The structure described by BiScO3 crystallizes in the monoclinic Cc space group. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form corner-sharing ScO6 octahedra. The corner-sharing octahedral tilt angles range from 22-36°. In the second Sc site, Sc(2) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form corner-sharing ScO6 octahedra. The corner-sharing octahedral tilt angles range from 22-36°. There are two inequivalent Bi sites. In the first Bi site, Bi(1) is bonded in a 4-coordinate geometry to one O(1), one O(2), one O(3), and one O(4) atom. In the second Bi site, Bi(2) is bonded in a 5-coordinate geometry to one O(2), one O(3), one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted T-shaped geometry to one Sc(1), one Sc(2), and one Bi(1) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one Sc(1), one Sc(2), one Bi(1), and one Bi(2) atom. In the third O site, O(3) is bonded to one Sc(1), one Sc(2), one Bi(1), and one Bi(2) atom to form a mixture of distorted corner and edge-sharing OSc2Bi2 tetrahedra. In the fourth O site, O(4) is bonded to one Sc(1), one Sc(2), one Bi(1), and one Bi(2) atom to form a mixture of distorted corner and edge-sharing OSc2Bi2 tetrahedra. In the fifth O site, O(5) is bonded in a distorted T-shaped geometry to one Sc(1), one Sc(2), and one Bi(2) atom. In the sixth O site, O(6) is bonded in a distorted T-shaped geometry to one Sc(1), one Sc(2), and one Bi(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_ScBiO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.796
_cell_length_b   5.796
_cell_length_c   10.150
_cell_angle_alpha   73.788
_cell_angle_beta   73.788
_cell_angle_gamma   61.127
_symmetry_Int_Tables_number   1
_cell_volume   282.419
_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
  Sc  Sc0  1  0.986  0.495  0.499  1.0
  Sc  Sc1  1  0.241  0.743  0.749  1.0
  Sc  Sc2  1  0.495  0.986  0.999  1.0
  Sc  Sc3  1  0.743  0.241  0.249  1.0
  Bi  Bi4  1  0.679  0.041  0.633  1.0
  Bi  Bi5  1  0.041  0.679  0.133  1.0
  Bi  Bi6  1  0.313  0.946  0.367  1.0
  Bi  Bi7  1  0.946  0.313  0.867  1.0
  O  O8  1  0.612  0.693  0.630  1.0
  O  O9  1  0.856  0.818  0.336  1.0
  O  O10  1  0.885  0.256  0.418  1.0
  O  O11  1  0.098  0.726  0.579  1.0
  O  O12  1  0.172  0.095  0.165  1.0
  O  O13  1  0.310  0.359  0.862  1.0
  O  O14  1  0.818  0.856  0.836  1.0
  O  O15  1  0.359  0.310  0.362  1.0
  O  O16  1  0.726  0.098  0.079  1.0
  O  O17  1  0.693  0.612  0.130  1.0
  O  O18  1  0.095  0.172  0.665  1.0
  O  O19  1  0.256  0.885  0.918  1.0
[/CIF]
.
The structure described by BiScO3 crystallizes in the monoclinic Cc space group. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form corner-sharing ScO6 octahedra. The corner-sharing octahedral tilt angles range from 22-36°. In the second Sc site, Sc(2) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form corner-sharing ScO6 octahedra. The corner-sharing octahedral tilt angles range from 22-36°. There are two inequivalent Bi sites. In the first Bi site, Bi(1) is bonded in a 4-coordinate geometry to one O(1), one O(2), one O(3), and one O(4) atom. In the second Bi site, Bi(2) is bonded in a 5-coordinate geometry to one O(2), one O(3), one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted T-shaped geometry to one Sc(1), one Sc(2), and one Bi(1) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one Sc(1), one Sc(2), one Bi(1), and one Bi(2) atom. In the third O site, O(3) is bonded to one Sc(1), one Sc(2), one Bi(1), and one Bi(2) atom to form a mixture of distorted corner and edge-sharing OSc2Bi2 tetrahedra. In the fourth O site, O(4) is bonded to one Sc(1), one Sc(2), one Bi(1), and one Bi(2) atom to form a mixture of distorted corner and edge-sharing OSc2Bi2 tetrahedra. In the fifth O site, O(5) is bonded in a distorted T-shaped geometry to one Sc(1), one Sc(2), and one Bi(2) atom. In the sixth O site, O(6) is bonded in a distorted T-shaped geometry to one Sc(1), one Sc(2), and one Bi(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_ScBiO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.796
_cell_length_b   5.796
_cell_length_c   10.150
_cell_angle_alpha   73.788
_cell_angle_beta   73.788
_cell_angle_gamma   61.127
_symmetry_Int_Tables_number   1
_cell_volume   282.419
_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
  Sc  Sc0  1  0.986  0.495  0.499  1.0
  Sc  Sc1  1  0.241  0.743  0.749  1.0
  Sc  Sc2  1  0.495  0.986  0.999  1.0
  Sc  Sc3  1  0.743  0.241  0.249  1.0
  Bi  Bi4  1  0.679  0.041  0.633  1.0
  Bi  Bi5  1  0.041  0.679  0.133  1.0
  Bi  Bi6  1  0.313  0.946  0.367  1.0
  Bi  Bi7  1  0.946  0.313  0.867  1.0
  O  O8  1  0.612  0.693  0.630  1.0
  O  O9  1  0.856  0.818  0.336  1.0
  O  O10  1  0.885  0.256  0.418  1.0
  O  O11  1  0.098  0.726  0.579  1.0
  O  O12  1  0.172  0.095  0.165  1.0
  O  O13  1  0.310  0.359  0.862  1.0
  O  O14  1  0.818  0.856  0.836  1.0
  O  O15  1  0.359  0.310  0.362  1.0
  O  O16  1  0.726  0.098  0.079  1.0
  O  O17  1  0.693  0.612  0.130  1.0
  O  O18  1  0.095  0.172  0.665  1.0
  O  O19  1  0.256  0.885  0.918  1.0
[/CIF]
.