The material structure described by ScRe2O6 is Hydrophilite-derived structured and crystallizes in the monoclinic P2_1/c space group. Sc(1) is bonded to two equivalent O(3) and four equivalent O(1) atoms to form ScO6 octahedra that share corners with four equivalent Sc(1)O6 octahedra, corners with four equivalent Re(1)O6 octahedra, and edges with two equivalent Re(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 45-56°. Re(1) is bonded to one O(1), two equivalent O(3), and three equivalent O(2) atoms to form ReO6 octahedra that share corners with two equivalent Sc(1)O6 octahedra, corners with six equivalent Re(1)O6 octahedra,  an edgeedge with one Sc(1)O6 octahedra, and  an edgeedge with one Re(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 36-54°. There are three inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to two equivalent Sc(1) and one Re(1) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to three equivalent Re(1) atoms. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Sc(1) and two equivalent Re(1) atoms. is represented by the CIF file [CIF]
data_Sc(ReO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.834
_cell_length_b   5.638
_cell_length_c   7.514
_cell_angle_alpha   82.137
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   202.841
_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
  Sc  Sc0  1  0.500  0.000  0.500  1.0
  Sc  Sc1  1  0.000  0.500  0.500  1.0
  Re  Re2  1  0.991  0.128  0.850  1.0
  Re  Re3  1  0.009  0.872  0.150  1.0
  Re  Re4  1  0.509  0.628  0.850  1.0
  Re  Re5  1  0.491  0.372  0.150  1.0
  O  O6  1  0.324  0.674  0.618  1.0
  O  O7  1  0.232  0.841  0.930  1.0
  O  O8  1  0.217  0.578  0.247  1.0
  O  O9  1  0.824  0.826  0.382  1.0
  O  O10  1  0.717  0.922  0.753  1.0
  O  O11  1  0.783  0.422  0.753  1.0
  O  O12  1  0.676  0.326  0.382  1.0
  O  O13  1  0.283  0.078  0.247  1.0
  O  O14  1  0.268  0.341  0.930  1.0
  O  O15  1  0.176  0.174  0.618  1.0
  O  O16  1  0.768  0.159  0.070  1.0
  O  O17  1  0.732  0.659  0.070  1.0
[/CIF]
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The material structure described by ScRe2O6 is Hydrophilite-derived structured and crystallizes in the monoclinic P2_1/c space group. Sc(1) is bonded to two equivalent O(3) and four equivalent O(1) atoms to form ScO6 octahedra that share corners with four equivalent Sc(1)O6 octahedra, corners with four equivalent Re(1)O6 octahedra, and edges with two equivalent Re(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 45-56°. Re(1) is bonded to one O(1), two equivalent O(3), and three equivalent O(2) atoms to form ReO6 octahedra that share corners with two equivalent Sc(1)O6 octahedra, corners with six equivalent Re(1)O6 octahedra,  an edgeedge with one Sc(1)O6 octahedra, and  an edgeedge with one Re(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 36-54°. There are three inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to two equivalent Sc(1) and one Re(1) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to three equivalent Re(1) atoms. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Sc(1) and two equivalent Re(1) atoms. is represented by the CIF file [CIF]
data_Sc(ReO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.834
_cell_length_b   5.638
_cell_length_c   7.514
_cell_angle_alpha   82.137
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   202.841
_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
  Sc  Sc0  1  0.500  0.000  0.500  1.0
  Sc  Sc1  1  0.000  0.500  0.500  1.0
  Re  Re2  1  0.991  0.128  0.850  1.0
  Re  Re3  1  0.009  0.872  0.150  1.0
  Re  Re4  1  0.509  0.628  0.850  1.0
  Re  Re5  1  0.491  0.372  0.150  1.0
  O  O6  1  0.324  0.674  0.618  1.0
  O  O7  1  0.232  0.841  0.930  1.0
  O  O8  1  0.217  0.578  0.247  1.0
  O  O9  1  0.824  0.826  0.382  1.0
  O  O10  1  0.717  0.922  0.753  1.0
  O  O11  1  0.783  0.422  0.753  1.0
  O  O12  1  0.676  0.326  0.382  1.0
  O  O13  1  0.283  0.078  0.247  1.0
  O  O14  1  0.268  0.341  0.930  1.0
  O  O15  1  0.176  0.174  0.618  1.0
  O  O16  1  0.768  0.159  0.070  1.0
  O  O17  1  0.732  0.659  0.070  1.0
[/CIF]
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