The compound described by La2LiFeO6 crystallizes in the trigonal R-3 space group. Li(1) is bonded to six equivalent O(1) atoms to form LiO6 octahedra that share corners with six equivalent Fe(1)O6 octahedra. The corner-sharing octahedral tilt angles are 16°. La(1) is bonded in a 12-coordinate geometry to twelve equivalent O(1) atoms. Fe(1) is bonded to six equivalent O(1) atoms to form FeO6 octahedra that share corners with six equivalent Li(1)O6 octahedra. The corner-sharing octahedral tilt angles are 16°. O(1) is bonded in a 2-coordinate geometry to one Li(1), four equivalent La(1), and one Fe(1) atom. is represented by the CIF file [CIF]
data_LiLa2FeO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.368
_cell_length_b   5.369
_cell_length_c   5.370
_cell_angle_alpha   60.982
_cell_angle_beta   60.975
_cell_angle_gamma   60.983
_symmetry_Int_Tables_number   1
_cell_volume   111.844
_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
  Fe  Fe0  1  1.000  1.000  0.000  1.0
  La  La1  1  0.250  0.250  0.250  1.0
  La  La2  1  0.750  0.750  0.750  1.0
  Li  Li3  1  0.500  0.500  0.500  1.0
  O  O4  1  0.811  0.234  0.712  1.0
  O  O5  1  0.713  0.811  0.235  1.0
  O  O6  1  0.235  0.712  0.811  1.0
  O  O7  1  0.189  0.766  0.288  1.0
  O  O8  1  0.287  0.189  0.765  1.0
  O  O9  1  0.765  0.288  0.189  1.0
[/CIF]
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The compound described by La2LiFeO6 crystallizes in the trigonal R-3 space group. Li(1) is bonded to six equivalent O(1) atoms to form LiO6 octahedra that share corners with six equivalent Fe(1)O6 octahedra. The corner-sharing octahedral tilt angles are 16°. La(1) is bonded in a 12-coordinate geometry to twelve equivalent O(1) atoms. Fe(1) is bonded to six equivalent O(1) atoms to form FeO6 octahedra that share corners with six equivalent Li(1)O6 octahedra. The corner-sharing octahedral tilt angles are 16°. O(1) is bonded in a 2-coordinate geometry to one Li(1), four equivalent La(1), and one Fe(1) atom. is represented by the CIF file [CIF]
data_LiLa2FeO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.368
_cell_length_b   5.369
_cell_length_c   5.370
_cell_angle_alpha   60.982
_cell_angle_beta   60.975
_cell_angle_gamma   60.983
_symmetry_Int_Tables_number   1
_cell_volume   111.844
_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
  Fe  Fe0  1  1.000  1.000  0.000  1.0
  La  La1  1  0.250  0.250  0.250  1.0
  La  La2  1  0.750  0.750  0.750  1.0
  Li  Li3  1  0.500  0.500  0.500  1.0
  O  O4  1  0.811  0.234  0.712  1.0
  O  O5  1  0.713  0.811  0.235  1.0
  O  O6  1  0.235  0.712  0.811  1.0
  O  O7  1  0.189  0.766  0.288  1.0
  O  O8  1  0.287  0.189  0.765  1.0
  O  O9  1  0.765  0.288  0.189  1.0
[/CIF]
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