# generated using pymatgen
data_Li2FeO2F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21167825
_cell_length_b   5.21167825
_cell_length_c   5.14627272
_cell_angle_alpha   81.07450822
_cell_angle_beta   81.07450822
_cell_angle_gamma   120.69108414
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeO2F
_chemical_formula_sum   'Li4 Fe2 O4 F2'
_cell_volume   114.13924881
_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  0.00000000  1
  Li  Li1  1  0.50000000  0.50000000  0.50000000  1
  Li  Li2  1  0.32665400  0.67334600  0.00000000  1
  Li  Li3  1  0.67334600  0.32665400  0.00000000  1
  Fe  Fe4  1  0.18939800  0.81060200  0.50000000  1
  Fe  Fe5  1  0.81060200  0.18939800  0.50000000  1
  O  O6  1  0.41381600  0.07028500  0.73266300  1
  O  O7  1  0.92971500  0.58618400  0.26733700  1
  O  O8  1  0.58618400  0.92971500  0.26733700  1
  O  O9  1  0.07028500  0.41381600  0.73266300  1
  F  F10  1  0.76215400  0.76215400  0.74578200  1
  F  F11  1  0.23784600  0.23784600  0.25421800  1
