The material described by Al(BiO3)3 crystallizes in the monoclinic Cc space group. Al(1) is bonded to one O(2), one O(3), one O(4), one O(5), one O(7), and one O(8) atom to form AlO6 octahedra that share  a cornercorner with one Bi(1)O6 octahedra, corners with two equivalent Bi(3)O6 octahedra,  an edgeedge with one Bi(1)O6 octahedra, edges with two equivalent Bi(2)O6 octahedra, and  a faceface with one Bi(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 52-55°. There are three inequivalent Bi sites. In the first Bi site, Bi(1) is bonded to one O(1), one O(3), one O(4), one O(6), one O(8), and one O(9) atom to form BiO6 octahedra that share  a cornercorner with one Al(1)O6 octahedra, corners with three equivalent Bi(2)O6 octahedra, corners with three equivalent Bi(3)O6 octahedra, and  an edgeedge with one Al(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 43-57°. In the second Bi site, Bi(2) is bonded to one O(1), one O(2), one O(4), one O(5), one O(7), and one O(9) atom to form BiO6 octahedra that share corners with three equivalent Bi(1)O6 octahedra, corners with three equivalent Bi(3)O6 octahedra, and edges with two equivalent Al(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 39-56°. In the third Bi site, Bi(3) is bonded to one O(2), one O(3), one O(5), one O(6), one O(7), and one O(8) atom to form distorted BiO6 octahedra that share corners with two equivalent Al(1)O6 octahedra, corners with three equivalent Bi(1)O6 octahedra, corners with three equivalent Bi(2)O6 octahedra, and  a faceface with one Al(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 39-57°. There are nine inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Bi(1) and one Bi(2) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Al(1), one Bi(2), and one Bi(3) atom. In the third O site, O(3) is bonded in a distorted T-shaped geometry to one Al(1), one Bi(1), and one Bi(3) atom. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one Al(1), one Bi(1), and one Bi(2) atom. In the fifth O site, O(5) is bonded in a distorted T-shaped geometry to one Al(1), one Bi(2), and one Bi(3) atom. In the sixth O site, O(6) is bonded in a bent 120 degrees geometry to one Bi(1) and one Bi(3) atom. In the seventh O site, O(7) is bonded in a distorted T-shaped geometry to one Al(1), one Bi(2), and one Bi(3) atom. In the eighth O site, O(8) is bonded in a distorted trigonal planar geometry to one Al(1), one Bi(1), and one Bi(3) atom. In the ninth O site, O(9) is bonded in a bent 120 degrees geometry to one Bi(1) and one Bi(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Al(BiO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.794
_cell_length_b   5.794
_cell_length_c   13.285
_cell_angle_alpha   86.059
_cell_angle_beta   86.059
_cell_angle_gamma   54.349
_symmetry_Int_Tables_number   1
_cell_volume   361.291
_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
  Al  Al0  1  0.718  0.706  0.430  1.0
  Al  Al1  1  0.706  0.718  0.930  1.0
  Bi  Bi2  1  0.639  0.619  0.666  1.0
  Bi  Bi3  1  0.308  0.303  0.314  1.0
  Bi  Bi4  1  0.966  0.994  0.996  1.0
  Bi  Bi5  1  0.303  0.308  0.814  1.0
  Bi  Bi6  1  0.994  0.966  0.496  1.0
  Bi  Bi7  1  0.619  0.639  0.166  1.0
  O  O8  1  0.641  0.278  0.733  1.0
  O  O9  1  0.325  0.942  0.403  1.0
  O  O10  1  0.896  0.666  0.055  1.0
  O  O11  1  0.505  0.847  0.807  1.0
  O  O12  1  0.116  0.543  0.448  1.0
  O  O13  1  0.831  0.201  0.132  1.0
  O  O14  1  0.020  0.729  0.870  1.0
  O  O15  1  0.728  0.419  0.514  1.0
  O  O16  1  0.386  0.080  0.184  1.0
  O  O17  1  0.942  0.325  0.903  1.0
  O  O18  1  0.666  0.896  0.555  1.0
  O  O19  1  0.278  0.641  0.233  1.0
  O  O20  1  0.080  0.386  0.684  1.0
  O  O21  1  0.729  0.020  0.370  1.0
  O  O22  1  0.419  0.728  0.014  1.0
  O  O23  1  0.201  0.831  0.632  1.0
  O  O24  1  0.847  0.505  0.307  1.0
  O  O25  1  0.543  0.116  0.948  1.0
[/CIF]
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The material described by Al(BiO3)3 crystallizes in the monoclinic Cc space group. Al(1) is bonded to one O(2), one O(3), one O(4), one O(5), one O(7), and one O(8) atom to form AlO6 octahedra that share  a cornercorner with one Bi(1)O6 octahedra, corners with two equivalent Bi(3)O6 octahedra,  an edgeedge with one Bi(1)O6 octahedra, edges with two equivalent Bi(2)O6 octahedra, and  a faceface with one Bi(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 52-55°. There are three inequivalent Bi sites. In the first Bi site, Bi(1) is bonded to one O(1), one O(3), one O(4), one O(6), one O(8), and one O(9) atom to form BiO6 octahedra that share  a cornercorner with one Al(1)O6 octahedra, corners with three equivalent Bi(2)O6 octahedra, corners with three equivalent Bi(3)O6 octahedra, and  an edgeedge with one Al(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 43-57°. In the second Bi site, Bi(2) is bonded to one O(1), one O(2), one O(4), one O(5), one O(7), and one O(9) atom to form BiO6 octahedra that share corners with three equivalent Bi(1)O6 octahedra, corners with three equivalent Bi(3)O6 octahedra, and edges with two equivalent Al(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 39-56°. In the third Bi site, Bi(3) is bonded to one O(2), one O(3), one O(5), one O(6), one O(7), and one O(8) atom to form distorted BiO6 octahedra that share corners with two equivalent Al(1)O6 octahedra, corners with three equivalent Bi(1)O6 octahedra, corners with three equivalent Bi(2)O6 octahedra, and  a faceface with one Al(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 39-57°. There are nine inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Bi(1) and one Bi(2) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Al(1), one Bi(2), and one Bi(3) atom. In the third O site, O(3) is bonded in a distorted T-shaped geometry to one Al(1), one Bi(1), and one Bi(3) atom. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one Al(1), one Bi(1), and one Bi(2) atom. In the fifth O site, O(5) is bonded in a distorted T-shaped geometry to one Al(1), one Bi(2), and one Bi(3) atom. In the sixth O site, O(6) is bonded in a bent 120 degrees geometry to one Bi(1) and one Bi(3) atom. In the seventh O site, O(7) is bonded in a distorted T-shaped geometry to one Al(1), one Bi(2), and one Bi(3) atom. In the eighth O site, O(8) is bonded in a distorted trigonal planar geometry to one Al(1), one Bi(1), and one Bi(3) atom. In the ninth O site, O(9) is bonded in a bent 120 degrees geometry to one Bi(1) and one Bi(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Al(BiO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.794
_cell_length_b   5.794
_cell_length_c   13.285
_cell_angle_alpha   86.059
_cell_angle_beta   86.059
_cell_angle_gamma   54.349
_symmetry_Int_Tables_number   1
_cell_volume   361.291
_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
  Al  Al0  1  0.718  0.706  0.430  1.0
  Al  Al1  1  0.706  0.718  0.930  1.0
  Bi  Bi2  1  0.639  0.619  0.666  1.0
  Bi  Bi3  1  0.308  0.303  0.314  1.0
  Bi  Bi4  1  0.966  0.994  0.996  1.0
  Bi  Bi5  1  0.303  0.308  0.814  1.0
  Bi  Bi6  1  0.994  0.966  0.496  1.0
  Bi  Bi7  1  0.619  0.639  0.166  1.0
  O  O8  1  0.641  0.278  0.733  1.0
  O  O9  1  0.325  0.942  0.403  1.0
  O  O10  1  0.896  0.666  0.055  1.0
  O  O11  1  0.505  0.847  0.807  1.0
  O  O12  1  0.116  0.543  0.448  1.0
  O  O13  1  0.831  0.201  0.132  1.0
  O  O14  1  0.020  0.729  0.870  1.0
  O  O15  1  0.728  0.419  0.514  1.0
  O  O16  1  0.386  0.080  0.184  1.0
  O  O17  1  0.942  0.325  0.903  1.0
  O  O18  1  0.666  0.896  0.555  1.0
  O  O19  1  0.278  0.641  0.233  1.0
  O  O20  1  0.080  0.386  0.684  1.0
  O  O21  1  0.729  0.020  0.370  1.0
  O  O22  1  0.419  0.728  0.014  1.0
  O  O23  1  0.201  0.831  0.632  1.0
  O  O24  1  0.847  0.505  0.307  1.0
  O  O25  1  0.543  0.116  0.948  1.0
[/CIF]
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