# generated using pymatgen
data_Li5FeO3F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.64050000
_cell_length_b   5.47177100
_cell_length_c   5.48276338
_cell_angle_alpha   86.11742659
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5FeO3F
_chemical_formula_sum   'Li10 Fe2 O6 F2'
_cell_volume   198.76060578
_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  0.99647000  0.91347700  1
  Li  Li1  1  0.25132400  0.82814300  0.19578200  1
  Li  Li2  1  0.74867600  0.82814300  0.19578200  1
  Li  Li3  1  0.00000000  0.66237300  0.66050300  1
  Li  Li4  1  0.22683100  0.41216300  0.91887100  1
  Li  Li5  1  0.77316900  0.41216300  0.91887100  1
  Li  Li6  1  0.50000000  0.35478900  0.36447500  1
  Li  Li7  1  0.26967800  0.11285200  0.62582400  1
  Li  Li8  1  0.73032200  0.11285200  0.62582400  1
  Li  Li9  1  0.50000000  0.11481700  0.02532100  1
  Fe  Fe10  1  0.50000000  0.69160800  0.72491300  1
  Fe  Fe11  1  0.00000000  0.28937300  0.33580700  1
  O  O12  1  0.76332600  0.79513300  0.83271600  1
  O  O13  1  0.23667400  0.79513300  0.83271600  1
  O  O14  1  0.50000000  0.31081600  0.72586200  1
  O  O15  1  0.00000000  0.29953200  0.71570100  1
  O  O16  1  0.26328400  0.18915800  0.22893200  1
  O  O17  1  0.73671600  0.18915800  0.22893200  1
  F  F18  1  0.50000000  0.69967000  0.31307700  1
  F  F19  1  0.00000000  0.70767700  0.31603200  1
