# generated using pymatgen
data_Li8Fe(O2F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.44928600
_cell_length_b   5.59154016
_cell_length_c   11.00422952
_cell_angle_alpha   101.61277459
_cell_angle_beta   84.81056989
_cell_angle_gamma   117.40167841
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Fe(O2F)2
_chemical_formula_sum   'Li16 Fe2 O8 F4'
_cell_volume   291.58373713
_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  0.71490000  0.56424400  0.81544500  1
  Li  Li1  1  0.43682200  0.66481400  0.96644400  1
  Li  Li2  1  0.36870400  0.19611800  0.68562400  1
  Li  Li3  1  0.08526700  0.58888400  0.66479600  1
  Li  Li4  1  0.57408700  0.03429300  0.17539400  1
  Li  Li5  1  0.26311300  0.13154500  0.31060400  1
  Li  Li6  1  0.04220400  0.27407400  0.83152800  1
  Li  Li7  1  0.28204100  0.83433200  0.45342800  1
  Li  Li8  1  0.71795900  0.16566800  0.54657200  1
  Li  Li9  1  0.95779600  0.72592600  0.16847200  1
  Li  Li10  1  0.73688700  0.86845500  0.68939600  1
  Li  Li11  1  0.63129600  0.80388200  0.31437600  1
  Li  Li12  1  0.42591300  0.96570700  0.82460600  1
  Li  Li13  1  0.91473300  0.41111600  0.33520400  1
  Li  Li14  1  0.56317800  0.33518600  0.03355600  1
  Li  Li15  1  0.28510000  0.43575600  0.18455500  1
  Fe  Fe16  1  0.00000000  0.00000000  0.00000000  1
  Fe  Fe17  1  0.50000000  0.50000000  0.50000000  1
  O  O18  1  0.70855600  0.50527400  0.63515400  1
  O  O19  1  0.57848300  0.13784900  0.38062600  1
  O  O20  1  0.37830700  0.28718600  0.87772700  1
  O  O21  1  0.26266400  0.06381700  0.12829600  1
  O  O22  1  0.73733600  0.93618300  0.87170400  1
  O  O23  1  0.62169300  0.71281400  0.12227300  1
  O  O24  1  0.42151700  0.86215100  0.61937400  1
  O  O25  1  0.29144400  0.49472600  0.36484600  1
  F  F26  1  0.09297400  0.64021300  0.85902200  1
  F  F27  1  0.03743300  0.21149200  0.64837200  1
  F  F28  1  0.96256700  0.78850800  0.35162800  1
  F  F29  1  0.90702600  0.35978700  0.14097800  1
