# generated using pymatgen
data_Li2Fe4OF8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.38110757
_cell_length_b   5.38110757
_cell_length_c   14.35168058
_cell_angle_alpha   88.88036741
_cell_angle_beta   88.88036741
_cell_angle_gamma   58.67034861
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe4OF8
_chemical_formula_sum   'Li4 Fe8 O2 F16'
_cell_volume   354.88806599
_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  0.00003500  0.99796100  0.84634700  1
  Li  Li1  1  0.99796100  0.00003500  0.34634700  1
  Li  Li2  1  0.98865100  0.02072400  0.63968100  1
  Li  Li3  1  0.02072400  0.98865100  0.13968100  1
  Fe  Fe4  1  0.69061100  0.65284000  0.68245500  1
  Fe  Fe5  1  0.65226700  0.66979300  0.98507900  1
  Fe  Fe6  1  0.65284000  0.69061100  0.18245500  1
  Fe  Fe7  1  0.66979300  0.65226700  0.48507900  1
  Fe  Fe8  1  0.33465300  0.32696100  0.81432800  1
  Fe  Fe9  1  0.32696100  0.33465300  0.31432800  1
  Fe  Fe10  1  0.33988100  0.30793500  0.02619800  1
  Fe  Fe11  1  0.30793500  0.33988100  0.52619800  1
  O  O12  1  0.38133300  0.95334700  0.08183100  1
  O  O13  1  0.95334700  0.38133300  0.58183100  1
  F  F14  1  0.29675900  0.70394000  0.25233600  1
  F  F15  1  0.34216200  0.68266900  0.58430900  1
  F  F16  1  0.70394000  0.29675900  0.75233600  1
  F  F17  1  0.68266900  0.34216200  0.08430900  1
  F  F18  1  0.97856300  0.33619000  0.25565800  1
  F  F19  1  0.67070400  0.98616600  0.58537200  1
  F  F20  1  0.00818000  0.34472200  0.91418800  1
  F  F21  1  0.33619000  0.97856300  0.75565800  1
  F  F22  1  0.98616600  0.67070400  0.08537200  1
  F  F23  1  0.34472200  0.00818000  0.41418800  1
  F  F24  1  0.01140800  0.69783400  0.75351500  1
  F  F25  1  0.02462300  0.64668500  0.41120900  1
  F  F26  1  0.32596900  0.61989400  0.91755700  1
  F  F27  1  0.64668500  0.02462300  0.91120900  1
  F  F28  1  0.69783400  0.01140800  0.25351500  1
  F  F29  1  0.61989400  0.32596900  0.41755700  1
