The compound described by YSbO3 crystallizes in the hexagonal P6_3cm space group. There are two inequivalent Y sites. In the first Y site, Y(1) is bonded in a 7-coordinate geometry to one O(1), three equivalent O(3), and three equivalent O(4) atoms. In the second Y site, Y(2) is bonded in a 7-coordinate geometry to one O(2), three equivalent O(3), and three equivalent O(4) atoms. Sb(1) is bonded to one O(2), one O(3), one O(4), and two equivalent O(1) atoms to form corner-sharing SbO5 trigonal bipyramids. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Y(1) and three equivalent Sb(1) atoms to form distorted OYSb3 trigonal pyramids that share corners with three equivalent O(2)YSb3 tetrahedra, corners with six equivalent O(3)Y3Sb tetrahedra, corners with three equivalent O(1)YSb3 trigonal pyramids, and edges with three equivalent O(4)Y3Sb tetrahedra. In the second O site, O(2) is bonded to one Y(2) and three equivalent Sb(1) atoms to form OYSb3 tetrahedra that share corners with six equivalent O(4)Y3Sb tetrahedra, corners with six equivalent O(1)YSb3 trigonal pyramids, and edges with three equivalent O(3)Y3Sb tetrahedra. In the third O site, O(3) is bonded to one Y(2), two equivalent Y(1), and one Sb(1) atom to form OY3Sb tetrahedra that share corners with four equivalent O(4)Y3Sb tetrahedra, corners with six equivalent O(3)Y3Sb tetrahedra, corners with four equivalent O(1)YSb3 trigonal pyramids,  an edgeedge with one O(2)YSb3 tetrahedra, and edges with three equivalent O(4)Y3Sb tetrahedra. In the fourth O site, O(4) is bonded to one Y(2), two equivalent Y(1), and one Sb(1) atom to form OY3Sb tetrahedra that share corners with two equivalent O(2)YSb3 tetrahedra, corners with four equivalent O(3)Y3Sb tetrahedra, corners with six equivalent O(4)Y3Sb tetrahedra, edges with three equivalent O(3)Y3Sb tetrahedra, and edges with two equivalent O(1)YSb3 trigonal pyramids. is represented by the CIF card [CIF]
data_YSbO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.523
_cell_length_b   6.523
_cell_length_c   12.653
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   466.315
_cell_formula_units_Z   6
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
  Y  Y0  1  0.667  0.333  0.236  1.0
  Y  Y1  1  0.333  0.667  0.736  1.0
  Y  Y2  1  0.667  0.333  0.736  1.0
  Y  Y3  1  0.333  0.667  0.236  1.0
  Y  Y4  1  0.000  0.000  0.768  1.0
  Y  Y5  1  0.000  0.000  0.268  1.0
  Sb  Sb6  1  0.667  0.000  0.501  1.0
  Sb  Sb7  1  0.667  0.667  0.001  1.0
  Sb  Sb8  1  0.000  0.333  0.001  1.0
  Sb  Sb9  1  0.000  0.667  0.501  1.0
  Sb  Sb10  1  0.333  0.333  0.501  1.0
  Sb  Sb11  1  0.333  0.000  0.001  1.0
  O  O12  1  0.667  0.333  0.029  1.0
  O  O13  1  0.333  0.667  0.529  1.0
  O  O14  1  0.667  0.333  0.529  1.0
  O  O15  1  0.333  0.667  0.029  1.0
  O  O16  1  0.000  0.000  0.967  1.0
  O  O17  1  0.000  0.000  0.467  1.0
  O  O18  1  0.361  0.000  0.826  1.0
  O  O19  1  0.361  0.361  0.326  1.0
  O  O20  1  0.000  0.639  0.326  1.0
  O  O21  1  0.000  0.361  0.826  1.0
  O  O22  1  0.639  0.639  0.826  1.0
  O  O23  1  0.639  0.000  0.326  1.0
  O  O24  1  0.309  0.000  0.177  1.0
  O  O25  1  0.309  0.309  0.677  1.0
  O  O26  1  0.000  0.691  0.677  1.0
  O  O27  1  0.000  0.309  0.177  1.0
  O  O28  1  0.691  0.691  0.177  1.0
  O  O29  1  0.691  0.000  0.677  1.0
[/CIF]
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The compound described by YSbO3 crystallizes in the hexagonal P6_3cm space group. There are two inequivalent Y sites. In the first Y site, Y(1) is bonded in a 7-coordinate geometry to one O(1), three equivalent O(3), and three equivalent O(4) atoms. In the second Y site, Y(2) is bonded in a 7-coordinate geometry to one O(2), three equivalent O(3), and three equivalent O(4) atoms. Sb(1) is bonded to one O(2), one O(3), one O(4), and two equivalent O(1) atoms to form corner-sharing SbO5 trigonal bipyramids. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Y(1) and three equivalent Sb(1) atoms to form distorted OYSb3 trigonal pyramids that share corners with three equivalent O(2)YSb3 tetrahedra, corners with six equivalent O(3)Y3Sb tetrahedra, corners with three equivalent O(1)YSb3 trigonal pyramids, and edges with three equivalent O(4)Y3Sb tetrahedra. In the second O site, O(2) is bonded to one Y(2) and three equivalent Sb(1) atoms to form OYSb3 tetrahedra that share corners with six equivalent O(4)Y3Sb tetrahedra, corners with six equivalent O(1)YSb3 trigonal pyramids, and edges with three equivalent O(3)Y3Sb tetrahedra. In the third O site, O(3) is bonded to one Y(2), two equivalent Y(1), and one Sb(1) atom to form OY3Sb tetrahedra that share corners with four equivalent O(4)Y3Sb tetrahedra, corners with six equivalent O(3)Y3Sb tetrahedra, corners with four equivalent O(1)YSb3 trigonal pyramids,  an edgeedge with one O(2)YSb3 tetrahedra, and edges with three equivalent O(4)Y3Sb tetrahedra. In the fourth O site, O(4) is bonded to one Y(2), two equivalent Y(1), and one Sb(1) atom to form OY3Sb tetrahedra that share corners with two equivalent O(2)YSb3 tetrahedra, corners with four equivalent O(3)Y3Sb tetrahedra, corners with six equivalent O(4)Y3Sb tetrahedra, edges with three equivalent O(3)Y3Sb tetrahedra, and edges with two equivalent O(1)YSb3 trigonal pyramids. is represented by the CIF card [CIF]
data_YSbO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.523
_cell_length_b   6.523
_cell_length_c   12.653
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   466.315
_cell_formula_units_Z   6
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
  Y  Y0  1  0.667  0.333  0.236  1.0
  Y  Y1  1  0.333  0.667  0.736  1.0
  Y  Y2  1  0.667  0.333  0.736  1.0
  Y  Y3  1  0.333  0.667  0.236  1.0
  Y  Y4  1  0.000  0.000  0.768  1.0
  Y  Y5  1  0.000  0.000  0.268  1.0
  Sb  Sb6  1  0.667  0.000  0.501  1.0
  Sb  Sb7  1  0.667  0.667  0.001  1.0
  Sb  Sb8  1  0.000  0.333  0.001  1.0
  Sb  Sb9  1  0.000  0.667  0.501  1.0
  Sb  Sb10  1  0.333  0.333  0.501  1.0
  Sb  Sb11  1  0.333  0.000  0.001  1.0
  O  O12  1  0.667  0.333  0.029  1.0
  O  O13  1  0.333  0.667  0.529  1.0
  O  O14  1  0.667  0.333  0.529  1.0
  O  O15  1  0.333  0.667  0.029  1.0
  O  O16  1  0.000  0.000  0.967  1.0
  O  O17  1  0.000  0.000  0.467  1.0
  O  O18  1  0.361  0.000  0.826  1.0
  O  O19  1  0.361  0.361  0.326  1.0
  O  O20  1  0.000  0.639  0.326  1.0
  O  O21  1  0.000  0.361  0.826  1.0
  O  O22  1  0.639  0.639  0.826  1.0
  O  O23  1  0.639  0.000  0.326  1.0
  O  O24  1  0.309  0.000  0.177  1.0
  O  O25  1  0.309  0.309  0.677  1.0
  O  O26  1  0.000  0.691  0.677  1.0
  O  O27  1  0.000  0.309  0.177  1.0
  O  O28  1  0.691  0.691  0.177  1.0
  O  O29  1  0.691  0.000  0.677  1.0
[/CIF]
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