# generated using pymatgen
data_Li3Fe2(OF)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.77090220
_cell_length_b   13.77090220
_cell_length_c   13.77090238
_cell_angle_alpha   13.44776080
_cell_angle_beta   13.44776080
_cell_angle_gamma   13.44776441
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe2(OF)3
_chemical_formula_sum   'Li3 Fe2 O3 F3'
_cell_volume   122.87743660
_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  0.85631200  0.85631200  0.85631200  1
  Li  Li1  1  0.73362500  0.73362500  0.73362500  1
  Li  Li2  1  0.12850600  0.12850600  0.12850600  1
  Fe  Fe3  1  0.99737200  0.99737200  0.99737200  1
  Fe  Fe4  1  0.25626100  0.25626100  0.25626100  1
  O  O5  1  0.91519700  0.91519700  0.91519700  1
  O  O6  1  0.68481200  0.68481200  0.68481200  1
  O  O7  1  0.30313800  0.30313800  0.30313800  1
  F  F8  1  0.80954600  0.80954600  0.80954600  1
  F  F9  1  0.20165000  0.20165000  0.20165000  1
  F  F10  1  0.08140800  0.08140800  0.08140800  1
