The structure described by Li7Ti11O24 crystallizes in the monoclinic Pm space group. There are five inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(12), one O(2), two equivalent O(5), and two equivalent O(9) atoms to form distorted LiO6 octahedra that share corners with four equivalent Ti(6)O6 octahedra, edges with two equivalent Ti(3)O6 octahedra, and edges with two equivalent Ti(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 51-55°. In the second Li site, Li(2) is bonded in a rectangular see-saw-like geometry to one O(13), one O(14), one O(15), and one O(3) atom. In the third Li site, Li(3) is bonded in a rectangular see-saw-like geometry to one O(16), one O(4), and two equivalent O(13) atoms. In the fourth Li site, Li(4) is bonded in a distorted rectangular see-saw-like geometry to one O(11), one O(12), one O(5), and one O(9) atom. In the fifth Li site, Li(5) is bonded in a rectangular see-saw-like geometry to one O(10), one O(6), and two equivalent O(11) atoms. There are seven inequivalent Ti sites. In the first Ti site, Ti(1) is bonded to one O(13), one O(15), one O(16), one O(3), one O(4), and one O(7) atom to form a mixture of corner and edge-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles range from 45-50°. In the second Ti site, Ti(2) is bonded to one O(14), one O(8), two equivalent O(15), and two equivalent O(3) atoms to form a mixture of corner and edge-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles range from 46-52°. In the third Ti site, Ti(3) is bonded to one O(1), one O(10), one O(11), one O(5), one O(6), and one O(9) atom to form distorted TiO6 octahedra that share corners with two equivalent Ti(6)O6 octahedra, corners with two equivalent Ti(7)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Ti(3)O6 octahedra,  an edgeedge with one Ti(4)O6 octahedra, and  an edgeedge with one Ti(5)O6 octahedra. The corner-sharing octahedral tilt angles range from 40-52°. In the fourth Ti site, Ti(4) is bonded to one O(11), one O(12), one O(15), one O(5), one O(7), and one O(8) atom to form TiO6 octahedra that share corners with two equivalent Ti(1)O6 octahedra, corners with two equivalent Ti(2)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Ti(3)O6 octahedra,  an edgeedge with one Ti(4)O6 octahedra, and  an edgeedge with one Ti(5)O6 octahedra. The corner-sharing octahedral tilt angles range from 46-52°. In the fifth Ti site, Ti(5) is bonded to one O(16), one O(6), two equivalent O(11), and two equivalent O(7) atoms to form a mixture of corner and edge-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles range from 45-49°. In the sixth Ti site, Ti(6) is bonded to one O(1), one O(13), one O(14), one O(2), one O(3), and one O(9) atom to form TiO6 octahedra that share corners with two equivalent Li(1)O6 octahedra, corners with two equivalent Ti(3)O6 octahedra,  an edgeedge with one Ti(1)O6 octahedra,  an edgeedge with one Ti(2)O6 octahedra,  an edgeedge with one Ti(6)O6 octahedra, and  an edgeedge with one Ti(7)O6 octahedra. The corner-sharing octahedral tilt angles range from 40-55°. In the seventh Ti site, Ti(7) is bonded to one O(10), one O(4), two equivalent O(1), and two equivalent O(13) atoms to form a mixture of corner and edge-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles range from 43-51°. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one Ti(3), one Ti(6), and one Ti(7) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one Li(1) and two equivalent Ti(6) atoms. In the third O site, O(3) is bonded to one Li(2), one Ti(1), one Ti(2), and one Ti(6) atom to form distorted OLiTi3 tetrahedra that share  a cornercorner with one O(13)Li2Ti3 square pyramid,  a cornercorner with one O(14)Li2Ti3 square pyramid,  a cornercorner with one O(3)LiTi3 tetrahedra,  a cornercorner with one O(4)LiTi3 tetrahedra,  a cornercorner with one O(16)LiTi3 trigonal pyramid,  an edgeedge with one O(13)Li2Ti3 square pyramid, and  an edgeedge with one O(14)Li2Ti3 square pyramid. In the fourth O site, O(4) is bonded to one Li(3), one Ti(7), and two equivalent Ti(1) atoms to form distorted OLiTi3 tetrahedra that share corners with two equivalent O(13)Li2Ti3 square pyramids, corners with two equivalent O(3)LiTi3 tetrahedra,  a cornercorner with one O(10)LiTi3 trigonal pyramid,  a cornercorner with one O(16)LiTi3 trigonal pyramid, edges with two equivalent O(13)Li2Ti3 square pyramids, and  an edgeedge with one O(16)LiTi3 trigonal pyramid. In the fifth O site, O(5) is bonded to one Li(1), one Li(4), one Ti(3), and one Ti(4) atom to form distorted OLi2Ti2 trigonal pyramids that share  a cornercorner with one O(11)Li2Ti3 square pyramid,  a cornercorner with one O(12)Li3Ti2 square pyramid,  a cornercorner with one O(6)LiTi3 tetrahedra,  a cornercorner with one O(5)Li2Ti2 trigonal pyramid,  a cornercorner with one O(10)LiTi3 trigonal pyramid,  an edgeedge with one O(11)Li2Ti3 square pyramid, and  an edgeedge with one O(12)Li3Ti2 square pyramid. In the sixth O site, O(6) is bonded to one Li(5), one Ti(5), and two equivalent Ti(3) atoms to form OLiTi3 tetrahedra that share corners with two equivalent O(11)Li2Ti3 square pyramids,  a cornercorner with one O(10)LiTi3 trigonal pyramid,  a cornercorner with one O(16)LiTi3 trigonal pyramid, corners with two equivalent O(5)Li2Ti2 trigonal pyramids, edges with two equivalent O(11)Li2Ti3 square pyramids, and  an edgeedge with one O(10)LiTi3 trigonal pyramid. In the seventh O site, O(7) is bonded in a distorted trigonal planar geometry to one Ti(1), one Ti(4), and one Ti(5) atom. In the eighth O site, O(8) is bonded in a distorted T-shaped geometry to one Ti(2) and two equivalent Ti(4) atoms. In the ninth O site, O(9) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(4), one Ti(3), and one Ti(6) atom. In the tenth O site, O(10) is bonded to one Li(5), one Ti(7), and two equivalent Ti(3) atoms to form OLiTi3 trigonal pyramids that share corners with two equivalent O(13)Li2Ti3 square pyramids,  a cornercorner with one O(4)LiTi3 tetrahedra,  a cornercorner with one O(6)LiTi3 tetrahedra, corners with two equivalent O(5)Li2Ti2 trigonal pyramids, edges with two equivalent O(11)Li2Ti3 square pyramids, and  an edgeedge with one O(6)LiTi3 tetrahedra. In the eleventh O site, O(11) is bonded to one Li(4), one Li(5), one Ti(3), one Ti(4), and one Ti(5) atom to form OLi2Ti3 square pyramids that share  a cornercorner with one O(6)LiTi3 tetrahedra,  a cornercorner with one O(5)Li2Ti2 trigonal pyramid,  a cornercorner with one O(16)LiTi3 trigonal pyramid,  an edgeedge with one O(11)Li2Ti3 square pyramid,  an edgeedge with one O(12)Li3Ti2 square pyramid,  an edgeedge with one O(6)LiTi3 tetrahedra,  an edgeedge with one O(5)Li2Ti2 trigonal pyramid, and  an edgeedge with one O(10)LiTi3 trigonal pyramid. In the twelfth O site, O(12) is bonded to one Li(1), two equivalent Li(4), and two equivalent Ti(4) atoms to form OLi3Ti2 square pyramids that share corners with two equivalent O(5)Li2Ti2 trigonal pyramids, edges with two equivalent O(11)Li2Ti3 square pyramids, and edges with two equivalent O(5)Li2Ti2 trigonal pyramids. In the thirteenth O site, O(13) is bonded to one Li(2), one Li(3), one Ti(1), one Ti(6), and one Ti(7) atom to form OLi2Ti3 square pyramids that share  a cornercorner with one O(3)LiTi3 tetrahedra,  a cornercorner with one O(4)LiTi3 tetrahedra,  a cornercorner with one O(10)LiTi3 trigonal pyramid,  an edgeedge with one O(13)Li2Ti3 square pyramid,  an edgeedge with one O(14)Li2Ti3 square pyramid,  an edgeedge with one O(3)LiTi3 tetrahedra,  an edgeedge with one O(4)LiTi3 tetrahedra, and  an edgeedge with one O(16)LiTi3 trigonal pyramid. In the fourteenth O site, O(14) is bonded to two equivalent Li(2), one Ti(2), and two equivalent Ti(6) atoms to form OLi2Ti3 square pyramids that share corners with two equivalent O(3)LiTi3 tetrahedra, edges with two equivalent O(13)Li2Ti3 square pyramids, and edges with two equivalent O(3)LiTi3 tetrahedra. In the fifteenth O site, O(15) is bonded in a rectangular see-saw-like geometry to one Li(2), one Ti(1), one Ti(2), and one Ti(4) atom. In the sixteenth O site, O(16) is bonded to one Li(3), one Ti(5), and two equivalent Ti(1) atoms to form OLiTi3 trigonal pyramids that share corners with two equivalent O(11)Li2Ti3 square pyramids,  a cornercorner with one O(4)LiTi3 tetrahedra,  a cornercorner with one O(6)LiTi3 tetrahedra, corners with two equivalent O(3)LiTi3 tetrahedra, edges with two equivalent O(13)Li2Ti3 square pyramids, and  an edgeedge with one O(4)LiTi3 tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li7Ti11O24
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.870
_cell_length_b   5.085
_cell_length_c   9.736
_cell_angle_alpha   89.691
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   439.114
_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
  Li  Li0  1  0.500  0.526  0.650  1.0
  Li  Li1  1  0.332  0.438  0.035  1.0
  Li  Li2  1  0.668  0.438  0.035  1.0
  Li  Li3  1  0.000  0.442  0.037  1.0
  Li  Li4  1  0.340  0.065  0.541  1.0
  Li  Li5  1  0.000  0.058  0.538  1.0
  Li  Li6  1  0.660  0.065  0.541  1.0
  Ti  Ti7  1  0.170  0.978  0.143  1.0
  Ti  Ti8  1  0.830  0.978  0.143  1.0
  Ti  Ti9  1  0.500  0.982  0.143  1.0
  Ti  Ti10  1  0.176  0.523  0.643  1.0
  Ti  Ti11  1  0.824  0.523  0.643  1.0
  Ti  Ti12  1  0.337  0.487  0.369  1.0
  Ti  Ti13  1  0.663  0.487  0.369  1.0
  Ti  Ti14  1  0.000  0.483  0.361  1.0
  Ti  Ti15  1  0.334  0.015  0.855  1.0
  Ti  Ti16  1  0.000  0.026  0.861  1.0
  Ti  Ti17  1  0.666  0.015  0.855  1.0
  O  O18  1  0.164  0.802  0.777  1.0
  O  O19  1  0.500  0.832  0.779  1.0
  O  O20  1  0.836  0.802  0.777  1.0
  O  O21  1  0.331  0.805  0.035  1.0
  O  O22  1  0.000  0.810  0.036  1.0
  O  O23  1  0.669  0.805  0.035  1.0
  O  O24  1  0.322  0.698  0.531  1.0
  O  O25  1  0.000  0.686  0.536  1.0
  O  O26  1  0.678  0.698  0.531  1.0
  O  O27  1  0.837  0.689  0.274  1.0
  O  O28  1  0.500  0.691  0.274  1.0
  O  O29  1  0.163  0.689  0.274  1.0
  O  O30  1  0.318  0.283  0.717  1.0
  O  O31  1  0.682  0.283  0.717  1.0
  O  O32  1  0.000  0.294  0.714  1.0
  O  O33  1  0.167  0.285  0.466  1.0
  O  O34  1  0.833  0.285  0.466  1.0
  O  O35  1  0.500  0.277  0.452  1.0
  O  O36  1  0.165  0.214  0.968  1.0
  O  O37  1  0.835  0.214  0.968  1.0
  O  O38  1  0.500  0.209  0.966  1.0
  O  O39  1  0.330  0.211  0.212  1.0
  O  O40  1  0.000  0.202  0.218  1.0
  O  O41  1  0.670  0.211  0.212  1.0
[/CIF]
.
The structure described by Li7Ti11O24 crystallizes in the monoclinic Pm space group. There are five inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(12), one O(2), two equivalent O(5), and two equivalent O(9) atoms to form distorted LiO6 octahedra that share corners with four equivalent Ti(6)O6 octahedra, edges with two equivalent Ti(3)O6 octahedra, and edges with two equivalent Ti(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 51-55°. In the second Li site, Li(2) is bonded in a rectangular see-saw-like geometry to one O(13), one O(14), one O(15), and one O(3) atom. In the third Li site, Li(3) is bonded in a rectangular see-saw-like geometry to one O(16), one O(4), and two equivalent O(13) atoms. In the fourth Li site, Li(4) is bonded in a distorted rectangular see-saw-like geometry to one O(11), one O(12), one O(5), and one O(9) atom. In the fifth Li site, Li(5) is bonded in a rectangular see-saw-like geometry to one O(10), one O(6), and two equivalent O(11) atoms. There are seven inequivalent Ti sites. In the first Ti site, Ti(1) is bonded to one O(13), one O(15), one O(16), one O(3), one O(4), and one O(7) atom to form a mixture of corner and edge-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles range from 45-50°. In the second Ti site, Ti(2) is bonded to one O(14), one O(8), two equivalent O(15), and two equivalent O(3) atoms to form a mixture of corner and edge-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles range from 46-52°. In the third Ti site, Ti(3) is bonded to one O(1), one O(10), one O(11), one O(5), one O(6), and one O(9) atom to form distorted TiO6 octahedra that share corners with two equivalent Ti(6)O6 octahedra, corners with two equivalent Ti(7)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Ti(3)O6 octahedra,  an edgeedge with one Ti(4)O6 octahedra, and  an edgeedge with one Ti(5)O6 octahedra. The corner-sharing octahedral tilt angles range from 40-52°. In the fourth Ti site, Ti(4) is bonded to one O(11), one O(12), one O(15), one O(5), one O(7), and one O(8) atom to form TiO6 octahedra that share corners with two equivalent Ti(1)O6 octahedra, corners with two equivalent Ti(2)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Ti(3)O6 octahedra,  an edgeedge with one Ti(4)O6 octahedra, and  an edgeedge with one Ti(5)O6 octahedra. The corner-sharing octahedral tilt angles range from 46-52°. In the fifth Ti site, Ti(5) is bonded to one O(16), one O(6), two equivalent O(11), and two equivalent O(7) atoms to form a mixture of corner and edge-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles range from 45-49°. In the sixth Ti site, Ti(6) is bonded to one O(1), one O(13), one O(14), one O(2), one O(3), and one O(9) atom to form TiO6 octahedra that share corners with two equivalent Li(1)O6 octahedra, corners with two equivalent Ti(3)O6 octahedra,  an edgeedge with one Ti(1)O6 octahedra,  an edgeedge with one Ti(2)O6 octahedra,  an edgeedge with one Ti(6)O6 octahedra, and  an edgeedge with one Ti(7)O6 octahedra. The corner-sharing octahedral tilt angles range from 40-55°. In the seventh Ti site, Ti(7) is bonded to one O(10), one O(4), two equivalent O(1), and two equivalent O(13) atoms to form a mixture of corner and edge-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles range from 43-51°. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one Ti(3), one Ti(6), and one Ti(7) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one Li(1) and two equivalent Ti(6) atoms. In the third O site, O(3) is bonded to one Li(2), one Ti(1), one Ti(2), and one Ti(6) atom to form distorted OLiTi3 tetrahedra that share  a cornercorner with one O(13)Li2Ti3 square pyramid,  a cornercorner with one O(14)Li2Ti3 square pyramid,  a cornercorner with one O(3)LiTi3 tetrahedra,  a cornercorner with one O(4)LiTi3 tetrahedra,  a cornercorner with one O(16)LiTi3 trigonal pyramid,  an edgeedge with one O(13)Li2Ti3 square pyramid, and  an edgeedge with one O(14)Li2Ti3 square pyramid. In the fourth O site, O(4) is bonded to one Li(3), one Ti(7), and two equivalent Ti(1) atoms to form distorted OLiTi3 tetrahedra that share corners with two equivalent O(13)Li2Ti3 square pyramids, corners with two equivalent O(3)LiTi3 tetrahedra,  a cornercorner with one O(10)LiTi3 trigonal pyramid,  a cornercorner with one O(16)LiTi3 trigonal pyramid, edges with two equivalent O(13)Li2Ti3 square pyramids, and  an edgeedge with one O(16)LiTi3 trigonal pyramid. In the fifth O site, O(5) is bonded to one Li(1), one Li(4), one Ti(3), and one Ti(4) atom to form distorted OLi2Ti2 trigonal pyramids that share  a cornercorner with one O(11)Li2Ti3 square pyramid,  a cornercorner with one O(12)Li3Ti2 square pyramid,  a cornercorner with one O(6)LiTi3 tetrahedra,  a cornercorner with one O(5)Li2Ti2 trigonal pyramid,  a cornercorner with one O(10)LiTi3 trigonal pyramid,  an edgeedge with one O(11)Li2Ti3 square pyramid, and  an edgeedge with one O(12)Li3Ti2 square pyramid. In the sixth O site, O(6) is bonded to one Li(5), one Ti(5), and two equivalent Ti(3) atoms to form OLiTi3 tetrahedra that share corners with two equivalent O(11)Li2Ti3 square pyramids,  a cornercorner with one O(10)LiTi3 trigonal pyramid,  a cornercorner with one O(16)LiTi3 trigonal pyramid, corners with two equivalent O(5)Li2Ti2 trigonal pyramids, edges with two equivalent O(11)Li2Ti3 square pyramids, and  an edgeedge with one O(10)LiTi3 trigonal pyramid. In the seventh O site, O(7) is bonded in a distorted trigonal planar geometry to one Ti(1), one Ti(4), and one Ti(5) atom. In the eighth O site, O(8) is bonded in a distorted T-shaped geometry to one Ti(2) and two equivalent Ti(4) atoms. In the ninth O site, O(9) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(4), one Ti(3), and one Ti(6) atom. In the tenth O site, O(10) is bonded to one Li(5), one Ti(7), and two equivalent Ti(3) atoms to form OLiTi3 trigonal pyramids that share corners with two equivalent O(13)Li2Ti3 square pyramids,  a cornercorner with one O(4)LiTi3 tetrahedra,  a cornercorner with one O(6)LiTi3 tetrahedra, corners with two equivalent O(5)Li2Ti2 trigonal pyramids, edges with two equivalent O(11)Li2Ti3 square pyramids, and  an edgeedge with one O(6)LiTi3 tetrahedra. In the eleventh O site, O(11) is bonded to one Li(4), one Li(5), one Ti(3), one Ti(4), and one Ti(5) atom to form OLi2Ti3 square pyramids that share  a cornercorner with one O(6)LiTi3 tetrahedra,  a cornercorner with one O(5)Li2Ti2 trigonal pyramid,  a cornercorner with one O(16)LiTi3 trigonal pyramid,  an edgeedge with one O(11)Li2Ti3 square pyramid,  an edgeedge with one O(12)Li3Ti2 square pyramid,  an edgeedge with one O(6)LiTi3 tetrahedra,  an edgeedge with one O(5)Li2Ti2 trigonal pyramid, and  an edgeedge with one O(10)LiTi3 trigonal pyramid. In the twelfth O site, O(12) is bonded to one Li(1), two equivalent Li(4), and two equivalent Ti(4) atoms to form OLi3Ti2 square pyramids that share corners with two equivalent O(5)Li2Ti2 trigonal pyramids, edges with two equivalent O(11)Li2Ti3 square pyramids, and edges with two equivalent O(5)Li2Ti2 trigonal pyramids. In the thirteenth O site, O(13) is bonded to one Li(2), one Li(3), one Ti(1), one Ti(6), and one Ti(7) atom to form OLi2Ti3 square pyramids that share  a cornercorner with one O(3)LiTi3 tetrahedra,  a cornercorner with one O(4)LiTi3 tetrahedra,  a cornercorner with one O(10)LiTi3 trigonal pyramid,  an edgeedge with one O(13)Li2Ti3 square pyramid,  an edgeedge with one O(14)Li2Ti3 square pyramid,  an edgeedge with one O(3)LiTi3 tetrahedra,  an edgeedge with one O(4)LiTi3 tetrahedra, and  an edgeedge with one O(16)LiTi3 trigonal pyramid. In the fourteenth O site, O(14) is bonded to two equivalent Li(2), one Ti(2), and two equivalent Ti(6) atoms to form OLi2Ti3 square pyramids that share corners with two equivalent O(3)LiTi3 tetrahedra, edges with two equivalent O(13)Li2Ti3 square pyramids, and edges with two equivalent O(3)LiTi3 tetrahedra. In the fifteenth O site, O(15) is bonded in a rectangular see-saw-like geometry to one Li(2), one Ti(1), one Ti(2), and one Ti(4) atom. In the sixteenth O site, O(16) is bonded to one Li(3), one Ti(5), and two equivalent Ti(1) atoms to form OLiTi3 trigonal pyramids that share corners with two equivalent O(11)Li2Ti3 square pyramids,  a cornercorner with one O(4)LiTi3 tetrahedra,  a cornercorner with one O(6)LiTi3 tetrahedra, corners with two equivalent O(3)LiTi3 tetrahedra, edges with two equivalent O(13)Li2Ti3 square pyramids, and  an edgeedge with one O(4)LiTi3 tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li7Ti11O24
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.870
_cell_length_b   5.085
_cell_length_c   9.736
_cell_angle_alpha   89.691
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   439.114
_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
  Li  Li0  1  0.500  0.526  0.650  1.0
  Li  Li1  1  0.332  0.438  0.035  1.0
  Li  Li2  1  0.668  0.438  0.035  1.0
  Li  Li3  1  0.000  0.442  0.037  1.0
  Li  Li4  1  0.340  0.065  0.541  1.0
  Li  Li5  1  0.000  0.058  0.538  1.0
  Li  Li6  1  0.660  0.065  0.541  1.0
  Ti  Ti7  1  0.170  0.978  0.143  1.0
  Ti  Ti8  1  0.830  0.978  0.143  1.0
  Ti  Ti9  1  0.500  0.982  0.143  1.0
  Ti  Ti10  1  0.176  0.523  0.643  1.0
  Ti  Ti11  1  0.824  0.523  0.643  1.0
  Ti  Ti12  1  0.337  0.487  0.369  1.0
  Ti  Ti13  1  0.663  0.487  0.369  1.0
  Ti  Ti14  1  0.000  0.483  0.361  1.0
  Ti  Ti15  1  0.334  0.015  0.855  1.0
  Ti  Ti16  1  0.000  0.026  0.861  1.0
  Ti  Ti17  1  0.666  0.015  0.855  1.0
  O  O18  1  0.164  0.802  0.777  1.0
  O  O19  1  0.500  0.832  0.779  1.0
  O  O20  1  0.836  0.802  0.777  1.0
  O  O21  1  0.331  0.805  0.035  1.0
  O  O22  1  0.000  0.810  0.036  1.0
  O  O23  1  0.669  0.805  0.035  1.0
  O  O24  1  0.322  0.698  0.531  1.0
  O  O25  1  0.000  0.686  0.536  1.0
  O  O26  1  0.678  0.698  0.531  1.0
  O  O27  1  0.837  0.689  0.274  1.0
  O  O28  1  0.500  0.691  0.274  1.0
  O  O29  1  0.163  0.689  0.274  1.0
  O  O30  1  0.318  0.283  0.717  1.0
  O  O31  1  0.682  0.283  0.717  1.0
  O  O32  1  0.000  0.294  0.714  1.0
  O  O33  1  0.167  0.285  0.466  1.0
  O  O34  1  0.833  0.285  0.466  1.0
  O  O35  1  0.500  0.277  0.452  1.0
  O  O36  1  0.165  0.214  0.968  1.0
  O  O37  1  0.835  0.214  0.968  1.0
  O  O38  1  0.500  0.209  0.966  1.0
  O  O39  1  0.330  0.211  0.212  1.0
  O  O40  1  0.000  0.202  0.218  1.0
  O  O41  1  0.670  0.211  0.212  1.0
[/CIF]
.