The structure described by LiVF6 crystallizes in the trigonal P312 space group. Li(1) is bonded to six equivalent F(1) atoms to form LiF6 octahedra that share corners with six equivalent V(1)F6 octahedra. The corner-sharing octahedral tilt angles are 40°. V(1) is bonded to six equivalent F(1) atoms to form VF6 octahedra that share corners with six equivalent Li(1)F6 octahedra. The corner-sharing octahedral tilt angles are 40°. F(1) is bonded in a bent 150 degrees geometry to one Li(1) and one V(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiVF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.960
_cell_length_b   4.960
_cell_length_c   4.635
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   98.745
_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  0.000  0.000  0.500  1.0
  V  V1  1  0.333  0.667  0.000  1.0
  F  F2  1  0.044  0.684  0.230  1.0
  F  F3  1  0.044  0.361  0.770  1.0
  F  F4  1  0.316  0.956  0.770  1.0
  F  F5  1  0.316  0.361  0.230  1.0
  F  F6  1  0.639  0.956  0.230  1.0
  F  F7  1  0.639  0.684  0.770  1.0
[/CIF]
.
The structure described by LiVF6 crystallizes in the trigonal P312 space group. Li(1) is bonded to six equivalent F(1) atoms to form LiF6 octahedra that share corners with six equivalent V(1)F6 octahedra. The corner-sharing octahedral tilt angles are 40°. V(1) is bonded to six equivalent F(1) atoms to form VF6 octahedra that share corners with six equivalent Li(1)F6 octahedra. The corner-sharing octahedral tilt angles are 40°. F(1) is bonded in a bent 150 degrees geometry to one Li(1) and one V(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiVF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.960
_cell_length_b   4.960
_cell_length_c   4.635
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   98.745
_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  0.000  0.000  0.500  1.0
  V  V1  1  0.333  0.667  0.000  1.0
  F  F2  1  0.044  0.684  0.230  1.0
  F  F3  1  0.044  0.361  0.770  1.0
  F  F4  1  0.316  0.956  0.770  1.0
  F  F5  1  0.316  0.361  0.230  1.0
  F  F6  1  0.639  0.956  0.230  1.0
  F  F7  1  0.639  0.684  0.770  1.0
[/CIF]
.