# generated using pymatgen
data_LiFe2O2F3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.62715863
_cell_length_b   5.62715863
_cell_length_c   7.04103280
_cell_angle_alpha   70.09567930
_cell_angle_beta   70.09567930
_cell_angle_gamma   54.78632544
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2O2F3
_chemical_formula_sum   'Li2 Fe4 O4 F6'
_cell_volume   168.23147607
_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  0.50000000  1
  Li  Li1  1  0.00000000  0.00000000  0.00000000  1
  Fe  Fe2  1  0.37660200  0.39605700  0.69980300  1
  Fe  Fe3  1  0.39605700  0.37660200  0.19980300  1
  Fe  Fe4  1  0.60394300  0.62339800  0.80019700  1
  Fe  Fe5  1  0.62339800  0.60394300  0.30019700  1
  O  O6  1  0.27965600  0.55913400  0.93679500  1
  O  O7  1  0.55913400  0.27965600  0.43679500  1
  O  O8  1  0.44086600  0.72034400  0.56320500  1
  O  O9  1  0.72034400  0.44086600  0.06320500  1
  F  F10  1  0.95382000  0.64933000  0.65870300  1
  F  F11  1  0.35067000  0.04618000  0.84129700  1
  F  F12  1  0.64933000  0.95382000  0.15870300  1
  F  F13  1  0.04618000  0.35067000  0.34129700  1
  F  F14  1  0.79512100  0.20487900  0.75000000  1
  F  F15  1  0.20487900  0.79512100  0.25000000  1
