The compound described by CaLa2BiO6 is Corundum-derived structured and crystallizes in the trigonal R-3 space group. Ca(1) is bonded to six equivalent O(1) atoms to form CaO6 octahedra that share corners with six equivalent Bi(1)O6 octahedra. The corner-sharing octahedral tilt angles are 39°. La(1) is bonded in a 6-coordinate geometry to six equivalent O(1) atoms. Bi(1) is bonded to six equivalent O(1) atoms to form BiO6 octahedra that share corners with six equivalent Ca(1)O6 octahedra. The corner-sharing octahedral tilt angles are 39°. O(1) is bonded to one Ca(1), two equivalent La(1), and one Bi(1) atom to form a mixture of corner and edge-sharing OCaLa2Bi trigonal pyramids. is represented by the Crystallographic Information File (CIF) [CIF]
data_CaLa2BiO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.250
_cell_length_b   6.250
_cell_length_c   6.250
_cell_angle_alpha   58.884
_cell_angle_beta   58.884
_cell_angle_gamma   58.884
_symmetry_Int_Tables_number   1
_cell_volume   168.222
_cell_formula_units_Z   1
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
  Ca  Ca0  1  0.500  0.500  0.500  1.0
  La  La1  1  0.782  0.782  0.782  1.0
  La  La2  1  0.218  0.218  0.218  1.0
  Bi  Bi3  1  0.000  0.000  0.000  1.0
  O  O4  1  0.794  0.365  0.122  1.0
  O  O5  1  0.122  0.794  0.365  1.0
  O  O6  1  0.365  0.122  0.794  1.0
  O  O7  1  0.206  0.635  0.878  1.0
  O  O8  1  0.635  0.878  0.206  1.0
  O  O9  1  0.878  0.206  0.635  1.0
[/CIF]
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The compound described by CaLa2BiO6 is Corundum-derived structured and crystallizes in the trigonal R-3 space group. Ca(1) is bonded to six equivalent O(1) atoms to form CaO6 octahedra that share corners with six equivalent Bi(1)O6 octahedra. The corner-sharing octahedral tilt angles are 39°. La(1) is bonded in a 6-coordinate geometry to six equivalent O(1) atoms. Bi(1) is bonded to six equivalent O(1) atoms to form BiO6 octahedra that share corners with six equivalent Ca(1)O6 octahedra. The corner-sharing octahedral tilt angles are 39°. O(1) is bonded to one Ca(1), two equivalent La(1), and one Bi(1) atom to form a mixture of corner and edge-sharing OCaLa2Bi trigonal pyramids. is represented by the Crystallographic Information File (CIF) [CIF]
data_CaLa2BiO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.250
_cell_length_b   6.250
_cell_length_c   6.250
_cell_angle_alpha   58.884
_cell_angle_beta   58.884
_cell_angle_gamma   58.884
_symmetry_Int_Tables_number   1
_cell_volume   168.222
_cell_formula_units_Z   1
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
  Ca  Ca0  1  0.500  0.500  0.500  1.0
  La  La1  1  0.782  0.782  0.782  1.0
  La  La2  1  0.218  0.218  0.218  1.0
  Bi  Bi3  1  0.000  0.000  0.000  1.0
  O  O4  1  0.794  0.365  0.122  1.0
  O  O5  1  0.122  0.794  0.365  1.0
  O  O6  1  0.365  0.122  0.794  1.0
  O  O7  1  0.206  0.635  0.878  1.0
  O  O8  1  0.635  0.878  0.206  1.0
  O  O9  1  0.878  0.206  0.635  1.0
[/CIF]
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