# generated using pymatgen
data_Li4Fe3P3O12F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.44988400
_cell_length_b   8.44988400
_cell_length_c   8.44988400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Fe3P3O12F
_chemical_formula_sum   'Li8 Fe6 P6 O24 F2'
_cell_volume   603.32627727
_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  0.14313000  0.14313000  0.14313000  1
  Li  Li1  1  0.14313000  0.85687000  0.85687000  1
  Li  Li2  1  0.35687000  0.35687000  0.64313000  1
  Li  Li3  1  0.35687000  0.64313000  0.35687000  1
  Li  Li4  1  0.64313000  0.35687000  0.35687000  1
  Li  Li5  1  0.64313000  0.64313000  0.64313000  1
  Li  Li6  1  0.85687000  0.14313000  0.85687000  1
  Li  Li7  1  0.85687000  0.85687000  0.14313000  1
  Fe  Fe8  1  0.00000000  0.50000000  0.25000000  1
  Fe  Fe9  1  0.00000000  0.50000000  0.75000000  1
  Fe  Fe10  1  0.25000000  0.00000000  0.50000000  1
  Fe  Fe11  1  0.50000000  0.25000000  0.00000000  1
  Fe  Fe12  1  0.50000000  0.75000000  0.00000000  1
  Fe  Fe13  1  0.75000000  0.00000000  0.50000000  1
  P  P14  1  0.00000000  0.25000000  0.50000000  1
  P  P15  1  0.00000000  0.75000000  0.50000000  1
  P  P16  1  0.25000000  0.50000000  0.00000000  1
  P  P17  1  0.50000000  0.00000000  0.25000000  1
  P  P18  1  0.50000000  0.00000000  0.75000000  1
  P  P19  1  0.75000000  0.50000000  0.00000000  1
  O  O20  1  0.11575100  0.35289900  0.59973800  1
  O  O21  1  0.11575100  0.64710100  0.40026200  1
  O  O22  1  0.09973800  0.14710100  0.38424900  1
  O  O23  1  0.09973800  0.85289900  0.61575100  1
  O  O24  1  0.14710100  0.38424900  0.09973800  1
  O  O25  1  0.14710100  0.61575100  0.90026200  1
  O  O26  1  0.35289900  0.40026200  0.88424900  1
  O  O27  1  0.35289900  0.59973800  0.11575100  1
  O  O28  1  0.40026200  0.11575100  0.64710100  1
  O  O29  1  0.40026200  0.88424900  0.35289900  1
  O  O30  1  0.38424900  0.09973800  0.14710100  1
  O  O31  1  0.38424900  0.90026200  0.85289900  1
  O  O32  1  0.61575100  0.09973800  0.85289900  1
  O  O33  1  0.61575100  0.90026200  0.14710100  1
  O  O34  1  0.59973800  0.11575100  0.35289900  1
  O  O35  1  0.59973800  0.88424900  0.64710100  1
  O  O36  1  0.64710100  0.40026200  0.11575100  1
  O  O37  1  0.64710100  0.59973800  0.88424900  1
  O  O38  1  0.85289900  0.38424900  0.90026200  1
  O  O39  1  0.85289900  0.61575100  0.09973800  1
  O  O40  1  0.90026200  0.14710100  0.61575100  1
  O  O41  1  0.90026200  0.85289900  0.38424900  1
  O  O42  1  0.88424900  0.35289900  0.40026200  1
  O  O43  1  0.88424900  0.64710100  0.59973800  1
  F  F44  1  0.00000000  0.00000000  0.00000000  1
  F  F45  1  0.50000000  0.50000000  0.50000000  1
