# generated using pymatgen
data_LiFe5O3F5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.25886115
_cell_length_b   6.25886115
_cell_length_c   6.37873835
_cell_angle_alpha   59.94853340
_cell_angle_beta   59.94853340
_cell_angle_gamma   59.82799524
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe5O3F5
_chemical_formula_sum   'Li1 Fe5 O3 F5'
_cell_volume   176.32150576
_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  0.61782800  0.61782800  0.12725800  1
  Fe  Fe1  1  0.61037400  0.13818500  0.61097500  1
  Fe  Fe2  1  0.96495000  0.96495000  0.06464800  1
  Fe  Fe3  1  0.62196100  0.62196100  0.62497600  1
  Fe  Fe4  1  0.29284800  0.29284800  0.20109100  1
  Fe  Fe5  1  0.13818500  0.61037400  0.61097500  1
  O  O6  1  0.39775000  0.39775000  0.82589500  1
  O  O7  1  0.84696300  0.84696300  0.43874200  1
  O  O8  1  0.39277600  0.39277600  0.37629100  1
  F  F9  1  0.87527000  0.38378900  0.35951600  1
  F  F10  1  0.87019600  0.37396400  0.88945200  1
  F  F11  1  0.37396400  0.87019600  0.88945200  1
  F  F12  1  0.86314400  0.86314400  0.87121800  1
  F  F13  1  0.38378900  0.87527000  0.35951600  1
