# generated using pymatgen
data_LiV2OF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22844235
_cell_length_b   5.22844235
_cell_length_c   13.92648800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000445
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiV2OF5
_chemical_formula_sum   'Li3 V6 O3 F15'
_cell_volume   329.69842255
_cell_formula_units_Z   3
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  0.69327600  0.69327600  0.50000000  1
  Li  Li1  1  0.00000000  0.30672400  0.16666700  1
  Li  Li2  1  0.30672400  0.00000000  0.83333300  1
  V  V3  1  0.67592500  0.69096900  0.75345200  1
  V  V4  1  0.30903100  0.98495700  0.08678500  1
  V  V5  1  0.69096900  0.67592500  0.24654800  1
  V  V6  1  0.98495700  0.30903100  0.91321500  1
  V  V7  1  0.01504300  0.32407500  0.42011900  1
  V  V8  1  0.32407500  0.01504300  0.57988100  1
  O  O9  1  0.00000000  0.93690200  0.16666700  1
  O  O10  1  0.93690200  0.00000000  0.83333300  1
  O  O11  1  0.06309800  0.06309800  0.50000000  1
  F  F12  1  0.60484900  0.94140800  0.65864700  1
  F  F13  1  0.36574400  0.68240500  0.16086900  1
  F  F14  1  0.33655900  0.39515100  0.32531400  1
  F  F15  1  0.00000000  0.72729000  0.66666700  1
  F  F16  1  0.39515100  0.33655900  0.67468600  1
  F  F17  1  0.05859200  0.66344100  0.99198000  1
  F  F18  1  0.94140800  0.60484900  0.34135300  1
  F  F19  1  0.68240500  0.36574400  0.83913100  1
  F  F20  1  0.31759500  0.68333900  0.49420300  1
  F  F21  1  0.63425600  0.31666100  0.17246400  1
  F  F22  1  0.31666100  0.63425600  0.82753600  1
  F  F23  1  0.68333900  0.31759500  0.50579700  1
  F  F24  1  0.66344100  0.05859200  0.00802000  1
  F  F25  1  0.72729000  0.00000000  0.33333300  1
  F  F26  1  0.27271000  0.27271000  0.00000000  1
