The material structure described by SbSeO5 crystallizes in the orthorhombic P2_12_12_1 space group. Sb(1) is bonded to one O(1), one O(2), one O(3), one O(4), and two equivalent O(5) atoms to form SbO6 octahedra that share corners with two equivalent Sb(1)O6 octahedra and corners with four equivalent Se(1)O4 tetrahedra. The corner-sharing octahedral tilt angles are 45°. Se(1) is bonded to one O(1), one O(2), one O(3), and one O(4) atom to form SeO4 tetrahedra that share corners with four equivalent Sb(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 37-53°. There are five inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to one Sb(1) and one Se(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Sb(1) and one Se(1) atom. In the third O site, O(3) is bonded in a distorted bent 120 degrees geometry to one Sb(1) and one Se(1) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one Sb(1) and one Se(1) atom. In the fifth O site, O(5) is bonded in a bent 150 degrees geometry to two equivalent Sb(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_SbSeO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.259
_cell_length_b   9.285
_cell_length_c   9.888
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   482.853
_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
  Sb  Sb0  1  0.621  0.340  0.596  1.0
  Sb  Sb1  1  0.121  0.160  0.404  1.0
  Sb  Sb2  1  0.879  0.660  0.096  1.0
  Sb  Sb3  1  0.379  0.840  0.904  1.0
  Se  Se4  1  0.895  0.023  0.710  1.0
  Se  Se5  1  0.395  0.477  0.290  1.0
  Se  Se6  1  0.605  0.977  0.210  1.0
  Se  Se7  1  0.105  0.523  0.790  1.0
  O  O8  1  0.317  0.394  0.747  1.0
  O  O9  1  0.221  0.693  0.759  1.0
  O  O10  1  0.834  0.516  0.698  1.0
  O  O11  1  0.955  0.004  0.540  1.0
  O  O12  1  0.416  0.179  0.526  1.0
  O  O13  1  0.916  0.321  0.474  1.0
  O  O14  1  0.455  0.496  0.460  1.0
  O  O15  1  0.334  0.984  0.302  1.0
  O  O16  1  0.721  0.807  0.241  1.0
  O  O17  1  0.817  0.106  0.253  1.0
  O  O18  1  0.183  0.606  0.247  1.0
  O  O19  1  0.279  0.307  0.259  1.0
  O  O20  1  0.666  0.484  0.198  1.0
  O  O21  1  0.545  0.996  0.040  1.0
  O  O22  1  0.084  0.821  0.026  1.0
  O  O23  1  0.584  0.679  0.974  1.0
  O  O24  1  0.045  0.504  0.960  1.0
  O  O25  1  0.166  0.016  0.802  1.0
  O  O26  1  0.779  0.193  0.741  1.0
  O  O27  1  0.683  0.894  0.753  1.0
[/CIF]
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The material structure described by SbSeO5 crystallizes in the orthorhombic P2_12_12_1 space group. Sb(1) is bonded to one O(1), one O(2), one O(3), one O(4), and two equivalent O(5) atoms to form SbO6 octahedra that share corners with two equivalent Sb(1)O6 octahedra and corners with four equivalent Se(1)O4 tetrahedra. The corner-sharing octahedral tilt angles are 45°. Se(1) is bonded to one O(1), one O(2), one O(3), and one O(4) atom to form SeO4 tetrahedra that share corners with four equivalent Sb(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 37-53°. There are five inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to one Sb(1) and one Se(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Sb(1) and one Se(1) atom. In the third O site, O(3) is bonded in a distorted bent 120 degrees geometry to one Sb(1) and one Se(1) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one Sb(1) and one Se(1) atom. In the fifth O site, O(5) is bonded in a bent 150 degrees geometry to two equivalent Sb(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_SbSeO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.259
_cell_length_b   9.285
_cell_length_c   9.888
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   482.853
_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
  Sb  Sb0  1  0.621  0.340  0.596  1.0
  Sb  Sb1  1  0.121  0.160  0.404  1.0
  Sb  Sb2  1  0.879  0.660  0.096  1.0
  Sb  Sb3  1  0.379  0.840  0.904  1.0
  Se  Se4  1  0.895  0.023  0.710  1.0
  Se  Se5  1  0.395  0.477  0.290  1.0
  Se  Se6  1  0.605  0.977  0.210  1.0
  Se  Se7  1  0.105  0.523  0.790  1.0
  O  O8  1  0.317  0.394  0.747  1.0
  O  O9  1  0.221  0.693  0.759  1.0
  O  O10  1  0.834  0.516  0.698  1.0
  O  O11  1  0.955  0.004  0.540  1.0
  O  O12  1  0.416  0.179  0.526  1.0
  O  O13  1  0.916  0.321  0.474  1.0
  O  O14  1  0.455  0.496  0.460  1.0
  O  O15  1  0.334  0.984  0.302  1.0
  O  O16  1  0.721  0.807  0.241  1.0
  O  O17  1  0.817  0.106  0.253  1.0
  O  O18  1  0.183  0.606  0.247  1.0
  O  O19  1  0.279  0.307  0.259  1.0
  O  O20  1  0.666  0.484  0.198  1.0
  O  O21  1  0.545  0.996  0.040  1.0
  O  O22  1  0.084  0.821  0.026  1.0
  O  O23  1  0.584  0.679  0.974  1.0
  O  O24  1  0.045  0.504  0.960  1.0
  O  O25  1  0.166  0.016  0.802  1.0
  O  O26  1  0.779  0.193  0.741  1.0
  O  O27  1  0.683  0.894  0.753  1.0
[/CIF]
.