7  1  0.713  0.560  0.495  1.0
  Cl  Cl8  1  0.637  0.788  0.191  1.0
  Cl  Cl9  1  0.410  0.712  0.343  1.0
  Cl  Cl10  1  0.029  0.855  0.154  1.0
  Cl  Cl11  1  0.310  0.963  0.995  1.0
  Cl  Cl12  1  0.554  0.403  0.191  1.0
  Cl  Cl13  1  0.381  0.183  0.843  1.0
  Cl  Cl14  1  0.780  0.481  0.995  1.0
  Cl  Cl15  1  0.782  0.935  0.495  1.0
  Cl  Cl16  1  0.049  0.375  0.654  1.0
  Cl  Cl17  1  0.125  0.299  0.154  1.0
  Cl  Cl18  1  0.983  0.145  0.854  1.0
  Cl  Cl19  1  0.685  0.032  0.995  1.0
  Cl  Cl20  1  0.231  0.030  0.495  1.0
  Cl  Cl21  1  0.459  0.120  0.354  1.0
  Cl  Cl22  1  0.538  0.887  0.691  1.0
  Cl  Cl23  1  0.870  0.709  0.854  1.0
  Cl  Cl24  1  0.605  0.279  0.654  1.0
  Cl  Cl25  1  0.153  0.804  0.691  1.0
  Cl  Cl26  1  0.933  0.631  0.343  1.0
  Cl  Cl27  1  0.264  0.465  0.495  1.0
  Cl  Cl28  1  0.215  0.514  0.995  1.0
  Cl  Cl29  1  0.462  0.660  0.843  1.0
[/CIF]
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The material described by Re(SeCl6)2 is Indium-like structured and crystallizes in the orthorhombic Fdd2 space group. The structure is zero-dimensional and consists of eight Re(SeCl6)2 clusters. Re(1) is bonded in an octahedral geometry to two equivalent Cl(2), two equivalent Cl(3), and two equivalent Cl(4) atoms. Se(1) is bonded in a 3-coordinate geometry to one Cl(1), one Cl(4), one Cl(5), and one Cl(6) atom. There are six inequivalent Cl sites. In the first Cl site, Cl(6) is bonded in a single-bond geometry to one Se(1) atom. In the second Cl site, Cl(1) is bonded in a single-bond geometry to one Se(1) atom. In the third Cl site, Cl(2) is bonded in a distorted single-bond geometry to one Re(1) atom. In the fourth Cl site, Cl(3) is bonded in a single-bond geometry to one Re(1) atom. In the fifth Cl site, Cl(4) is bonded in a distorted water-like geometry to one Re(1) and one Se(1) atom. In the sixth Cl site, Cl(5) is bonded in a single-bond geometry to one Se(1) atom. is represented by the CIF file [CIF]
data_Re(SeCl6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.863
_cell_length_b   8.863
_cell_length_c   12.503
_cell_angle_alpha   109.219
_cell_angle_beta   109.219
_cell_angle_gamma   94.085
_symmetry_Int_Tables_number   1
_cell_volume   857.653
_cell_formula_units_Z   2
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  0.420  0.920  0.840  1.0
  Re  Re1  1  0.670  0.670  0.340  1.0
  Se  Se2  1  0.218  0.271  0.005  1.0
  Se  Se3  1  0.788  0.734  0.005  1.0
  Se  Se4  1  0.021  0.468  0.505  1.0
  Se  Se5  1  0.484  0.038  0.505  1.0
  Cl  Cl6  1  0.895  0.233  0.354  1.0
  Cl  Cl7  1  0.713  0.560  0.495  1.0
  Cl  Cl8  1  0.637  0.788  0.191  1.0
  Cl  Cl9  1  0.410  0.712  0.343  1.0
  Cl  Cl10  1  0.029  0.855  0.154  1.0
  Cl  Cl11  1  0.310  0.963  0.995  1.0
  Cl  Cl12  1  0.554  0.403  0.191  1.0
  Cl  Cl13  1  0.381  0.183  0.843  1.0
  Cl  Cl14  1  0.780  0.481  0.995  1.0
  Cl  Cl15  1  0.782  0.935  0.495  1.0
  Cl  Cl16  1  0.049  0.375  0.654  1.0
  Cl  Cl17  1  0.125  0.299  0.154  1.0
  Cl  Cl18  1  0.983  0.145  0.854  1.0
  Cl  Cl19  1  0.685  0.032  0.995  1.0
  Cl  Cl20  1  0.231  0.030  0.495  1.0
  Cl  Cl21  1  0.459  0.120  0.354  1.0
  Cl  Cl22  1  0.538  0.887  0.691  1.0
  Cl  Cl23  1  0.870  0.709  0.854  1.0
  Cl  Cl24  1  0.605  0.279  0.654  1.0
  Cl  Cl25  1  0.153  0.804  0.691  1.0
  Cl  Cl26  1  0.933  0.631  0.343  1.0
  Cl  Cl27  1  0.264  0.465  0.495  1.0
  Cl  Cl28  1  0.215  0.514  0.995  1.0
  Cl  Cl29  1  0.462  0.660  0.843  1.0
[/CIF]
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