# generated using pymatgen
data_LiFe2O2F3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.97950427
_cell_length_b   5.97950427
_cell_length_c   7.10037124
_cell_angle_alpha   70.55523212
_cell_angle_beta   70.55523212
_cell_angle_gamma   50.36335980
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2O2F3
_chemical_formula_sum   'Li2 Fe4 O4 F6'
_cell_volume   181.79813828
_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  0.50000000  0.50000000  0.00000000  1
  Li  Li1  1  0.50000000  0.50000000  0.50000000  1
  Fe  Fe2  1  0.78715300  0.83017700  0.86968800  1
  Fe  Fe3  1  0.83017700  0.78715300  0.36968800  1
  Fe  Fe4  1  0.16982300  0.21284700  0.63031200  1
  Fe  Fe5  1  0.21284700  0.16982300  0.13031200  1
  O  O6  1  0.97563700  0.62689100  0.63454100  1
  O  O7  1  0.62689100  0.97563700  0.13454100  1
  O  O8  1  0.37310900  0.02436300  0.86545900  1
  O  O9  1  0.02436300  0.37310900  0.36545900  1
  F  F10  1  0.17029000  0.82971000  0.25000000  1
  F  F11  1  0.55310700  0.19012000  0.45344900  1
  F  F12  1  0.19012000  0.55310700  0.95344900  1
  F  F13  1  0.80988000  0.44689300  0.04655100  1
  F  F14  1  0.44689300  0.80988000  0.54655100  1
  F  F15  1  0.82971000  0.17029000  0.75000000  1
