The crystal structure described by Li4V3OF11 crystallizes in the triclinic P1 space group. There are eight inequivalent Li sites. In the first Li site, Li(1) is bonded to one F(16), one F(19), one F(3), and one F(8) atom to form distorted LiF4 tetrahedra that share  a cornercorner with one V(2)F6 octahedra,  a cornercorner with one V(3)F6 octahedra,  a cornercorner with one V(5)F6 octahedra, corners with two equivalent Li(5)F4 tetrahedra, and  an edgeedge with one V(6)F6 octahedra. The corner-sharing octahedral tilt angles range from 48-66°. In the second Li site, Li(2) is bonded to one F(17), one F(21), one F(6), and one F(7) atom to form distorted LiF4 tetrahedra that share  a cornercorner with one V(3)F6 octahedra, corners with two equivalent V(1)O2F4 octahedra, corners with two equivalent Li(6)F4 tetrahedra, and  an edgeedge with one V(4)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 47-70°. In the third Li site, Li(3) is bonded in a 5-coordinate geometry to one O(1), one O(2), one F(20), one F(4), and one F(9) atom. In the fourth Li site, Li(4) is bonded in a 4-coordinate geometry to one F(15), one F(2), one F(22), one F(4), and one F(9) atom. In the fifth Li site, Li(5) is bonded to one F(11), one F(16), one F(19), and one F(5) atom to form distorted LiF4 tetrahedra that share  a cornercorner with one V(3)F6 octahedra,  a cornercorner with one V(5)F6 octahedra,  a cornercorner with one V(6)F6 octahedra, corners with two equivalent Li(1)F4 tetrahedra, and  an edgeedge with one V(2)F6 octahedra. The corner-sharing octahedral tilt angles range from 50-66°. In the sixth Li site, Li(6) is bonded to one F(12), one F(17), one F(18), and one F(6) atom to form distorted LiF4 tetrahedra that share  a cornercorner with one V(6)F6 octahedra, corners with two equivalent V(4)O2F4 octahedra, corners with two equivalent Li(2)F4 tetrahedra, and  an edgeedge with one V(1)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 47-76°. In the seventh Li site, Li(7) is bonded in a 6-coordinate geometry to one O(1), one O(2), one F(12), one F(15), one F(20), and one F(9) atom. In the eighth Li site, Li(8) is bonded in a 6-coordinate geometry to one F(1), one F(10), one F(14), one F(17), one F(18), and one F(7) atom. There are six inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(2), one F(12), one F(21), one F(6), and one F(9) atom to form VO2F4 octahedra that share corners with four equivalent V(4)O2F4 octahedra, corners with two equivalent Li(2)F4 tetrahedra, and  an edgeedge with one Li(6)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 35-46°. In the second V site, V(2) is bonded to one F(11), one F(13), one F(19), one F(2), one F(22), and one F(4) atom to form VF6 octahedra that share corners with four equivalent V(5)F6 octahedra,  a cornercorner with one Li(1)F4 tetrahedra, and  an edgeedge with one Li(5)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 36-43°. In the third V site, V(3) is bonded to one F(1), one F(10), one F(14), one F(3), one F(5), and one F(7) atom to form VF6 octahedra that share corners with four equivalent V(6)F6 octahedra,  a cornercorner with one Li(1)F4 tetrahedra,  a cornercorner with one Li(2)F4 tetrahedra, and  a cornercorner with one Li(5)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 38-45°. In the fourth V site, V(4) is bonded to one O(1), one O(2), one F(12), one F(17), one F(20), and one F(21) atom to form VO2F4 octahedra that share corners with four equivalent V(1)O2F4 octahedra, corners with two equivalent Li(6)F4 tetrahedra, and  an edgeedge with one Li(2)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 35-46°. In the fifth V site, V(5) is bonded to one F(11), one F(13), one F(15), one F(2), one F(22), and one F(8) atom to form VF6 octahedra that share corners with four equivalent V(2)F6 octahedra,  a cornercorner with one Li(1)F4 tetrahedra, and  a cornercorner with one Li(5)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 36-43°. In the sixth V site, V(6) is bonded to one F(1), one F(10), one F(14), one F(16), one F(18), and one F(3) atom to form VF6 octahedra that share corners with four equivalent V(3)F6 octahedra,  a cornercorner with one Li(5)F4 tetrahedra,  a cornercorner with one Li(6)F4 tetrahedra, and  an edgeedge with one Li(1)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 38-45°. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted see-saw-like geometry to one Li(3), one Li(7), one V(1), and one V(4) atom. In the second O site, O(2) is bonded in a distorted see-saw-like geometry to one Li(3), one Li(7), one V(1), and one V(4) atom. There are twenty-two inequivalent F sites. In the first F site, F(1) is bonded in a trigonal planar geometry to one Li(8), one V(3), and one V(6) atom. In the second F site, F(2) is bonded in a 3-coordinate geometry to one Li(4), one V(2), and one V(5) atom. In the third F site, F(3) is bonded in a distorted trigonal non-coplanar geometry to one Li(1), one V(3), and one V(6) atom. In the fourth F site, F(4) is bonded in a distorted trigonal planar geometry to one Li(3), one Li(4), and one V(2) atom. In the fifth F site, F(5) is bonded in a bent 120 degrees geometry to one Li(5) and one V(3) atom. In the sixth F site, F(6) is bonded in a distorted trigonal non-coplanar geometry to one Li(2), one Li(6), and one V(1) atom. In the seventh F site, F(7) is bonded in a trigonal non-coplanar geometry to one Li(2), one Li(8), and one V(3) atom. In the eighth F site, F(8) is bonded in a bent 120 degrees geometry to one Li(1) and one V(5) atom. In the ninth F site, F(9) is bonded in a 4-coordinate geometry to one Li(3), one Li(4), one Li(7), and one V(1) atom. In the tenth F site, F(10) is bonded in a distorted bent 150 degrees geometry to one Li(8), one V(3), and one V(6) atom. In the eleventh F site, F(11) is bonded in a distorted trigonal non-coplanar geometry to one Li(5), one V(2), and one V(5) atom. In the twelfth F site, F(12) is bonded in a 3-coordinate geometry to one Li(6), one Li(7), one V(1), and one V(4) atom. In the thirteenth F site, F(13) is bonded in a bent 150 degrees geometry to one V(2) and one V(5) atom. In the fourteenth F site, F(14) is bonded in a distorted T-shaped geometry to one Li(8), one V(3), and one V(6) atom. In the fifteenth F site, F(15) is bonded in a T-shaped geometry to one Li(4), one Li(7), and one V(5) atom. In the sixteenth F site, F(16) is bonded in a distorted trigonal planar geometry to one Li(1), one Li(5), and one V(6) atom. In the seventeenth F site, F(17) is bonded in a distorted tetrahedral geometry to one Li(2), one Li(6), one Li(8), and one V(4) atom. In the eighteenth F site, F(18) is bonded in a trigonal non-coplanar geometry to one Li(6), one Li(8), and one V(6) atom. In the nineteenth F site, F(19) is bonded in a distorted trigonal planar geometry to one Li(1), one Li(5), and one V(2) atom. In the twentieth F site, F(20) is bonded in a distorted T-shaped geometry to one Li(3), one Li(7), and one V(4) atom. In the twenty-first F site, F(21) is bonded in a 3-coordinate geometry to one Li(2), one V(1), and one V(4) atom. In the twenty-second F site, F(22) is bonded in a trigonal planar geometry to one Li(4), one V(2), and one V(5) atom. is represented by the CIF file [CIF]
data_Li4V3OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.199
_cell_length_b   5.469
_cell_length_c   16.534
_cell_angle_alpha   79.690
_cell_angle_beta   89.619
_cell_angle_gamma   89.696
_symmetry_Int_Tables_number   1
_cell_volume   462.540
_cell_formula_units_Z   2
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  0.675  0.140  0.174  1.0
  Li  Li1  1  0.045  0.098  0.542  1.0
  Li  Li2  1  0.999  0.039  0.772  1.0
  Li  Li3  1  0.476  0.129  0.882  1.0
  Li  Li4  1  0.184  0.694  0.158  1.0
  Li  Li5  1  0.459  0.584  0.542  1.0
  Li  Li6  1  0.500  0.580  0.769  1.0
  Li  Li7  1  0.965  0.675  0.449  1.0
  V  V8  1  0.475  0.153  0.673  1.0
  V  V9  1  0.997  0.999  0.998  1.0
  V  V10  1  0.996  0.328  0.333  1.0
  V  V11  1  0.024  0.651  0.673  1.0
  V  V12  1  0.497  0.501  0.998  1.0
  V  V13  1  0.492  0.830  0.334  1.0
  O  O14  1  0.200  0.353  0.706  1.0
  O  O15  1  0.302  0.855  0.702  1.0
  F  F16  1  0.168  0.991  0.367  1.0
  F  F17  1  0.316  0.163  0.023  1.0
  F  F18  1  0.685  0.160  0.299  1.0
  F  F19  1  0.125  0.023  0.887  1.0
  F  F20  1  0.096  0.379  0.219  1.0
  F  F21  1  0.364  0.239  0.554  1.0
  F  F22  1  0.905  0.313  0.448  1.0
  F  F23  1  0.595  0.454  0.111  1.0
  F  F24  1  0.646  0.161  0.783  1.0
  F  F25  1  0.302  0.506  0.362  1.0
  F  F26  1  0.189  0.672  0.032  1.0
  F  F27  1  0.688  0.490  0.635  1.0
  F  F28  1  0.811  0.323  0.973  1.0
  F  F29  1  0.820  0.661  0.311  1.0
  F  F30  1  0.409  0.495  0.886  1.0
  F  F31  1  0.408  0.879  0.216  1.0
  F  F32  1  0.123  0.731  0.547  1.0
  F  F33  1  0.616  0.779  0.448  1.0
  F  F34  1  0.906  0.954  0.113  1.0
  F  F35  1  0.849  0.681  0.777  1.0
  F  F36  1  0.815  0.994  0.633  1.0
  F  F37  1  0.678  0.841  0.966  1.0
[/CIF]
.
The crystal structure described by Li4V3OF11 crystallizes in the triclinic P1 space group. There are eight inequivalent Li sites. In the first Li site, Li(1) is bonded to one F(16), one F(19), one F(3), and one F(8) atom to form distorted LiF4 tetrahedra that share  a cornercorner with one V(2)F6 octahedra,  a cornercorner with one V(3)F6 octahedra,  a cornercorner with one V(5)F6 octahedra, corners with two equivalent Li(5)F4 tetrahedra, and  an edgeedge with one V(6)F6 octahedra. The corner-sharing octahedral tilt angles range from 48-66°. In the second Li site, Li(2) is bonded to one F(17), one F(21), one F(6), and one F(7) atom to form distorted LiF4 tetrahedra that share  a cornercorner with one V(3)F6 octahedra, corners with two equivalent V(1)O2F4 octahedra, corners with two equivalent Li(6)F4 tetrahedra, and  an edgeedge with one V(4)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 47-70°. In the third Li site, Li(3) is bonded in a 5-coordinate geometry to one O(1), one O(2), one F(20), one F(4), and one F(9) atom. In the fourth Li site, Li(4) is bonded in a 4-coordinate geometry to one F(15), one F(2), one F(22), one F(4), and one F(9) atom. In the fifth Li site, Li(5) is bonded to one F(11), one F(16), one F(19), and one F(5) atom to form distorted LiF4 tetrahedra that share  a cornercorner with one V(3)F6 octahedra,  a cornercorner with one V(5)F6 octahedra,  a cornercorner with one V(6)F6 octahedra, corners with two equivalent Li(1)F4 tetrahedra, and  an edgeedge with one V(2)F6 octahedra. The corner-sharing octahedral tilt angles range from 50-66°. In the sixth Li site, Li(6) is bonded to one F(12), one F(17), one F(18), and one F(6) atom to form distorted LiF4 tetrahedra that share  a cornercorner with one V(6)F6 octahedra, corners with two equivalent V(4)O2F4 octahedra, corners with two equivalent Li(2)F4 tetrahedra, and  an edgeedge with one V(1)O2F4 octahedra. The corner-sharing octahedral tilt angles range from 47-76°. In the seventh Li site, Li(7) is bonded in a 6-coordinate geometry to one O(1), one O(2), one F(12), one F(15), one F(20), and one F(9) atom. In the eighth Li site, Li(8) is bonded in a 6-coordinate geometry to one F(1), one F(10), one F(14), one F(17), one F(18), and one F(7) atom. There are six inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(2), one F(12), one F(21), one F(6), and one F(9) atom to form VO2F4 octahedra that share corners with four equivalent V(4)O2F4 octahedra, corners with two equivalent Li(2)F4 tetrahedra, and  an edgeedge with one Li(6)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 35-46°. In the second V site, V(2) is bonded to one F(11), one F(13), one F(19), one F(2), one F(22), and one F(4) atom to form VF6 octahedra that share corners with four equivalent V(5)F6 octahedra,  a cornercorner with one Li(1)F4 tetrahedra, and  an edgeedge with one Li(5)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 36-43°. In the third V site, V(3) is bonded to one F(1), one F(10), one F(14), one F(3), one F(5), and one F(7) atom to form VF6 octahedra that share corners with four equivalent V(6)F6 octahedra,  a cornercorner with one Li(1)F4 tetrahedra,  a cornercorner with one Li(2)F4 tetrahedra, and  a cornercorner with one Li(5)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 38-45°. In the fourth V site, V(4) is bonded to one O(1), one O(2), one F(12), one F(17), one F(20), and one F(21) atom to form VO2F4 octahedra that share corners with four equivalent V(1)O2F4 octahedra, corners with two equivalent Li(6)F4 tetrahedra, and  an edgeedge with one Li(2)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 35-46°. In the fifth V site, V(5) is bonded to one F(11), one F(13), one F(15), one F(2), one F(22), and one F(8) atom to form VF6 octahedra that share corners with four equivalent V(2)F6 octahedra,  a cornercorner with one Li(1)F4 tetrahedra, and  a cornercorner with one Li(5)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 36-43°. In the sixth V site, V(6) is bonded to one F(1), one F(10), one F(14), one F(16), one F(18), and one F(3) atom to form VF6 octahedra that share corners with four equivalent V(3)F6 octahedra,  a cornercorner with one Li(5)F4 tetrahedra,  a cornercorner with one Li(6)F4 tetrahedra, and  an edgeedge with one Li(1)F4 tetrahedra. The corner-sharing octahedral tilt angles range from 38-45°. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted see-saw-like geometry to one Li(3), one Li(7), one V(1), and one V(4) atom. In the second O site, O(2) is bonded in a distorted see-saw-like geometry to one Li(3), one Li(7), one V(1), and one V(4) atom. There are twenty-two inequivalent F sites. In the first F site, F(1) is bonded in a trigonal planar geometry to one Li(8), one V(3), and one V(6) atom. In the second F site, F(2) is bonded in a 3-coordinate geometry to one Li(4), one V(2), and one V(5) atom. In the third F site, F(3) is bonded in a distorted trigonal non-coplanar geometry to one Li(1), one V(3), and one V(6) atom. In the fourth F site, F(4) is bonded in a distorted trigonal planar geometry to one Li(3), one Li(4), and one V(2) atom. In the fifth F site, F(5) is bonded in a bent 120 degrees geometry to one Li(5) and one V(3) atom. In the sixth F site, F(6) is bonded in a distorted trigonal non-coplanar geometry to one Li(2), one Li(6), and one V(1) atom. In the seventh F site, F(7) is bonded in a trigonal non-coplanar geometry to one Li(2), one Li(8), and one V(3) atom. In the eighth F site, F(8) is bonded in a bent 120 degrees geometry to one Li(1) and one V(5) atom. In the ninth F site, F(9) is bonded in a 4-coordinate geometry to one Li(3), one Li(4), one Li(7), and one V(1) atom. In the tenth F site, F(10) is bonded in a distorted bent 150 degrees geometry to one Li(8), one V(3), and one V(6) atom. In the eleventh F site, F(11) is bonded in a distorted trigonal non-coplanar geometry to one Li(5), one V(2), and one V(5) atom. In the twelfth F site, F(12) is bonded in a 3-coordinate geometry to one Li(6), one Li(7), one V(1), and one V(4) atom. In the thirteenth F site, F(13) is bonded in a bent 150 degrees geometry to one V(2) and one V(5) atom. In the fourteenth F site, F(14) is bonded in a distorted T-shaped geometry to one Li(8), one V(3), and one V(6) atom. In the fifteenth F site, F(15) is bonded in a T-shaped geometry to one Li(4), one Li(7), and one V(5) atom. In the sixteenth F site, F(16) is bonded in a distorted trigonal planar geometry to one Li(1), one Li(5), and one V(6) atom. In the seventeenth F site, F(17) is bonded in a distorted tetrahedral geometry to one Li(2), one Li(6), one Li(8), and one V(4) atom. In the eighteenth F site, F(18) is bonded in a trigonal non-coplanar geometry to one Li(6), one Li(8), and one V(6) atom. In the nineteenth F site, F(19) is bonded in a distorted trigonal planar geometry to one Li(1), one Li(5), and one V(2) atom. In the twentieth F site, F(20) is bonded in a distorted T-shaped geometry to one Li(3), one Li(7), and one V(4) atom. In the twenty-first F site, F(21) is bonded in a 3-coordinate geometry to one Li(2), one V(1), and one V(4) atom. In the twenty-second F site, F(22) is bonded in a trigonal planar geometry to one Li(4), one V(2), and one V(5) atom. is represented by the CIF file [CIF]
data_Li4V3OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.199
_cell_length_b   5.469
_cell_length_c   16.534
_cell_angle_alpha   79.690
_cell_angle_beta   89.619
_cell_angle_gamma   89.696
_symmetry_Int_Tables_number   1
_cell_volume   462.540
_cell_formula_units_Z   2
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  0.675  0.140  0.174  1.0
  Li  Li1  1  0.045  0.098  0.542  1.0
  Li  Li2  1  0.999  0.039  0.772  1.0
  Li  Li3  1  0.476  0.129  0.882  1.0
  Li  Li4  1  0.184  0.694  0.158  1.0
  Li  Li5  1  0.459  0.584  0.542  1.0
  Li  Li6  1  0.500  0.580  0.769  1.0
  Li  Li7  1  0.965  0.675  0.449  1.0
  V  V8  1  0.475  0.153  0.673  1.0
  V  V9  1  0.997  0.999  0.998  1.0
  V  V10  1  0.996  0.328  0.333  1.0
  V  V11  1  0.024  0.651  0.673  1.0
  V  V12  1  0.497  0.501  0.998  1.0
  V  V13  1  0.492  0.830  0.334  1.0
  O  O14  1  0.200  0.353  0.706  1.0
  O  O15  1  0.302  0.855  0.702  1.0
  F  F16  1  0.168  0.991  0.367  1.0
  F  F17  1  0.316  0.163  0.023  1.0
  F  F18  1  0.685  0.160  0.299  1.0
  F  F19  1  0.125  0.023  0.887  1.0
  F  F20  1  0.096  0.379  0.219  1.0
  F  F21  1  0.364  0.239  0.554  1.0
  F  F22  1  0.905  0.313  0.448  1.0
  F  F23  1  0.595  0.454  0.111  1.0
  F  F24  1  0.646  0.161  0.783  1.0
  F  F25  1  0.302  0.506  0.362  1.0
  F  F26  1  0.189  0.672  0.032  1.0
  F  F27  1  0.688  0.490  0.635  1.0
  F  F28  1  0.811  0.323  0.973  1.0
  F  F29  1  0.820  0.661  0.311  1.0
  F  F30  1  0.409  0.495  0.886  1.0
  F  F31  1  0.408  0.879  0.216  1.0
  F  F32  1  0.123  0.731  0.547  1.0
  F  F33  1  0.616  0.779  0.448  1.0
  F  F34  1  0.906  0.954  0.113  1.0
  F  F35  1  0.849  0.681  0.777  1.0
  F  F36  1  0.815  0.994  0.633  1.0
  F  F37  1  0.678  0.841  0.966  1.0
[/CIF]
.