The compound described by LiTi2Mn3O10 crystallizes in the triclinic P1 space group. Li(1) is bonded in a 5-coordinate geometry to one O(3), one O(5), one O(6), one O(7), and one O(8) atom. There are two inequivalent Ti sites. In the first Ti site, Ti(1) is bonded to one O(1), one O(2), one O(3), one O(5), one O(7), and one O(8) atom to form distorted TiO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra,  an edgeedge with one Ti(2)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(3)O6 octahedra, and edges with two equivalent Mn(2)O6 octahedra. The corner-sharing octahedral tilt angles are 18°. In the second Ti site, Ti(2) is bonded to one O(10), one O(3), one O(4), one O(6), one O(8), and one O(9) atom to form distorted TiO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra,  an edgeedge with one Ti(1)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, and edges with two equivalent Mn(3)O6 octahedra. The corner-sharing octahedral tilt angles are 15°. There are three inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(1), one O(10), one O(2), one O(4), one O(7), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Ti(1)O6 octahedra,  a cornercorner with one Ti(2)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one Mn(3)O6 octahedra,  an edgeedge with one Ti(1)O6 octahedra,  an edgeedge with one Ti(2)O6 octahedra, edges with two equivalent Mn(2)O6 octahedra, and edges with two equivalent Mn(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 9-18°. In the second Mn site, Mn(2) is bonded to one O(1), one O(10), one O(2), one O(5), one O(7), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra,  an edgeedge with one Ti(2)O6 octahedra, edges with two equivalent Ti(1)O6 octahedra, edges with two equivalent Mn(1)O6 octahedra, and edges with two equivalent Mn(3)O6 octahedra. The corner-sharing octahedral tilt angles are 10°. In the third Mn site, Mn(3) is bonded to one O(1), one O(10), one O(2), one O(4), one O(6), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra,  an edgeedge with one Ti(1)O6 octahedra, edges with two equivalent Ti(2)O6 octahedra, edges with two equivalent Mn(1)O6 octahedra, and edges with two equivalent Mn(2)O6 octahedra. The corner-sharing octahedral tilt angles are 9°. There are ten inequivalent O sites. In the first O site, O(1) is bonded in a rectangular see-saw-like geometry to one Ti(1), one Mn(1), one Mn(2), and one Mn(3) atom. In the second O site, O(2) is bonded in a rectangular see-saw-like geometry to one Ti(1), one Mn(1), one Mn(2), and one Mn(3) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Li(1), one Ti(1), and one Ti(2) atom. In the fourth O site, O(4) is bonded in a trigonal non-coplanar geometry to one Ti(2), one Mn(1), and one Mn(3) atom. In the fifth O site, O(5) is bonded in a trigonal planar geometry to one Li(1), one Ti(1), and one Mn(2) atom. In the sixth O site, O(6) is bonded in a distorted T-shaped geometry to one Li(1), one Ti(2), and one Mn(3) atom. In the seventh O site, O(7) is bonded in a distorted tetrahedral geometry to one Li(1), one Ti(1), one Mn(1), and one Mn(2) atom. In the eighth O site, O(8) is bonded in a distorted T-shaped geometry to one Li(1), one Ti(1), and one Ti(2) atom. In the ninth O site, O(9) is bonded in a see-saw-like geometry to one Ti(2), one Mn(1), one Mn(2), and one Mn(3) atom. In the tenth O site, O(10) is bonded in a distorted see-saw-like geometry to one Ti(2), one Mn(1), one Mn(2), and one Mn(3) atom. is represented by the CIF file [CIF]
data_LiTi2Mn3O10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.021
_cell_length_b   5.085
_cell_length_c   7.926
_cell_angle_alpha   74.941
_cell_angle_beta   73.607
_cell_angle_gamma   81.994
_symmetry_Int_Tables_number   1
_cell_volume   187.034
_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  0.676  0.501  0.456  1.0
  Ti  Ti1  1  0.124  0.986  0.317  1.0
  Ti  Ti2  1  0.893  0.992  0.674  1.0
  Mn  Mn3  1  0.010  0.502  0.997  1.0
  Mn  Mn4  1  0.705  0.017  0.094  1.0
  Mn  Mn5  1  0.312  0.994  0.896  1.0
  O  O6  1  0.045  0.786  0.122  1.0
  O  O7  1  0.364  0.211  0.053  1.0
  O  O8  1  0.092  0.218  0.469  1.0
  O  O9  1  0.196  0.757  0.784  1.0
  O  O10  1  0.478  0.817  0.306  1.0
  O  O11  1  0.548  0.182  0.685  1.0
  O  O12  1  0.819  0.251  0.211  1.0
  O  O13  1  0.901  0.769  0.519  1.0
  O  O14  1  0.651  0.794  0.941  1.0
  O  O15  1  0.969  0.221  0.873  1.0
[/CIF]
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The compound described by LiTi2Mn3O10 crystallizes in the triclinic P1 space group. Li(1) is bonded in a 5-coordinate geometry to one O(3), one O(5), one O(6), one O(7), and one O(8) atom. There are two inequivalent Ti sites. In the first Ti site, Ti(1) is bonded to one O(1), one O(2), one O(3), one O(5), one O(7), and one O(8) atom to form distorted TiO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra,  an edgeedge with one Ti(2)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(3)O6 octahedra, and edges with two equivalent Mn(2)O6 octahedra. The corner-sharing octahedral tilt angles are 18°. In the second Ti site, Ti(2) is bonded to one O(10), one O(3), one O(4), one O(6), one O(8), and one O(9) atom to form distorted TiO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra,  an edgeedge with one Ti(1)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, and edges with two equivalent Mn(3)O6 octahedra. The corner-sharing octahedral tilt angles are 15°. There are three inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(1), one O(10), one O(2), one O(4), one O(7), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Ti(1)O6 octahedra,  a cornercorner with one Ti(2)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  a cornercorner with one Mn(3)O6 octahedra,  an edgeedge with one Ti(1)O6 octahedra,  an edgeedge with one Ti(2)O6 octahedra, edges with two equivalent Mn(2)O6 octahedra, and edges with two equivalent Mn(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 9-18°. In the second Mn site, Mn(2) is bonded to one O(1), one O(10), one O(2), one O(5), one O(7), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra,  an edgeedge with one Ti(2)O6 octahedra, edges with two equivalent Ti(1)O6 octahedra, edges with two equivalent Mn(1)O6 octahedra, and edges with two equivalent Mn(3)O6 octahedra. The corner-sharing octahedral tilt angles are 10°. In the third Mn site, Mn(3) is bonded to one O(1), one O(10), one O(2), one O(4), one O(6), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra,  an edgeedge with one Ti(1)O6 octahedra, edges with two equivalent Ti(2)O6 octahedra, edges with two equivalent Mn(1)O6 octahedra, and edges with two equivalent Mn(2)O6 octahedra. The corner-sharing octahedral tilt angles are 9°. There are ten inequivalent O sites. In the first O site, O(1) is bonded in a rectangular see-saw-like geometry to one Ti(1), one Mn(1), one Mn(2), and one Mn(3) atom. In the second O site, O(2) is bonded in a rectangular see-saw-like geometry to one Ti(1), one Mn(1), one Mn(2), and one Mn(3) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Li(1), one Ti(1), and one Ti(2) atom. In the fourth O site, O(4) is bonded in a trigonal non-coplanar geometry to one Ti(2), one Mn(1), and one Mn(3) atom. In the fifth O site, O(5) is bonded in a trigonal planar geometry to one Li(1), one Ti(1), and one Mn(2) atom. In the sixth O site, O(6) is bonded in a distorted T-shaped geometry to one Li(1), one Ti(2), and one Mn(3) atom. In the seventh O site, O(7) is bonded in a distorted tetrahedral geometry to one Li(1), one Ti(1), one Mn(1), and one Mn(2) atom. In the eighth O site, O(8) is bonded in a distorted T-shaped geometry to one Li(1), one Ti(1), and one Ti(2) atom. In the ninth O site, O(9) is bonded in a see-saw-like geometry to one Ti(2), one Mn(1), one Mn(2), and one Mn(3) atom. In the tenth O site, O(10) is bonded in a distorted see-saw-like geometry to one Ti(2), one Mn(1), one Mn(2), and one Mn(3) atom. is represented by the CIF file [CIF]
data_LiTi2Mn3O10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.021
_cell_length_b   5.085
_cell_length_c   7.926
_cell_angle_alpha   74.941
_cell_angle_beta   73.607
_cell_angle_gamma   81.994
_symmetry_Int_Tables_number   1
_cell_volume   187.034
_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  0.676  0.501  0.456  1.0
  Ti  Ti1  1  0.124  0.986  0.317  1.0
  Ti  Ti2  1  0.893  0.992  0.674  1.0
  Mn  Mn3  1  0.010  0.502  0.997  1.0
  Mn  Mn4  1  0.705  0.017  0.094  1.0
  Mn  Mn5  1  0.312  0.994  0.896  1.0
  O  O6  1  0.045  0.786  0.122  1.0
  O  O7  1  0.364  0.211  0.053  1.0
  O  O8  1  0.092  0.218  0.469  1.0
  O  O9  1  0.196  0.757  0.784  1.0
  O  O10  1  0.478  0.817  0.306  1.0
  O  O11  1  0.548  0.182  0.685  1.0
  O  O12  1  0.819  0.251  0.211  1.0
  O  O13  1  0.901  0.769  0.519  1.0
  O  O14  1  0.651  0.794  0.941  1.0
  O  O15  1  0.969  0.221  0.873  1.0
[/CIF]
.