# generated using pymatgen
data_Li2FeF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21312555
_cell_length_b   5.21312555
_cell_length_c   6.56963700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   112.99822853
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeF4
_chemical_formula_sum   'Li4 Fe2 F8'
_cell_volume   164.34993010
_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  0.84527900  0.15472100  0.25000000  1
  Li  Li1  1  0.50000000  0.50000000  0.00000000  1
  Li  Li2  1  0.50000000  0.50000000  0.50000000  1
  Li  Li3  1  0.15472100  0.84527900  0.75000000  1
  Fe  Fe4  1  0.83001200  0.16998800  0.75000000  1
  Fe  Fe5  1  0.16998800  0.83001200  0.25000000  1
  F  F6  1  0.24889100  0.23827700  0.75000000  1
  F  F7  1  0.23827700  0.24889100  0.25000000  1
  F  F8  1  0.72914500  0.27085500  0.01326900  1
  F  F9  1  0.72914500  0.27085500  0.48673100  1
  F  F10  1  0.27085500  0.72914500  0.98673100  1
  F  F11  1  0.27085500  0.72914500  0.51326900  1
  F  F12  1  0.76172300  0.75110900  0.75000000  1
  F  F13  1  0.75110900  0.76172300  0.25000000  1
