# generated using pymatgen
data_Li2TiF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.60075757
_cell_length_b   4.60075757
_cell_length_c   8.84075562
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiF6
_chemical_formula_sum   'Li4 Ti2 F12'
_cell_volume   187.13201091
_cell_formula_units_Z   2
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  -0.00000000  0.00000000  0.33880427  1
  Li  Li1  1  0.50000000  0.50000000  0.83880427  1
  Li  Li2  1  0.50000000  0.50000000  0.16119573  1
  Li  Li3  1  -0.00000000  0.00000000  0.66119573  1
  Ti  Ti4  1  -0.00000000  0.00000000  -0.00000000  1
  Ti  Ti5  1  0.50000000  0.50000000  0.50000000  1
  F  F6  1  0.21072506  0.78927494  0.50000000  1
  F  F7  1  0.69563045  0.69563045  0.65602867  1
  F  F8  1  0.28927494  0.28927494  -0.00000000  1
  F  F9  1  0.71072506  0.71072506  -0.00000000  1
  F  F10  1  0.78927494  0.21072506  0.50000000  1
  F  F11  1  0.19563045  0.80436955  0.84397133  1
  F  F12  1  0.30436955  0.30436955  0.34397133  1
  F  F13  1  0.69563045  0.69563045  0.34397133  1
  F  F14  1  0.80436955  0.19563045  0.84397133  1
  F  F15  1  0.80436955  0.19563045  0.15602867  1
  F  F16  1  0.19563045  0.80436955  0.15602867  1
  F  F17  1  0.30436955  0.30436955  0.65602867  1
