The material described by Na5InO4 is Ilmenite-like structured and crystallizes in the orthorhombic Pmmn space group. There are two inequivalent Na sites. In the first Na site, Na(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form distorted NaO4 trigonal pyramids that share corners with two equivalent Na(2)O4 tetrahedra, corners with two equivalent In(1)O4 tetrahedra, corners with eight equivalent Na(1)O4 trigonal pyramids,  an edgeedge with one Na(2)O4 tetrahedra,  an edgeedge with one In(1)O4 tetrahedra, and edges with two equivalent Na(1)O4 trigonal pyramids. In the second Na site, Na(2) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form NaO4 tetrahedra that share corners with four equivalent In(1)O4 tetrahedra, corners with eight equivalent Na(1)O4 trigonal pyramids, and edges with four equivalent Na(1)O4 trigonal pyramids. In(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form InO4 tetrahedra that share corners with four equivalent Na(2)O4 tetrahedra, corners with eight equivalent Na(1)O4 trigonal pyramids, and edges with four equivalent Na(1)O4 trigonal pyramids. There are two inequivalent O sites. In the first O site, O(1) is bonded to one Na(2), four equivalent Na(1), and one In(1) atom to form a mixture of edge and corner-sharing ONa5In octahedra. The corner-sharing octahedral tilt angles range from 60-64°. In the second O site, O(2) is bonded in a 6-coordinate geometry to one Na(2), four equivalent Na(1), and one In(1) atom. is represented by the CIF card [CIF]
data_Na5InO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.444
_cell_length_b   7.356
_cell_length_c   7.557
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   302.628
_cell_formula_units_Z   2
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  0.256  0.740  0.695  1.0
  Na  Na1  1  0.744  0.240  0.805  1.0
  Na  Na2  1  0.804  0.000  0.500  1.0
  Na  Na3  1  0.196  0.500  0.000  1.0
  Na  Na4  1  0.256  0.260  0.695  1.0
  Na  Na5  1  0.256  0.740  0.305  1.0
  Na  Na6  1  0.744  0.760  0.805  1.0
  Na  Na7  1  0.744  0.240  0.195  1.0
  Na  Na8  1  0.744  0.760  0.195  1.0
  Na  Na9  1  0.256  0.260  0.305  1.0
  In  In10  1  0.221  0.000  0.000  1.0
  In  In11  1  0.779  0.500  0.500  1.0
  O  O12  1  0.017  0.000  0.234  1.0
  O  O13  1  0.017  0.000  0.766  1.0
  O  O14  1  0.422  0.761  0.000  1.0
  O  O15  1  0.422  0.239  0.000  1.0
  O  O16  1  0.578  0.261  0.500  1.0
  O  O17  1  0.578  0.739  0.500  1.0
  O  O18  1  0.983  0.500  0.266  1.0
  O  O19  1  0.983  0.500  0.734  1.0
[/CIF]
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The material described by Na5InO4 is Ilmenite-like structured and crystallizes in the orthorhombic Pmmn space group. There are two inequivalent Na sites. In the first Na site, Na(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form distorted NaO4 trigonal pyramids that share corners with two equivalent Na(2)O4 tetrahedra, corners with two equivalent In(1)O4 tetrahedra, corners with eight equivalent Na(1)O4 trigonal pyramids,  an edgeedge with one Na(2)O4 tetrahedra,  an edgeedge with one In(1)O4 tetrahedra, and edges with two equivalent Na(1)O4 trigonal pyramids. In the second Na site, Na(2) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form NaO4 tetrahedra that share corners with four equivalent In(1)O4 tetrahedra, corners with eight equivalent Na(1)O4 trigonal pyramids, and edges with four equivalent Na(1)O4 trigonal pyramids. In(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form InO4 tetrahedra that share corners with four equivalent Na(2)O4 tetrahedra, corners with eight equivalent Na(1)O4 trigonal pyramids, and edges with four equivalent Na(1)O4 trigonal pyramids. There are two inequivalent O sites. In the first O site, O(1) is bonded to one Na(2), four equivalent Na(1), and one In(1) atom to form a mixture of edge and corner-sharing ONa5In octahedra. The corner-sharing octahedral tilt angles range from 60-64°. In the second O site, O(2) is bonded in a 6-coordinate geometry to one Na(2), four equivalent Na(1), and one In(1) atom. is represented by the CIF card [CIF]
data_Na5InO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.444
_cell_length_b   7.356
_cell_length_c   7.557
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   302.628
_cell_formula_units_Z   2
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  0.256  0.740  0.695  1.0
  Na  Na1  1  0.744  0.240  0.805  1.0
  Na  Na2  1  0.804  0.000  0.500  1.0
  Na  Na3  1  0.196  0.500  0.000  1.0
  Na  Na4  1  0.256  0.260  0.695  1.0
  Na  Na5  1  0.256  0.740  0.305  1.0
  Na  Na6  1  0.744  0.760  0.805  1.0
  Na  Na7  1  0.744  0.240  0.195  1.0
  Na  Na8  1  0.744  0.760  0.195  1.0
  Na  Na9  1  0.256  0.260  0.305  1.0
  In  In10  1  0.221  0.000  0.000  1.0
  In  In11  1  0.779  0.500  0.500  1.0
  O  O12  1  0.017  0.000  0.234  1.0
  O  O13  1  0.017  0.000  0.766  1.0
  O  O14  1  0.422  0.761  0.000  1.0
  O  O15  1  0.422  0.239  0.000  1.0
  O  O16  1  0.578  0.261  0.500  1.0
  O  O17  1  0.578  0.739  0.500  1.0
  O  O18  1  0.983  0.500  0.266  1.0
  O  O19  1  0.983  0.500  0.734  1.0
[/CIF]
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