The crystal structure described by (LiV4O4F7)2O2 crystallizes in the triclinic P1 space group. The structure consists of one water atom inside a LiV4O4F7 framework. In the LiV4O4F7 framework, Li(1) is bonded in a 5-coordinate geometry to one V(3), one O(1), one O(5), one F(1), and one F(3) atom. There are four inequivalent V sites. In the first V site, V(1) is bonded in a linear geometry to one O(2) and one F(7) atom. In the second V site, V(2) is bonded in a 5-coordinate geometry to one O(2), one O(4), one F(1), one F(4), and one F(6) atom. In the third V site, V(3) is bonded in a distorted bent 150 degrees geometry to one Li(1), one O(4), and one F(3) atom. In the fourth V site, V(4) is bonded in a 3-coordinate geometry to one O(1), one F(2), one F(3), one F(5), and one F(7) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a 1-coordinate geometry to one Li(1), one V(4), and one F(2) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one V(1) and one V(2) atom. In the third O site, O(4) is bonded in a distorted bent 120 degrees geometry to one V(2) and one V(3) atom. In the fourth O site, O(5) is bonded in a distorted single-bond geometry to one Li(1) atom. There are seven inequivalent F sites. In the first F site, F(1) is bonded in an L-shaped geometry to one Li(1) and one V(2) atom. In the second F site, F(2) is bonded in a 2-coordinate geometry to one V(4) and one O(1) atom. In the third F site, F(3) is bonded in a 3-coordinate geometry to one Li(1), one V(3), and one V(4) atom. In the fourth F site, F(4) is bonded in a single-bond geometry to one V(2) atom. In the fifth F site, F(5) is bonded in a single-bond geometry to one V(4) atom. In the sixth F site, F(6) is bonded in a single-bond geometry to one V(2) atom. In the seventh F site, F(7) is bonded in a water-like geometry to one V(1) and one V(4) atom. is represented by the CIF card [CIF]
data_LiV4O5F7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.184
_cell_length_b   5.366
_cell_length_c   8.990
_cell_angle_alpha   105.960
_cell_angle_beta   89.483
_cell_angle_gamma   118.667
_symmetry_Int_Tables_number   1
_cell_volume   208.737
_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  0.814  0.432  0.593  1.0
  V  V1  1  0.981  0.003  0.007  1.0
  V  V2  1  0.749  0.043  0.238  1.0
  V  V3  1  0.504  0.953  0.503  1.0
  V  V4  1  0.212  0.011  0.741  1.0
  O  O5  1  0.842  0.906  0.673  1.0
  O  O6  1  0.829  0.067  0.083  1.0
  O  O7  1  0.785  0.488  0.122  1.0
  O  O8  1  0.676  0.898  0.427  1.0
  O  O9  1  0.265  0.505  0.628  1.0
  F  F10  1  0.726  0.506  0.385  1.0
  F  F11  1  0.683  0.114  0.815  1.0
  F  F12  1  0.362  0.117  0.580  1.0
  F  F13  1  0.323  0.888  0.175  1.0
  F  F14  1  0.228  0.504  0.876  1.0
  F  F15  1  0.174  0.095  0.328  1.0
  F  F16  1  0.178  0.915  0.924  1.0
[/CIF]
.
The crystal structure described by (LiV4O4F7)2O2 crystallizes in the triclinic P1 space group. The structure consists of one water atom inside a LiV4O4F7 framework. In the LiV4O4F7 framework, Li(1) is bonded in a 5-coordinate geometry to one V(3), one O(1), one O(5), one F(1), and one F(3) atom. There are four inequivalent V sites. In the first V site, V(1) is bonded in a linear geometry to one O(2) and one F(7) atom. In the second V site, V(2) is bonded in a 5-coordinate geometry to one O(2), one O(4), one F(1), one F(4), and one F(6) atom. In the third V site, V(3) is bonded in a distorted bent 150 degrees geometry to one Li(1), one O(4), and one F(3) atom. In the fourth V site, V(4) is bonded in a 3-coordinate geometry to one O(1), one F(2), one F(3), one F(5), and one F(7) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a 1-coordinate geometry to one Li(1), one V(4), and one F(2) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one V(1) and one V(2) atom. In the third O site, O(4) is bonded in a distorted bent 120 degrees geometry to one V(2) and one V(3) atom. In the fourth O site, O(5) is bonded in a distorted single-bond geometry to one Li(1) atom. There are seven inequivalent F sites. In the first F site, F(1) is bonded in an L-shaped geometry to one Li(1) and one V(2) atom. In the second F site, F(2) is bonded in a 2-coordinate geometry to one V(4) and one O(1) atom. In the third F site, F(3) is bonded in a 3-coordinate geometry to one Li(1), one V(3), and one V(4) atom. In the fourth F site, F(4) is bonded in a single-bond geometry to one V(2) atom. In the fifth F site, F(5) is bonded in a single-bond geometry to one V(4) atom. In the sixth F site, F(6) is bonded in a single-bond geometry to one V(2) atom. In the seventh F site, F(7) is bonded in a water-like geometry to one V(1) and one V(4) atom. is represented by the CIF card [CIF]
data_LiV4O5F7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.184
_cell_length_b   5.366
_cell_length_c   8.990
_cell_angle_alpha   105.960
_cell_angle_beta   89.483
_cell_angle_gamma   118.667
_symmetry_Int_Tables_number   1
_cell_volume   208.737
_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  0.814  0.432  0.593  1.0
  V  V1  1  0.981  0.003  0.007  1.0
  V  V2  1  0.749  0.043  0.238  1.0
  V  V3  1  0.504  0.953  0.503  1.0
  V  V4  1  0.212  0.011  0.741  1.0
  O  O5  1  0.842  0.906  0.673  1.0
  O  O6  1  0.829  0.067  0.083  1.0
  O  O7  1  0.785  0.488  0.122  1.0
  O  O8  1  0.676  0.898  0.427  1.0
  O  O9  1  0.265  0.505  0.628  1.0
  F  F10  1  0.726  0.506  0.385  1.0
  F  F11  1  0.683  0.114  0.815  1.0
  F  F12  1  0.362  0.117  0.580  1.0
  F  F13  1  0.323  0.888  0.175  1.0
  F  F14  1  0.228  0.504  0.876  1.0
  F  F15  1  0.174  0.095  0.328  1.0
  F  F16  1  0.178  0.915  0.924  1.0
[/CIF]
.