# generated using pymatgen
data_LiFePH2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.70429600
_cell_length_b   5.66110600
_cell_length_c   7.92191800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFePH2O5
_chemical_formula_sum   'Li2 Fe2 P2 H4 O10'
_cell_volume   210.97270428
_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  0.07536100  0.00000000  0.46707400  1
  Li  Li1  1  0.57536100  0.50000000  0.53292600  1
  Fe  Fe2  1  0.01643500  0.00000000  0.98206000  1
  Fe  Fe3  1  0.51643500  0.50000000  0.01794000  1
  P  P4  1  0.58554600  0.00000000  0.23568800  1
  P  P5  1  0.08554600  0.50000000  0.76431200  1
  H  H6  1  0.58739700  0.13851500  0.78221500  1
  H  H7  1  0.08739700  0.36148500  0.21778500  1
  H  H8  1  0.08739700  0.63851500  0.21778500  1
  H  H9  1  0.58739700  0.86148500  0.78221500  1
  O  O10  1  0.25736300  0.00000000  0.22147100  1
  O  O11  1  0.67057400  0.00000000  0.42327600  1
  O  O12  1  0.71348500  0.00000000  0.78001800  1
  O  O13  1  0.72104700  0.21689100  0.13921000  1
  O  O14  1  0.22104700  0.28310900  0.86079000  1
  O  O15  1  0.21348500  0.50000000  0.21998200  1
  O  O16  1  0.75736300  0.50000000  0.77852900  1
  O  O17  1  0.17057400  0.50000000  0.57672400  1
  O  O18  1  0.22104700  0.71689100  0.86079000  1
  O  O19  1  0.72104700  0.78310900  0.13921000  1
