The structure described by LiVOF3 crystallizes in the monoclinic P2_1/c space group. Li(1) is bonded in a 4-coordinate geometry to two equivalent F(1) and two equivalent F(2) atoms. V(1) is bonded to two equivalent O(1), one F(1), one F(2), and two equivalent F(3) atoms to form corner-sharing VO2F4 octahedra. The corner-sharing octahedral tilt angles range from 40-44°. O(1) is bonded in a distorted bent 150 degrees geometry to two equivalent V(1) atoms. There are three inequivalent F sites. In the first F site, F(1) is bonded in a distorted trigonal planar geometry to two equivalent Li(1) and one V(1) atom. In the second F site, F(2) is bonded in a trigonal planar geometry to two equivalent Li(1) and one V(1) atom. In the third F site, F(3) is bonded in a distorted bent 150 degrees geometry to two equivalent V(1) atoms. is represented by the CIF file [CIF]
data_LiVOF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.158
_cell_length_b   7.843
_cell_length_c   7.353
_cell_angle_alpha   74.094
_cell_angle_beta   90.000
_cell_angle_gamma   89.989
_symmetry_Int_Tables_number   1
_cell_volume   286.059
_cell_formula_units_Z   4
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  0.199  0.135  0.014  1.0
  Li  Li1  1  0.301  0.136  0.514  1.0
  Li  Li2  1  0.699  0.864  0.486  1.0
  Li  Li3  1  0.801  0.865  0.986  1.0
  V  V4  1  0.782  0.348  0.266  1.0
  V  V5  1  0.282  0.652  0.234  1.0
  V  V6  1  0.718  0.348  0.766  1.0
  V  V7  1  0.218  0.652  0.734  1.0
  O  O8  1  0.046  0.458  0.815  1.0
  O  O9  1  0.454  0.458  0.315  1.0
  O  O10  1  0.546  0.542  0.685  1.0
  O  O11  1  0.954  0.542  0.185  1.0
  F  F12  1  0.875  0.120  0.884  1.0
  F  F13  1  0.625  0.120  0.384  1.0
  F  F14  1  0.375  0.879  0.616  1.0
  F  F15  1  0.125  0.880  0.116  1.0
  F  F16  1  0.419  0.199  0.749  1.0
  F  F17  1  0.082  0.199  0.249  1.0
  F  F18  1  0.919  0.801  0.751  1.0
  F  F19  1  0.581  0.801  0.251  1.0
  F  F20  1  0.888  0.323  0.533  1.0
  F  F21  1  0.612  0.323  0.033  1.0
  F  F22  1  0.388  0.677  0.967  1.0
  F  F23  1  0.112  0.677  0.467  1.0
[/CIF]
.
The structure described by LiVOF3 crystallizes in the monoclinic P2_1/c space group. Li(1) is bonded in a 4-coordinate geometry to two equivalent F(1) and two equivalent F(2) atoms. V(1) is bonded to two equivalent O(1), one F(1), one F(2), and two equivalent F(3) atoms to form corner-sharing VO2F4 octahedra. The corner-sharing octahedral tilt angles range from 40-44°. O(1) is bonded in a distorted bent 150 degrees geometry to two equivalent V(1) atoms. There are three inequivalent F sites. In the first F site, F(1) is bonded in a distorted trigonal planar geometry to two equivalent Li(1) and one V(1) atom. In the second F site, F(2) is bonded in a trigonal planar geometry to two equivalent Li(1) and one V(1) atom. In the third F site, F(3) is bonded in a distorted bent 150 degrees geometry to two equivalent V(1) atoms. is represented by the CIF file [CIF]
data_LiVOF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.158
_cell_length_b   7.843
_cell_length_c   7.353
_cell_angle_alpha   74.094
_cell_angle_beta   90.000
_cell_angle_gamma   89.989
_symmetry_Int_Tables_number   1
_cell_volume   286.059
_cell_formula_units_Z   4
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  0.199  0.135  0.014  1.0
  Li  Li1  1  0.301  0.136  0.514  1.0
  Li  Li2  1  0.699  0.864  0.486  1.0
  Li  Li3  1  0.801  0.865  0.986  1.0
  V  V4  1  0.782  0.348  0.266  1.0
  V  V5  1  0.282  0.652  0.234  1.0
  V  V6  1  0.718  0.348  0.766  1.0
  V  V7  1  0.218  0.652  0.734  1.0
  O  O8  1  0.046  0.458  0.815  1.0
  O  O9  1  0.454  0.458  0.315  1.0
  O  O10  1  0.546  0.542  0.685  1.0
  O  O11  1  0.954  0.542  0.185  1.0
  F  F12  1  0.875  0.120  0.884  1.0
  F  F13  1  0.625  0.120  0.384  1.0
  F  F14  1  0.375  0.879  0.616  1.0
  F  F15  1  0.125  0.880  0.116  1.0
  F  F16  1  0.419  0.199  0.749  1.0
  F  F17  1  0.082  0.199  0.249  1.0
  F  F18  1  0.919  0.801  0.751  1.0
  F  F19  1  0.581  0.801  0.251  1.0
  F  F20  1  0.888  0.323  0.533  1.0
  F  F21  1  0.612  0.323  0.033  1.0
  F  F22  1  0.388  0.677  0.967  1.0
  F  F23  1  0.112  0.677  0.467  1.0
[/CIF]
.