# generated using pymatgen
data_LiFe6(OF2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.88884594
_cell_length_b   5.82071285
_cell_length_c   5.82748394
_cell_angle_alpha   69.32481985
_cell_angle_beta   69.40258555
_cell_angle_gamma   69.52866215
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe6(OF2)4
_chemical_formula_sum   'Li1 Fe6 O4 F8'
_cell_volume   226.44921865
_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  0.57372200  0.40560300  0.92655600  1
  Fe  Fe1  1  0.85259400  0.65103900  0.67171200  1
  Fe  Fe2  1  0.68014000  0.34693900  0.33098400  1
  Fe  Fe3  1  0.31592000  0.69988600  0.62984400  1
  Fe  Fe4  1  0.16119700  0.33280600  0.36164300  1
  Fe  Fe5  1  0.48967400  0.95087100  0.02384100  1
  Fe  Fe6  1  0.00000900  0.99234300  0.01740000  1
  O  O7  1  0.32180000  0.00696100  0.35255900  1
  O  O8  1  0.67516700  0.61281500  0.00253900  1
  O  O9  1  0.00098000  0.29403400  0.71216500  1
  O  O10  1  0.00121900  0.69429900  0.31121800  1
  F  F11  1  0.67247600  0.03228200  0.63292200  1
  F  F12  1  0.33715900  0.38932400  0.94676900  1
  F  F13  1  0.27952300  0.89764800  0.90456800  1
  F  F14  1  0.97916100  0.22330900  0.22830600  1
  F  F15  1  0.63354700  0.56730800  0.57666800  1
  F  F16  1  0.01692400  0.77750900  0.78449400  1
  F  F17  1  0.36871500  0.44029900  0.41593100  1
  F  F18  1  0.71507500  0.09097400  0.09696700  1
