The crystal structure described by NaO3 is Baddeleyite-like structured and crystallizes in the orthorhombic Imm2 space group. Na(1) is bonded in a 7-coordinate geometry to one O(2) and six equivalent O(1) atoms. There are two inequivalent O sites. In the first O site, O(1) is bonded to three equivalent Na(1) and one O(2) atom to form a mixture of distorted corner and edge-sharing ONa3O tetrahedra. In the second O site, O(2) is bonded in a trigonal planar geometry to one Na(1) and two equivalent O(1) atoms. is represented by the CIF card [CIF]
data_NaO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.317
_cell_length_b   4.317
_cell_length_c   4.317
_cell_angle_alpha   130.122
_cell_angle_beta   103.050
_cell_angle_gamma   97.457
_symmetry_Int_Tables_number   1
_cell_volume   55.672
_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
  Na  Na0  1  0.483  0.483  0.000  1.0
  O  O1  1  0.880  0.091  0.788  1.0
  O  O2  1  0.959  0.959  0.000  1.0
  O  O3  1  0.303  0.091  0.212  1.0
[/CIF]
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The crystal structure described by NaO3 is Baddeleyite-like structured and crystallizes in the orthorhombic Imm2 space group. Na(1) is bonded in a 7-coordinate geometry to one O(2) and six equivalent O(1) atoms. There are two inequivalent O sites. In the first O site, O(1) is bonded to three equivalent Na(1) and one O(2) atom to form a mixture of distorted corner and edge-sharing ONa3O tetrahedra. In the second O site, O(2) is bonded in a trigonal planar geometry to one Na(1) and two equivalent O(1) atoms. is represented by the CIF card [CIF]
data_NaO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.317
_cell_length_b   4.317
_cell_length_c   4.317
_cell_angle_alpha   130.122
_cell_angle_beta   103.050
_cell_angle_gamma   97.457
_symmetry_Int_Tables_number   1
_cell_volume   55.672
_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
  Na  Na0  1  0.483  0.483  0.000  1.0
  O  O1  1  0.880  0.091  0.788  1.0
  O  O2  1  0.959  0.959  0.000  1.0
  O  O3  1  0.303  0.091  0.212  1.0
[/CIF]
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