# generated using pymatgen
data_LiFePH2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.11479900
_cell_length_b   8.16108600
_cell_length_c   11.15119200
_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   'Li4 Fe4 P4 H8 O20'
_cell_volume   465.47656364
_cell_formula_units_Z   4
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  0.69708000  0.31734700  0.18759200  1
  Li  Li1  1  0.19708000  0.81734700  0.31240800  1
  Li  Li2  1  0.69708000  0.18265300  0.68759200  1
  Li  Li3  1  0.19708000  0.68265300  0.81240800  1
  Fe  Fe4  1  0.18753600  0.12834200  0.12258000  1
  Fe  Fe5  1  0.68753600  0.62834200  0.37742000  1
  Fe  Fe6  1  0.18753600  0.37165800  0.62258000  1
  Fe  Fe7  1  0.68753600  0.87165800  0.87742000  1
  P  P8  1  0.69541400  0.91605700  0.16966200  1
  P  P9  1  0.19541400  0.41605700  0.33033800  1
  P  P10  1  0.69541400  0.58394300  0.66966200  1
  P  P11  1  0.19541400  0.08394300  0.83033800  1
  H  H12  1  0.36407500  0.55613500  0.00243800  1
  H  H13  1  0.15022700  0.68234000  0.04051200  1
  H  H14  1  0.65022700  0.18234000  0.45948800  1
  H  H15  1  0.86407500  0.05613500  0.49756200  1
  H  H16  1  0.36407500  0.94386500  0.50243800  1
  H  H17  1  0.15022700  0.81766000  0.54051200  1
  H  H18  1  0.65022700  0.31766000  0.95948800  1
  H  H19  1  0.86407500  0.44386500  0.99756200  1
  O  O20  1  0.68698800  0.40493600  0.01752600  1
  O  O21  1  0.64728200  0.82656400  0.04954300  1
  O  O22  1  0.57359700  0.09109300  0.16642300  1
  O  O23  1  0.99525500  0.93248900  0.19337200  1
  O  O24  1  0.06881700  0.31655700  0.22694300  1
  O  O25  1  0.56881700  0.81655700  0.27305700  1
  O  O26  1  0.49525500  0.43248900  0.30662800  1
  O  O27  1  0.07359700  0.59109300  0.33357700  1
  O  O28  1  0.14728200  0.32656400  0.45045700  1
  O  O29  1  0.18698800  0.90493600  0.48247400  1
  O  O30  1  0.68698800  0.09506400  0.51752600  1
  O  O31  1  0.64728200  0.67343600  0.54954300  1
  O  O32  1  0.57359700  0.40890700  0.66642300  1
  O  O33  1  0.99525500  0.56751100  0.69337200  1
  O  O34  1  0.06881700  0.18344300  0.72694300  1
  O  O35  1  0.56881700  0.68344300  0.77305700  1
  O  O36  1  0.49525500  0.06751100  0.80662800  1
  O  O37  1  0.07359700  0.90890700  0.83357700  1
  O  O38  1  0.14728200  0.17343600  0.95045700  1
  O  O39  1  0.18698800  0.59506400  0.98247400  1
