# generated using pymatgen
data_LiFeP2H5O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.55861000
_cell_length_b   7.63334641
_cell_length_c   8.01196145
_cell_angle_alpha   82.36331623
_cell_angle_beta   114.89563456
_cell_angle_gamma   111.24685030
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeP2H5O9
_chemical_formula_sum   'Li2 Fe2 P4 H10 O18'
_cell_volume   390.70670177
_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  0.21668300  0.16611800  0.24077900  1
  Li  Li1  1  0.78331700  0.83388200  0.75922100  1
  Fe  Fe2  1  0.77318900  0.26020700  0.03550300  1
  Fe  Fe3  1  0.22681100  0.73979300  0.96449700  1
  P  P4  1  0.31416300  0.08159900  0.72476700  1
  P  P5  1  0.95890800  0.36669800  0.74229500  1
  P  P6  1  0.04109200  0.63330200  0.25770500  1
  P  P7  1  0.68583700  0.91840100  0.27523300  1
  H  H8  1  0.70790000  0.13930600  0.43156200  1
  H  H9  1  0.08063800  0.20564400  0.54507000  1
  H  H10  1  0.63709100  0.42132600  0.27148400  1
  H  H11  1  0.69160300  0.45181200  0.54545300  1
  H  H12  1  0.49676700  0.52654700  0.27106500  1
  H  H13  1  0.50323300  0.47345300  0.72893500  1
  H  H14  1  0.30839700  0.54818800  0.45454700  1
  H  H15  1  0.36290900  0.57867400  0.72851600  1
  H  H16  1  0.91936200  0.79435600  0.45493000  1
  H  H17  1  0.29210000  0.86069400  0.56843800  1
  O  O18  1  0.83765200  0.04066600  0.19184400  1
  O  O19  1  0.58878500  0.04189500  0.33217700  1
  O  O20  1  0.91923700  0.25868700  0.57438000  1
  O  O21  1  0.93651400  0.23521900  0.90161800  1
  O  O22  1  0.49078900  0.24249600  0.84991900  1
  O  O23  1  0.19462600  0.16628200  0.53665900  1
  O  O24  1  0.82788100  0.47470800  0.18972700  1
  O  O25  1  0.52867300  0.40955100  0.31746300  1
  O  O26  1  0.78757500  0.46784800  0.68073500  1
  O  O27  1  0.21242500  0.53215200  0.31926500  1
  O  O28  1  0.47132700  0.59044900  0.68253700  1
  O  O29  1  0.17211900  0.52529200  0.81027300  1
  O  O30  1  0.80537400  0.83371800  0.46334100  1
  O  O31  1  0.50921100  0.75750400  0.15008100  1
  O  O32  1  0.06348600  0.76478100  0.09838200  1
  O  O33  1  0.08076300  0.74131300  0.42562000  1
  O  O34  1  0.41121500  0.95810500  0.66782300  1
  O  O35  1  0.16234800  0.95933400  0.80815600  1
