# generated using pymatgen
data_Li2ZrF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.93340236
_cell_length_b   4.93340205
_cell_length_c   4.62948023
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999538
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2ZrF6
_chemical_formula_sum   'Li2 Zr1 F6'
_cell_volume   97.57890331
_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  0.66666700  0.33333300  0.50000000  1
  Li  Li1  1  0.33333300  0.66666700  0.50000000  1
  Zr  Zr2  1  -0.00000000  -0.00000000  0.00000000  1
  F  F3  1  0.00000000  0.33182832  0.25780369  1
  F  F4  1  0.66817168  0.66817168  0.25780369  1
  F  F5  1  -0.00000000  0.66817168  0.74219631  1
  F  F6  1  0.66817168  -0.00000000  0.74219631  1
  F  F7  1  0.33182832  0.33182832  0.74219631  1
  F  F8  1  0.33182832  0.00000000  0.25780369  1
