The structure described by LiVF4 crystallizes in the orthorhombic Pnma space group. Li(1) is bonded in a 6-coordinate geometry to one F(2), one F(3), and four equivalent F(1) atoms. V(1) is bonded to two equivalent F(1), two equivalent F(2), and two equivalent F(3) atoms to form edge-sharing VF6 octahedra. There are three inequivalent F sites. In the first F site, F(1) is bonded in a 3-coordinate geometry to two equivalent Li(1) and one V(1) atom. In the second F site, F(2) is bonded in a trigonal non-coplanar geometry to one Li(1) and two equivalent V(1) atoms. In the third F site, F(3) is bonded in a trigonal planar geometry to one Li(1) and two equivalent V(1) atoms. is represented by the CIF card [CIF]
data_LiVF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.752
_cell_length_b   6.282
_cell_length_c   9.968
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   297.580
_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  0.973  0.750  0.716  1.0
  Li  Li1  1  0.527  0.750  0.216  1.0
  Li  Li2  1  0.473  0.250  0.784  1.0
  Li  Li3  1  0.027  0.250  0.284  1.0
  V  V4  1  0.500  0.500  0.500  1.0
  V  V5  1  0.000  0.500  0.000  1.0
  V  V6  1  0.500  0.000  0.500  1.0
  V  V7  1  0.000  0.000  0.000  1.0
  F  F8  1  0.754  0.514  0.150  1.0
  F  F9  1  0.254  0.486  0.350  1.0
  F  F10  1  0.812  0.750  0.909  1.0
  F  F11  1  0.688  0.750  0.409  1.0
  F  F12  1  0.282  0.750  0.578  1.0
  F  F13  1  0.218  0.750  0.078  1.0
  F  F14  1  0.746  0.986  0.650  1.0
  F  F15  1  0.754  0.986  0.150  1.0
  F  F16  1  0.246  0.014  0.850  1.0
  F  F17  1  0.254  0.014  0.350  1.0
  F  F18  1  0.782  0.250  0.922  1.0
  F  F19  1  0.718  0.250  0.422  1.0
  F  F20  1  0.312  0.250  0.591  1.0
  F  F21  1  0.188  0.250  0.091  1.0
  F  F22  1  0.746  0.514  0.650  1.0
  F  F23  1  0.246  0.486  0.850  1.0
[/CIF]
.
The structure described by LiVF4 crystallizes in the orthorhombic Pnma space group. Li(1) is bonded in a 6-coordinate geometry to one F(2), one F(3), and four equivalent F(1) atoms. V(1) is bonded to two equivalent F(1), two equivalent F(2), and two equivalent F(3) atoms to form edge-sharing VF6 octahedra. There are three inequivalent F sites. In the first F site, F(1) is bonded in a 3-coordinate geometry to two equivalent Li(1) and one V(1) atom. In the second F site, F(2) is bonded in a trigonal non-coplanar geometry to one Li(1) and two equivalent V(1) atoms. In the third F site, F(3) is bonded in a trigonal planar geometry to one Li(1) and two equivalent V(1) atoms. is represented by the CIF card [CIF]
data_LiVF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.752
_cell_length_b   6.282
_cell_length_c   9.968
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   297.580
_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  0.973  0.750  0.716  1.0
  Li  Li1  1  0.527  0.750  0.216  1.0
  Li  Li2  1  0.473  0.250  0.784  1.0
  Li  Li3  1  0.027  0.250  0.284  1.0
  V  V4  1  0.500  0.500  0.500  1.0
  V  V5  1  0.000  0.500  0.000  1.0
  V  V6  1  0.500  0.000  0.500  1.0
  V  V7  1  0.000  0.000  0.000  1.0
  F  F8  1  0.754  0.514  0.150  1.0
  F  F9  1  0.254  0.486  0.350  1.0
  F  F10  1  0.812  0.750  0.909  1.0
  F  F11  1  0.688  0.750  0.409  1.0
  F  F12  1  0.282  0.750  0.578  1.0
  F  F13  1  0.218  0.750  0.078  1.0
  F  F14  1  0.746  0.986  0.650  1.0
  F  F15  1  0.754  0.986  0.150  1.0
  F  F16  1  0.246  0.014  0.850  1.0
  F  F17  1  0.254  0.014  0.350  1.0
  F  F18  1  0.782  0.250  0.922  1.0
  F  F19  1  0.718  0.250  0.422  1.0
  F  F20  1  0.312  0.250  0.591  1.0
  F  F21  1  0.188  0.250  0.091  1.0
  F  F22  1  0.746  0.514  0.650  1.0
  F  F23  1  0.246  0.486  0.850  1.0
[/CIF]
.