The crystal structure described by LiVOF3 crystallizes in the tetragonal P4_1 space group. Li(1) is bonded to two equivalent O(1), one F(2), and two equivalent F(1) atoms to form distorted edge-sharing LiO2F3 trigonal bipyramids. V(1) is bonded in a 6-coordinate geometry to one O(1), one F(2), two equivalent F(1), and two equivalent F(3) atoms. O(1) is bonded in a distorted T-shaped geometry to two equivalent Li(1) and one V(1) atom. There are three inequivalent F sites. In the first F site, F(1) is bonded in a 4-coordinate geometry to two equivalent Li(1) and two equivalent V(1) atoms. In the second F site, F(2) is bonded in a bent 120 degrees geometry to one Li(1) and one V(1) atom. In the third F site, F(3) is bonded in a 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   5.547
_cell_length_b   5.547
_cell_length_c   9.757
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   300.222
_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  0.093  0.853  0.753  1.0
  Li  Li1  1  0.147  0.093  0.003  1.0
  Li  Li2  1  0.853  0.907  0.503  1.0
  Li  Li3  1  0.907  0.147  0.253  1.0
  V  V4  1  0.137  0.416  0.503  1.0
  V  V5  1  0.416  0.863  0.253  1.0
  V  V6  1  0.584  0.137  0.753  1.0
  V  V7  1  0.863  0.584  0.003  1.0
  O  O8  1  0.079  0.668  0.585  1.0
  O  O9  1  0.332  0.079  0.835  1.0
  O  O10  1  0.668  0.921  0.335  1.0
  O  O11  1  0.921  0.332  0.085  1.0
  F  F12  1  0.039  0.819  0.120  1.0
  F  F13  1  0.128  0.602  0.883  1.0
  F  F14  1  0.181  0.039  0.370  1.0
  F  F15  1  0.315  0.560  0.344  1.0
  F  F16  1  0.398  0.128  0.133  1.0
  F  F17  1  0.440  0.315  0.594  1.0
  F  F18  1  0.560  0.685  0.094  1.0
  F  F19  1  0.602  0.872  0.633  1.0
  F  F20  1  0.685  0.440  0.844  1.0
  F  F21  1  0.819  0.961  0.870  1.0
  F  F22  1  0.872  0.398  0.383  1.0
  F  F23  1  0.961  0.181  0.620  1.0
[/CIF]
.
The crystal structure described by LiVOF3 crystallizes in the tetragonal P4_1 space group. Li(1) is bonded to two equivalent O(1), one F(2), and two equivalent F(1) atoms to form distorted edge-sharing LiO2F3 trigonal bipyramids. V(1) is bonded in a 6-coordinate geometry to one O(1), one F(2), two equivalent F(1), and two equivalent F(3) atoms. O(1) is bonded in a distorted T-shaped geometry to two equivalent Li(1) and one V(1) atom. There are three inequivalent F sites. In the first F site, F(1) is bonded in a 4-coordinate geometry to two equivalent Li(1) and two equivalent V(1) atoms. In the second F site, F(2) is bonded in a bent 120 degrees geometry to one Li(1) and one V(1) atom. In the third F site, F(3) is bonded in a 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   5.547
_cell_length_b   5.547
_cell_length_c   9.757
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   300.222
_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  0.093  0.853  0.753  1.0
  Li  Li1  1  0.147  0.093  0.003  1.0
  Li  Li2  1  0.853  0.907  0.503  1.0
  Li  Li3  1  0.907  0.147  0.253  1.0
  V  V4  1  0.137  0.416  0.503  1.0
  V  V5  1  0.416  0.863  0.253  1.0
  V  V6  1  0.584  0.137  0.753  1.0
  V  V7  1  0.863  0.584  0.003  1.0
  O  O8  1  0.079  0.668  0.585  1.0
  O  O9  1  0.332  0.079  0.835  1.0
  O  O10  1  0.668  0.921  0.335  1.0
  O  O11  1  0.921  0.332  0.085  1.0
  F  F12  1  0.039  0.819  0.120  1.0
  F  F13  1  0.128  0.602  0.883  1.0
  F  F14  1  0.181  0.039  0.370  1.0
  F  F15  1  0.315  0.560  0.344  1.0
  F  F16  1  0.398  0.128  0.133  1.0
  F  F17  1  0.440  0.315  0.594  1.0
  F  F18  1  0.560  0.685  0.094  1.0
  F  F19  1  0.602  0.872  0.633  1.0
  F  F20  1  0.685  0.440  0.844  1.0
  F  F21  1  0.819  0.961  0.870  1.0
  F  F22  1  0.872  0.398  0.383  1.0
  F  F23  1  0.961  0.181  0.620  1.0
[/CIF]
.