The crystal structure described by NaVO3 crystallizes in the orthorhombic Ibam space group. Na(1) is bonded in a see-saw-like geometry to two equivalent O(2) and two equivalent O(3) atoms. V(1) is bonded to one O(2), one O(3), and two equivalent O(1) atoms to form corner-sharing VO4 tetrahedra. There are three inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to two equivalent V(1) atoms. In the second O site, O(2) is bonded in a distorted trigonal non-coplanar geometry to two equivalent Na(1) and one V(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to two equivalent Na(1) and one V(1) atom. is represented by the CIF card [CIF]
data_NaVO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.817
_cell_length_b   7.817
_cell_length_c   7.817
_cell_angle_alpha   133.043
_cell_angle_beta   106.854
_cell_angle_gamma   91.577
_symmetry_Int_Tables_number   1
_cell_volume   316.273
_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  0.707  0.750  0.457  1.0
  Na  Na1  1  0.293  0.750  0.043  1.0
  Na  Na2  1  0.293  0.250  0.543  1.0
  Na  Na3  1  0.707  0.250  0.957  1.0
  V  V4  1  0.135  0.220  0.915  1.0
  V  V5  1  0.304  0.720  0.585  1.0
  V  V6  1  0.696  0.280  0.415  1.0
  V  V7  1  0.865  0.780  0.085  1.0
  O  O8  1  0.169  0.919  0.750  1.0
  O  O9  1  0.169  0.419  0.250  1.0
  O  O10  1  0.600  0.346  0.254  1.0
  O  O11  1  0.267  0.373  0.893  1.0
  O  O12  1  0.092  0.846  0.246  1.0
  O  O13  1  0.480  0.873  0.607  1.0
  O  O14  1  0.520  0.127  0.393  1.0
  O  O15  1  0.908  0.154  0.754  1.0
  O  O16  1  0.733  0.627  0.107  1.0
  O  O17  1  0.400  0.654  0.746  1.0
  O  O18  1  0.831  0.581  0.750  1.0
  O  O19  1  0.831  0.081  0.250  1.0
[/CIF]
.
The crystal structure described by NaVO3 crystallizes in the orthorhombic Ibam space group. Na(1) is bonded in a see-saw-like geometry to two equivalent O(2) and two equivalent O(3) atoms. V(1) is bonded to one O(2), one O(3), and two equivalent O(1) atoms to form corner-sharing VO4 tetrahedra. There are three inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to two equivalent V(1) atoms. In the second O site, O(2) is bonded in a distorted trigonal non-coplanar geometry to two equivalent Na(1) and one V(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to two equivalent Na(1) and one V(1) atom. is represented by the CIF card [CIF]
data_NaVO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.817
_cell_length_b   7.817
_cell_length_c   7.817
_cell_angle_alpha   133.043
_cell_angle_beta   106.854
_cell_angle_gamma   91.577
_symmetry_Int_Tables_number   1
_cell_volume   316.273
_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  0.707  0.750  0.457  1.0
  Na  Na1  1  0.293  0.750  0.043  1.0
  Na  Na2  1  0.293  0.250  0.543  1.0
  Na  Na3  1  0.707  0.250  0.957  1.0
  V  V4  1  0.135  0.220  0.915  1.0
  V  V5  1  0.304  0.720  0.585  1.0
  V  V6  1  0.696  0.280  0.415  1.0
  V  V7  1  0.865  0.780  0.085  1.0
  O  O8  1  0.169  0.919  0.750  1.0
  O  O9  1  0.169  0.419  0.250  1.0
  O  O10  1  0.600  0.346  0.254  1.0
  O  O11  1  0.267  0.373  0.893  1.0
  O  O12  1  0.092  0.846  0.246  1.0
  O  O13  1  0.480  0.873  0.607  1.0
  O  O14  1  0.520  0.127  0.393  1.0
  O  O15  1  0.908  0.154  0.754  1.0
  O  O16  1  0.733  0.627  0.107  1.0
  O  O17  1  0.400  0.654  0.746  1.0
  O  O18  1  0.831  0.581  0.750  1.0
  O  O19  1  0.831  0.081  0.250  1.0
[/CIF]
.