The material structure described by SrZrTiO6Sn crystallizes in the cubic F-43m space group. The structure consists of four 7440-31-5 atoms inside a SrZrTiO6 framework. In the SrZrTiO6 framework, Sr(1) is bonded to twelve equivalent O(1) atoms to form SrO12 cuboctahedra that share corners with twelve equivalent Sr(1)O12 cuboctahedra, faces with four equivalent Zr(1)O6 octahedra, and faces with four equivalent Ti(1)O6 octahedra. Zr(1) is bonded to six equivalent O(1) atoms to form ZrO6 octahedra that share corners with six equivalent Ti(1)O6 octahedra and faces with four equivalent Sr(1)O12 cuboctahedra. The corner-sharing octahedra are not tilted. Ti(1) is bonded to six equivalent O(1) atoms to form TiO6 octahedra that share corners with six equivalent Zr(1)O6 octahedra and faces with four equivalent Sr(1)O12 cuboctahedra. The corner-sharing octahedra are not tilted. O(1) is bonded in a distorted linear geometry to two equivalent Sr(1), one Zr(1), and one Ti(1) atom. is represented by the CIF card [CIF]
data_SrZrTiSnO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.754
_cell_length_b   5.754
_cell_length_c   5.754
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   134.721
_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
  Sr  Sr0  1  0.250  0.250  0.250  1.0
  Zr  Zr1  1  0.500  0.500  0.500  1.0
  Ti  Ti2  1  0.000  0.000  0.000  1.0
  Sn  Sn3  1  0.750  0.750  0.750  1.0
  O  O4  1  0.758  0.242  0.242  1.0
  O  O5  1  0.242  0.758  0.758  1.0
  O  O6  1  0.758  0.242  0.758  1.0
  O  O7  1  0.242  0.758  0.242  1.0
  O  O8  1  0.758  0.758  0.242  1.0
  O  O9  1  0.242  0.242  0.758  1.0
[/CIF]
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The material structure described by SrZrTiO6Sn crystallizes in the cubic F-43m space group. The structure consists of four 7440-31-5 atoms inside a SrZrTiO6 framework. In the SrZrTiO6 framework, Sr(1) is bonded to twelve equivalent O(1) atoms to form SrO12 cuboctahedra that share corners with twelve equivalent Sr(1)O12 cuboctahedra, faces with four equivalent Zr(1)O6 octahedra, and faces with four equivalent Ti(1)O6 octahedra. Zr(1) is bonded to six equivalent O(1) atoms to form ZrO6 octahedra that share corners with six equivalent Ti(1)O6 octahedra and faces with four equivalent Sr(1)O12 cuboctahedra. The corner-sharing octahedra are not tilted. Ti(1) is bonded to six equivalent O(1) atoms to form TiO6 octahedra that share corners with six equivalent Zr(1)O6 octahedra and faces with four equivalent Sr(1)O12 cuboctahedra. The corner-sharing octahedra are not tilted. O(1) is bonded in a distorted linear geometry to two equivalent Sr(1), one Zr(1), and one Ti(1) atom. is represented by the CIF card [CIF]
data_SrZrTiSnO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.754
_cell_length_b   5.754
_cell_length_c   5.754
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   134.721
_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
  Sr  Sr0  1  0.250  0.250  0.250  1.0
  Zr  Zr1  1  0.500  0.500  0.500  1.0
  Ti  Ti2  1  0.000  0.000  0.000  1.0
  Sn  Sn3  1  0.750  0.750  0.750  1.0
  O  O4  1  0.758  0.242  0.242  1.0
  O  O5  1  0.242  0.758  0.758  1.0
  O  O6  1  0.758  0.242  0.758  1.0
  O  O7  1  0.242  0.758  0.242  1.0
  O  O8  1  0.758  0.758  0.242  1.0
  O  O9  1  0.242  0.242  0.758  1.0
[/CIF]
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