The crystal structure described by YSbO3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. Y(1) is bonded in a 4-coordinate geometry to two equivalent O(2) and four equivalent O(1) atoms. Sb(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form corner-sharing SbO6 octahedra. The corner-sharing octahedral tilt angles range from 47-54°. There are two inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to two equivalent Y(1) and two equivalent Sb(1) atoms. In the second O site, O(2) is bonded in a distorted see-saw-like geometry to two equivalent Y(1) and two equivalent Sb(1) atoms. is represented by the CIF file [CIF]
data_YSbO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.737
_cell_length_b   6.045
_cell_length_c   8.559
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   296.825
_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
  Y  Y0  1  0.519  0.442  0.250  1.0
  Y  Y1  1  0.019  0.058  0.750  1.0
  Y  Y2  1  0.981  0.942  0.250  1.0
  Y  Y3  1  0.481  0.558  0.750  1.0
  Sb  Sb4  1  0.500  0.000  0.000  1.0
  Sb  Sb5  1  0.000  0.500  0.000  1.0
  Sb  Sb6  1  0.000  0.500  0.500  1.0
  Sb  Sb7  1  0.500  0.000  0.500  1.0
  O  O8  1  0.179  0.816  0.919  1.0
  O  O9  1  0.679  0.684  0.081  1.0
  O  O10  1  0.321  0.316  0.581  1.0
  O  O11  1  0.821  0.184  0.419  1.0
  O  O12  1  0.821  0.184  0.081  1.0
  O  O13  1  0.321  0.316  0.919  1.0
  O  O14  1  0.679  0.684  0.419  1.0
  O  O15  1  0.179  0.816  0.581  1.0
  O  O16  1  0.663  0.906  0.750  1.0
  O  O17  1  0.163  0.594  0.250  1.0
  O  O18  1  0.837  0.406  0.750  1.0
  O  O19  1  0.337  0.094  0.250  1.0
[/CIF]
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The crystal structure described by YSbO3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. Y(1) is bonded in a 4-coordinate geometry to two equivalent O(2) and four equivalent O(1) atoms. Sb(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form corner-sharing SbO6 octahedra. The corner-sharing octahedral tilt angles range from 47-54°. There are two inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to two equivalent Y(1) and two equivalent Sb(1) atoms. In the second O site, O(2) is bonded in a distorted see-saw-like geometry to two equivalent Y(1) and two equivalent Sb(1) atoms. is represented by the CIF file [CIF]
data_YSbO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.737
_cell_length_b   6.045
_cell_length_c   8.559
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   296.825
_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
  Y  Y0  1  0.519  0.442  0.250  1.0
  Y  Y1  1  0.019  0.058  0.750  1.0
  Y  Y2  1  0.981  0.942  0.250  1.0
  Y  Y3  1  0.481  0.558  0.750  1.0
  Sb  Sb4  1  0.500  0.000  0.000  1.0
  Sb  Sb5  1  0.000  0.500  0.000  1.0
  Sb  Sb6  1  0.000  0.500  0.500  1.0
  Sb  Sb7  1  0.500  0.000  0.500  1.0
  O  O8  1  0.179  0.816  0.919  1.0
  O  O9  1  0.679  0.684  0.081  1.0
  O  O10  1  0.321  0.316  0.581  1.0
  O  O11  1  0.821  0.184  0.419  1.0
  O  O12  1  0.821  0.184  0.081  1.0
  O  O13  1  0.321  0.316  0.919  1.0
  O  O14  1  0.679  0.684  0.419  1.0
  O  O15  1  0.179  0.816  0.581  1.0
  O  O16  1  0.663  0.906  0.750  1.0
  O  O17  1  0.163  0.594  0.250  1.0
  O  O18  1  0.837  0.406  0.750  1.0
  O  O19  1  0.337  0.094  0.250  1.0
[/CIF]
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