# generated using pymatgen
data_Li2ZrF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.50414946
_cell_length_b   6.50414946
_cell_length_c   5.18887744
_cell_angle_alpha   71.24151032
_cell_angle_beta   71.24151032
_cell_angle_gamma   75.35893924
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2ZrF6
_chemical_formula_sum   'Li4 Zr2 F12'
_cell_volume   194.06006545
_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  0.70356900  0.86517800  0.90983700  1
  Li  Li1  1  0.13482200  0.29643100  0.59016300  1
  Li  Li2  1  0.29643100  0.13482200  0.09016300  1
  Li  Li3  1  0.86517800  0.70356900  0.40983700  1
  Zr  Zr4  1  0.68274900  0.31725100  0.25000000  1
  Zr  Zr5  1  0.31725100  0.68274900  0.75000000  1
  F  F6  1  0.00039600  0.25007700  0.99652600  1
  F  F7  1  0.88659800  0.37008900  0.44270600  1
  F  F8  1  0.37008900  0.88659800  0.94270600  1
  F  F9  1  0.11340200  0.62991100  0.55729400  1
  F  F10  1  0.25007700  0.00039600  0.49652600  1
  F  F11  1  0.57135700  0.67007000  0.35222500  1
  F  F12  1  0.62991100  0.11340200  0.05729400  1
  F  F13  1  0.32993000  0.42864300  0.14777500  1
  F  F14  1  0.99960400  0.74992300  0.00347400  1
  F  F15  1  0.74992300  0.99960400  0.50347400  1
  F  F16  1  0.42864300  0.32993000  0.64777500  1
  F  F17  1  0.67007000  0.57135700  0.85222500  1
