# generated using pymatgen
data_Li8Fe(O2F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.63739948
_cell_length_b   6.01831705
_cell_length_c   8.41335028
_cell_angle_alpha   79.95758508
_cell_angle_beta   89.85613932
_cell_angle_gamma   92.48565372
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Fe(O2F)2
_chemical_formula_sum   'Li16 Fe2 O8 F4'
_cell_volume   280.79276108
_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  0.35320500  0.23095400  0.11672800  1
  Li  Li1  1  0.85313600  0.73086400  0.61683500  1
  Li  Li2  1  0.64678800  0.76906700  0.88326300  1
  Li  Li3  1  0.14691900  0.26918700  0.38314200  1
  Li  Li4  1  0.16310500  0.59460900  0.04939100  1
  Li  Li5  1  0.66305100  0.09456100  0.54939600  1
  Li  Li6  1  0.83691500  0.40539900  0.95060700  1
  Li  Li7  1  0.33696100  0.90540100  0.45057200  1
  Li  Li8  1  0.69603800  0.43193400  0.20731000  1
  Li  Li9  1  0.19594000  0.93195700  0.70744900  1
  Li  Li10  1  0.30392100  0.56809700  0.79270900  1
  Li  Li11  1  0.80406500  0.06804100  0.29254300  1
  Li  Li12  1  0.44927000  0.15794100  0.86230800  1
  Li  Li13  1  0.94922700  0.65800500  0.36226400  1
  Li  Li14  1  0.55071700  0.84204200  0.13769400  1
  Li  Li15  1  0.05076500  0.34199700  0.63771200  1
  Fe  Fe16  1  0.50007900  0.49997200  0.50017200  1
  Fe  Fe17  1  0.99988400  0.00000400  0.99991400  1
  O  O18  1  0.15655800  0.31134100  0.92850000  1
  O  O19  1  0.65668500  0.81131400  0.42857400  1
  O  O20  1  0.84343200  0.68865300  0.07147400  1
  O  O21  1  0.34332900  0.18863500  0.57147300  1
  O  O22  1  0.66825000  0.16256700  0.08322000  1
  O  O23  1  0.16820900  0.66254800  0.58327300  1
  O  O24  1  0.33175900  0.83744200  0.91675500  1
  O  O25  1  0.83180800  0.33744200  0.41676000  1
  F  F26  1  0.35040500  0.48419700  0.23510900  1
  F  F27  1  0.84985500  0.98452200  0.73537300  1
  F  F28  1  0.64958700  0.51580800  0.76487900  1
  F  F29  1  0.15013500  0.01549300  0.26460200  1
