The compound described by InO3 crystallizes in the orthorhombic Imm2 space group. In(1) is bonded to one O(1), one O(2), one O(3), one O(4), and two equivalent O(5) atoms to form distorted corner-sharing InO6 octahedra. The corner-sharing octahedral tilt angles range from 59-71°. There are five inequivalent O sites. In the first O site, O(1) is bonded in a trigonal non-coplanar geometry to two equivalent In(1) and one O(2) atom. In the second O site, O(2) is bonded in a trigonal non-coplanar geometry to two equivalent In(1) and one O(1) atom. In the third O site, O(3) is bonded in a trigonal planar geometry to two equivalent In(1) and one O(3) atom. In the fourth O site, O(4) is bonded in a trigonal planar geometry to two equivalent In(1) and one O(4) atom. In the fifth O site, O(5) is bonded in a bent 120 degrees geometry to two equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_InO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.834
_cell_length_b   6.834
_cell_length_c   6.834
_cell_angle_alpha   119.514
_cell_angle_beta   109.253
_cell_angle_gamma   100.231
_symmetry_Int_Tables_number   1
_cell_volume   238.710
_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
  In  In0  1  0.501  0.492  0.500  1.0
  In  In1  1  0.992  0.492  0.992  1.0
  In  In2  1  0.008  1.000  0.500  1.0
  In  In3  1  0.499  1.000  0.992  1.0
  O  O4  1  0.149  0.244  0.096  1.0
  O  O5  1  0.850  0.746  0.895  1.0
  O  O6  1  0.150  0.045  0.895  1.0
  O  O7  1  0.851  0.947  0.096  1.0
  O  O8  1  0.419  0.162  0.581  1.0
  O  O9  1  0.586  0.839  0.425  1.0
  O  O10  1  0.581  0.162  0.743  1.0
  O  O11  1  0.414  0.839  0.253  1.0
  O  O12  1  0.981  0.654  0.316  1.0
  O  O13  1  0.019  0.335  0.673  1.0
  O  O14  1  0.662  0.335  0.316  1.0
  O  O15  1  0.338  0.654  0.673  1.0
[/CIF]
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The compound described by InO3 crystallizes in the orthorhombic Imm2 space group. In(1) is bonded to one O(1), one O(2), one O(3), one O(4), and two equivalent O(5) atoms to form distorted corner-sharing InO6 octahedra. The corner-sharing octahedral tilt angles range from 59-71°. There are five inequivalent O sites. In the first O site, O(1) is bonded in a trigonal non-coplanar geometry to two equivalent In(1) and one O(2) atom. In the second O site, O(2) is bonded in a trigonal non-coplanar geometry to two equivalent In(1) and one O(1) atom. In the third O site, O(3) is bonded in a trigonal planar geometry to two equivalent In(1) and one O(3) atom. In the fourth O site, O(4) is bonded in a trigonal planar geometry to two equivalent In(1) and one O(4) atom. In the fifth O site, O(5) is bonded in a bent 120 degrees geometry to two equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_InO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.834
_cell_length_b   6.834
_cell_length_c   6.834
_cell_angle_alpha   119.514
_cell_angle_beta   109.253
_cell_angle_gamma   100.231
_symmetry_Int_Tables_number   1
_cell_volume   238.710
_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
  In  In0  1  0.501  0.492  0.500  1.0
  In  In1  1  0.992  0.492  0.992  1.0
  In  In2  1  0.008  1.000  0.500  1.0
  In  In3  1  0.499  1.000  0.992  1.0
  O  O4  1  0.149  0.244  0.096  1.0
  O  O5  1  0.850  0.746  0.895  1.0
  O  O6  1  0.150  0.045  0.895  1.0
  O  O7  1  0.851  0.947  0.096  1.0
  O  O8  1  0.419  0.162  0.581  1.0
  O  O9  1  0.586  0.839  0.425  1.0
  O  O10  1  0.581  0.162  0.743  1.0
  O  O11  1  0.414  0.839  0.253  1.0
  O  O12  1  0.981  0.654  0.316  1.0
  O  O13  1  0.019  0.335  0.673  1.0
  O  O14  1  0.662  0.335  0.316  1.0
  O  O15  1  0.338  0.654  0.673  1.0
[/CIF]
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