# generated using pymatgen
data_Li2FeF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.42164651
_cell_length_b   5.42164651
_cell_length_c   5.42164651
_cell_angle_alpha   126.43190925
_cell_angle_beta   126.43190925
_cell_angle_gamma   79.17942085
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeF4
_chemical_formula_sum   'Li2 Fe1 F4'
_cell_volume   99.75540274
_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  0.50000000  0.50000000  0.00000000  1
  Li  Li1  1  0.25000000  0.75000000  0.50000000  1
  Fe  Fe2  1  0.00000000  0.00000000  0.00000000  1
  F  F3  1  0.18708400  0.67327300  0.07594800  1
  F  F4  1  0.88886400  0.81291600  0.48618800  1
  F  F5  1  0.59732500  0.11113600  0.92405200  1
  F  F6  1  0.32672700  0.40267500  0.51381200  1
