The crystal structure described by Li7VO5F crystallizes in the triclinic P-1 space group. There are seven inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(3), two equivalent O(1), and one F(1) atom to form distorted LiO3F tetrahedra that share  a cornercorner with one Li(5)O3F tetrahedra,  a cornercorner with one Li(7)O4 tetrahedra,  a cornercorner with one V(1)O5 trigonal bipyramid,  an edgeedge with one Li(1)O3F tetrahedra, and  an edgeedge with one V(1)O5 trigonal bipyramid. In the second Li site, Li(2) is bonded to one O(4), one O(5), and two equivalent O(2) atoms to form LiO4 tetrahedra that share corners with two equivalent Li(5)O3F tetrahedra, corners with two equivalent Li(7)O4 tetrahedra, corners with two equivalent V(1)O5 trigonal bipyramids,  an edgeedge with one Li(5)O3F tetrahedra,  an edgeedge with one Li(2)O4 tetrahedra,  an edgeedge with one Li(7)O4 tetrahedra, and  an edgeedge with one V(1)O5 trigonal bipyramid. In the third Li site, Li(3) is bonded in a 4-coordinate geometry to one O(4), two equivalent O(1), and one F(1) atom. In the fourth Li site, Li(4) is bonded in a distorted rectangular see-saw-like geometry to one O(1), one O(3), one O(5), and one F(1) atom. In the fifth Li site, Li(5) is bonded to one O(2), one O(4), one O(5), and one F(1) atom to form distorted LiO3F tetrahedra that share  a cornercorner with one Li(1)O3F tetrahedra,  a cornercorner with one Li(7)O4 tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with three equivalent V(1)O5 trigonal bipyramids,  an edgeedge with one Li(2)O4 tetrahedra, and  an edgeedge with one Li(7)O4 tetrahedra. In the sixth Li site, Li(6) is bonded in a 4-coordinate geometry to one O(2), one O(3), one O(4), and two equivalent O(5) atoms. In the seventh Li site, Li(7) is bonded to one O(2), one O(3), one O(4), and one O(5) atom to form LiO4 tetrahedra that share  a cornercorner with one Li(1)O3F tetrahedra,  a cornercorner with one Li(5)O3F tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent V(1)O5 trigonal bipyramids,  an edgeedge with one Li(5)O3F tetrahedra,  an edgeedge with one Li(2)O4 tetrahedra, and  an edgeedge with one V(1)O5 trigonal bipyramid. V(1) is bonded to one O(1), one O(2), one O(3), one O(4), and one O(5) atom to form VO5 trigonal bipyramids that share  a cornercorner with one Li(1)O3F tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent Li(7)O4 tetrahedra, corners with three equivalent Li(5)O3F tetrahedra,  an edgeedge with one Li(1)O3F tetrahedra,  an edgeedge with one Li(2)O4 tetrahedra, and  an edgeedge with one Li(7)O4 tetrahedra. There are five inequivalent O sites. In the first O site, O(1) is bonded in a 6-coordinate geometry to one Li(4), two equivalent Li(1), two equivalent Li(3), and one V(1) atom. In the second O site, O(2) is bonded to one Li(5), one Li(6), one Li(7), two equivalent Li(2), and one V(1) atom to form distorted OLi5V pentagonal pyramids that share  a cornercorner with one O(3)Li4V trigonal bipyramid,  a cornercorner with one F(1)Li4 trigonal pyramid,  an edgeedge with one O(2)Li5V pentagonal pyramid, and  an edgeedge with one O(3)Li4V trigonal bipyramid. In the third O site, O(3) is bonded to one Li(1), one Li(4), one Li(6), one Li(7), and one V(1) atom to form distorted OLi4V trigonal bipyramids that share  a cornercorner with one O(2)Li5V pentagonal pyramid, corners with two equivalent F(1)Li4 trigonal pyramids, and  an edgeedge with one O(2)Li5V pentagonal pyramid. In the fourth O site, O(4) is bonded in a 6-coordinate geometry to one Li(2), one Li(3), one Li(5), one Li(6), one Li(7), and one V(1) atom. In the fifth O site, O(5) is bonded in a 7-coordinate geometry to one Li(2), one Li(4), one Li(5), one Li(7), two equivalent Li(6), and one V(1) atom. F(1) is bonded to one Li(1), one Li(3), one Li(4), and one Li(5) atom to form FLi4 trigonal pyramids that share  a cornercorner with one O(2)Li5V pentagonal pyramid and corners with two equivalent O(3)Li4V trigonal bipyramids. is represented by the CIF card [CIF]
data_Li7VO5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.569
_cell_length_b   6.000
_cell_length_c   9.401
_cell_angle_alpha   93.670
_cell_angle_beta   103.069
_cell_angle_gamma   116.046
_symmetry_Int_Tables_number   1
_cell_volume   270.054
_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  0.774  0.876  0.529  1.0
  Li  Li1  1  0.755  0.350  0.991  1.0
  Li  Li2  1  0.039  0.603  0.390  1.0
  Li  Li3  1  0.961  0.397  0.610  1.0
  Li  Li4  1  0.503  0.988  0.317  1.0
  Li  Li5  1  0.504  0.453  0.770  1.0
  Li  Li6  1  0.352  0.140  0.098  1.0
  Li  Li7  1  0.497  0.012  0.683  1.0
  Li  Li8  1  0.496  0.547  0.230  1.0
  Li  Li9  1  0.119  0.266  0.869  1.0
  Li  Li10  1  0.881  0.734  0.131  1.0
  Li  Li11  1  0.226  0.124  0.471  1.0
  Li  Li12  1  0.245  0.650  0.009  1.0
  Li  Li13  1  0.648  0.860  0.902  1.0
  V  V14  1  0.064  0.818  0.776  1.0
  V  V15  1  0.936  0.182  0.224  1.0
  O  O16  1  0.924  0.207  0.421  1.0
  O  O17  1  0.889  0.674  0.922  1.0
  O  O18  1  0.822  0.979  0.736  1.0
  O  O19  1  0.742  0.410  0.194  1.0
  O  O20  1  0.389  0.119  0.866  1.0
  O  O21  1  0.178  0.021  0.264  1.0
  O  O22  1  0.258  0.590  0.806  1.0
  O  O23  1  0.111  0.326  0.078  1.0
  O  O24  1  0.076  0.793  0.579  1.0
  O  O25  1  0.611  0.881  0.134  1.0
  F  F26  1  0.422  0.684  0.391  1.0
  F  F27  1  0.578  0.316  0.609  1.0
[/CIF]
.
The crystal structure described by Li7VO5F crystallizes in the triclinic P-1 space group. There are seven inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(3), two equivalent O(1), and one F(1) atom to form distorted LiO3F tetrahedra that share  a cornercorner with one Li(5)O3F tetrahedra,  a cornercorner with one Li(7)O4 tetrahedra,  a cornercorner with one V(1)O5 trigonal bipyramid,  an edgeedge with one Li(1)O3F tetrahedra, and  an edgeedge with one V(1)O5 trigonal bipyramid. In the second Li site, Li(2) is bonded to one O(4), one O(5), and two equivalent O(2) atoms to form LiO4 tetrahedra that share corners with two equivalent Li(5)O3F tetrahedra, corners with two equivalent Li(7)O4 tetrahedra, corners with two equivalent V(1)O5 trigonal bipyramids,  an edgeedge with one Li(5)O3F tetrahedra,  an edgeedge with one Li(2)O4 tetrahedra,  an edgeedge with one Li(7)O4 tetrahedra, and  an edgeedge with one V(1)O5 trigonal bipyramid. In the third Li site, Li(3) is bonded in a 4-coordinate geometry to one O(4), two equivalent O(1), and one F(1) atom. In the fourth Li site, Li(4) is bonded in a distorted rectangular see-saw-like geometry to one O(1), one O(3), one O(5), and one F(1) atom. In the fifth Li site, Li(5) is bonded to one O(2), one O(4), one O(5), and one F(1) atom to form distorted LiO3F tetrahedra that share  a cornercorner with one Li(1)O3F tetrahedra,  a cornercorner with one Li(7)O4 tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with three equivalent V(1)O5 trigonal bipyramids,  an edgeedge with one Li(2)O4 tetrahedra, and  an edgeedge with one Li(7)O4 tetrahedra. In the sixth Li site, Li(6) is bonded in a 4-coordinate geometry to one O(2), one O(3), one O(4), and two equivalent O(5) atoms. In the seventh Li site, Li(7) is bonded to one O(2), one O(3), one O(4), and one O(5) atom to form LiO4 tetrahedra that share  a cornercorner with one Li(1)O3F tetrahedra,  a cornercorner with one Li(5)O3F tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent V(1)O5 trigonal bipyramids,  an edgeedge with one Li(5)O3F tetrahedra,  an edgeedge with one Li(2)O4 tetrahedra, and  an edgeedge with one V(1)O5 trigonal bipyramid. V(1) is bonded to one O(1), one O(2), one O(3), one O(4), and one O(5) atom to form VO5 trigonal bipyramids that share  a cornercorner with one Li(1)O3F tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent Li(7)O4 tetrahedra, corners with three equivalent Li(5)O3F tetrahedra,  an edgeedge with one Li(1)O3F tetrahedra,  an edgeedge with one Li(2)O4 tetrahedra, and  an edgeedge with one Li(7)O4 tetrahedra. There are five inequivalent O sites. In the first O site, O(1) is bonded in a 6-coordinate geometry to one Li(4), two equivalent Li(1), two equivalent Li(3), and one V(1) atom. In the second O site, O(2) is bonded to one Li(5), one Li(6), one Li(7), two equivalent Li(2), and one V(1) atom to form distorted OLi5V pentagonal pyramids that share  a cornercorner with one O(3)Li4V trigonal bipyramid,  a cornercorner with one F(1)Li4 trigonal pyramid,  an edgeedge with one O(2)Li5V pentagonal pyramid, and  an edgeedge with one O(3)Li4V trigonal bipyramid. In the third O site, O(3) is bonded to one Li(1), one Li(4), one Li(6), one Li(7), and one V(1) atom to form distorted OLi4V trigonal bipyramids that share  a cornercorner with one O(2)Li5V pentagonal pyramid, corners with two equivalent F(1)Li4 trigonal pyramids, and  an edgeedge with one O(2)Li5V pentagonal pyramid. In the fourth O site, O(4) is bonded in a 6-coordinate geometry to one Li(2), one Li(3), one Li(5), one Li(6), one Li(7), and one V(1) atom. In the fifth O site, O(5) is bonded in a 7-coordinate geometry to one Li(2), one Li(4), one Li(5), one Li(7), two equivalent Li(6), and one V(1) atom. F(1) is bonded to one Li(1), one Li(3), one Li(4), and one Li(5) atom to form FLi4 trigonal pyramids that share  a cornercorner with one O(2)Li5V pentagonal pyramid and corners with two equivalent O(3)Li4V trigonal bipyramids. is represented by the CIF card [CIF]
data_Li7VO5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.569
_cell_length_b   6.000
_cell_length_c   9.401
_cell_angle_alpha   93.670
_cell_angle_beta   103.069
_cell_angle_gamma   116.046
_symmetry_Int_Tables_number   1
_cell_volume   270.054
_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  0.774  0.876  0.529  1.0
  Li  Li1  1  0.755  0.350  0.991  1.0
  Li  Li2  1  0.039  0.603  0.390  1.0
  Li  Li3  1  0.961  0.397  0.610  1.0
  Li  Li4  1  0.503  0.988  0.317  1.0
  Li  Li5  1  0.504  0.453  0.770  1.0
  Li  Li6  1  0.352  0.140  0.098  1.0
  Li  Li7  1  0.497  0.012  0.683  1.0
  Li  Li8  1  0.496  0.547  0.230  1.0
  Li  Li9  1  0.119  0.266  0.869  1.0
  Li  Li10  1  0.881  0.734  0.131  1.0
  Li  Li11  1  0.226  0.124  0.471  1.0
  Li  Li12  1  0.245  0.650  0.009  1.0
  Li  Li13  1  0.648  0.860  0.902  1.0
  V  V14  1  0.064  0.818  0.776  1.0
  V  V15  1  0.936  0.182  0.224  1.0
  O  O16  1  0.924  0.207  0.421  1.0
  O  O17  1  0.889  0.674  0.922  1.0
  O  O18  1  0.822  0.979  0.736  1.0
  O  O19  1  0.742  0.410  0.194  1.0
  O  O20  1  0.389  0.119  0.866  1.0
  O  O21  1  0.178  0.021  0.264  1.0
  O  O22  1  0.258  0.590  0.806  1.0
  O  O23  1  0.111  0.326  0.078  1.0
  O  O24  1  0.076  0.793  0.579  1.0
  O  O25  1  0.611  0.881  0.134  1.0
  F  F26  1  0.422  0.684  0.391  1.0
  F  F27  1  0.578  0.316  0.609  1.0
[/CIF]
.