The compound described by NaSbO3 is Ilmenite-like structured and crystallizes in the orthorhombic Pnna space group. Na(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form distorted NaO6 pentagonal pyramids that share corners with six equivalent Sb(1)O6 octahedra, edges with three equivalent Sb(1)O6 octahedra, and faces with two equivalent Na(1)O6 pentagonal pyramids. The corner-sharing octahedral tilt angles range from 41-62°. Sb(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form SbO6 octahedra that share corners with two equivalent Sb(1)O6 octahedra, corners with six equivalent Na(1)O6 pentagonal pyramids, edges with two equivalent Sb(1)O6 octahedra, and edges with three equivalent Na(1)O6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 41°. There are two inequivalent O sites. In the first O site, O(1) is bonded to two equivalent Na(1) and two equivalent Sb(1) atoms to form a mixture of distorted corner and edge-sharing ONa2Sb2 trigonal pyramids. In the second O site, O(2) is bonded in a 4-coordinate geometry to two equivalent Na(1) and two equivalent Sb(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaSbO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.348
_cell_length_b   5.401
_cell_length_c   8.496
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   245.379
_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
  Na  Na0  1  0.750  0.000  0.185  1.0
  Na  Na1  1  0.250  0.000  0.815  1.0
  Na  Na2  1  0.250  0.500  0.685  1.0
  Na  Na3  1  0.750  0.500  0.315  1.0
  Sb  Sb4  1  0.250  0.000  0.404  1.0
  Sb  Sb5  1  0.750  0.000  0.596  1.0
  Sb  Sb6  1  0.250  0.500  0.096  1.0
  Sb  Sb7  1  0.750  0.500  0.904  1.0
  O  O8  1  0.568  0.184  0.422  1.0
  O  O9  1  0.068  0.184  0.578  1.0
  O  O10  1  0.618  0.250  0.750  1.0
  O  O11  1  0.118  0.250  0.250  1.0
  O  O12  1  0.568  0.316  0.078  1.0
  O  O13  1  0.068  0.316  0.922  1.0
  O  O14  1  0.932  0.684  0.078  1.0
  O  O15  1  0.432  0.684  0.922  1.0
  O  O16  1  0.882  0.750  0.750  1.0
  O  O17  1  0.382  0.750  0.250  1.0
  O  O18  1  0.932  0.816  0.422  1.0
  O  O19  1  0.432  0.816  0.578  1.0
[/CIF]
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The compound described by NaSbO3 is Ilmenite-like structured and crystallizes in the orthorhombic Pnna space group. Na(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form distorted NaO6 pentagonal pyramids that share corners with six equivalent Sb(1)O6 octahedra, edges with three equivalent Sb(1)O6 octahedra, and faces with two equivalent Na(1)O6 pentagonal pyramids. The corner-sharing octahedral tilt angles range from 41-62°. Sb(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form SbO6 octahedra that share corners with two equivalent Sb(1)O6 octahedra, corners with six equivalent Na(1)O6 pentagonal pyramids, edges with two equivalent Sb(1)O6 octahedra, and edges with three equivalent Na(1)O6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 41°. There are two inequivalent O sites. In the first O site, O(1) is bonded to two equivalent Na(1) and two equivalent Sb(1) atoms to form a mixture of distorted corner and edge-sharing ONa2Sb2 trigonal pyramids. In the second O site, O(2) is bonded in a 4-coordinate geometry to two equivalent Na(1) and two equivalent Sb(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaSbO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.348
_cell_length_b   5.401
_cell_length_c   8.496
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   245.379
_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
  Na  Na0  1  0.750  0.000  0.185  1.0
  Na  Na1  1  0.250  0.000  0.815  1.0
  Na  Na2  1  0.250  0.500  0.685  1.0
  Na  Na3  1  0.750  0.500  0.315  1.0
  Sb  Sb4  1  0.250  0.000  0.404  1.0
  Sb  Sb5  1  0.750  0.000  0.596  1.0
  Sb  Sb6  1  0.250  0.500  0.096  1.0
  Sb  Sb7  1  0.750  0.500  0.904  1.0
  O  O8  1  0.568  0.184  0.422  1.0
  O  O9  1  0.068  0.184  0.578  1.0
  O  O10  1  0.618  0.250  0.750  1.0
  O  O11  1  0.118  0.250  0.250  1.0
  O  O12  1  0.568  0.316  0.078  1.0
  O  O13  1  0.068  0.316  0.922  1.0
  O  O14  1  0.932  0.684  0.078  1.0
  O  O15  1  0.432  0.684  0.922  1.0
  O  O16  1  0.882  0.750  0.750  1.0
  O  O17  1  0.382  0.750  0.250  1.0
  O  O18  1  0.932  0.816  0.422  1.0
  O  O19  1  0.432  0.816  0.578  1.0
[/CIF]
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