# generated using pymatgen
data_LiFe2(PO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.41476000
_cell_length_b   6.36602400
_cell_length_c   8.15662900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2(PO4)2
_chemical_formula_sum   'Li2 Fe4 P4 O16'
_cell_volume   281.16301562
_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  0.00674300  0.42063700  1
  Li  Li1  1  0.00000000  0.99325700  0.92063700  1
  Fe  Fe2  1  0.50000000  0.74143100  0.75033200  1
  Fe  Fe3  1  0.00000000  0.25856900  0.25033200  1
  Fe  Fe4  1  0.50000000  0.26234400  0.75490000  1
  Fe  Fe5  1  0.00000000  0.73765600  0.25490000  1
  P  P6  1  0.50000000  0.51255600  0.40043600  1
  P  P7  1  0.00000000  0.48744400  0.90043600  1
  P  P8  1  0.50000000  0.98706500  0.09401200  1
  P  P9  1  0.00000000  0.01293500  0.59401200  1
  O  O10  1  0.50000000  0.71340800  0.50390100  1
  O  O11  1  0.00000000  0.68988900  0.00657500  1
  O  O12  1  0.73559100  0.51329300  0.28831600  1
  O  O13  1  0.26440900  0.51329300  0.28831600  1
  O  O14  1  0.23559100  0.48670700  0.78831600  1
  O  O15  1  0.76440900  0.48670700  0.78831600  1
  O  O16  1  0.50000000  0.31011100  0.50657500  1
  O  O17  1  0.00000000  0.28659200  0.00390100  1
  O  O18  1  0.50000000  0.18700700  0.98935100  1
  O  O19  1  0.00000000  0.20897200  0.49059900  1
  O  O20  1  0.73219500  0.98762800  0.21342300  1
  O  O21  1  0.26780500  0.98762800  0.21342300  1
  O  O22  1  0.23219500  0.01237200  0.71342300  1
  O  O23  1  0.76780500  0.01237200  0.71342300  1
  O  O24  1  0.50000000  0.79102800  0.99059900  1
  O  O25  1  0.00000000  0.81299300  0.48935100  1
