# generated using pymatgen
data_Li2FeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13860374
_cell_length_b   8.81460526
_cell_length_c   13.22749281
_cell_angle_alpha   96.01048066
_cell_angle_beta   100.42838067
_cell_angle_gamma   89.02742935
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeP2O7
_chemical_formula_sum   'Li8 Fe4 P8 O28'
_cell_volume   585.99919481
_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  0.67611300  0.60312000  0.41020700  1
  Li  Li1  1  0.17829800  0.10278800  0.40892400  1
  Li  Li2  1  0.50649400  0.21235900  0.08941000  1
  Li  Li3  1  0.00845600  0.71224900  0.09125500  1
  Li  Li4  1  0.49300400  0.78767800  0.90868500  1
  Li  Li5  1  0.99282500  0.28785900  0.91080500  1
  Li  Li6  1  0.32167300  0.39725600  0.59148800  1
  Li  Li7  1  0.82326500  0.89664400  0.58934900  1
  Fe  Fe8  1  0.25003800  0.75015400  0.49979200  1
  Fe  Fe9  1  0.50072300  0.49999900  0.99947900  1
  Fe  Fe10  1  0.74980400  0.24984500  0.50035800  1
  Fe  Fe11  1  0.99946100  0.99986300  0.00017400  1
  P  P12  1  0.83408400  0.57918900  0.63180800  1
  P  P13  1  0.33557800  0.07886400  0.63091900  1
  P  P14  1  0.96375400  0.62265900  0.86883700  1
  P  P15  1  0.46329700  0.12254200  0.86823400  1
  P  P16  1  0.03617900  0.37731000  0.13198100  1
  P  P17  1  0.53723300  0.87764900  0.13089800  1
  P  P18  1  0.16387400  0.42082400  0.36927600  1
  P  P19  1  0.66591200  0.92104100  0.36802600  1
  O  O20  1  0.84880300  0.64877700  0.75032500  1
  O  O21  1  0.35404800  0.14878200  0.74940500  1
  O  O22  1  0.14444700  0.35036400  0.25080100  1
  O  O23  1  0.65239400  0.85208000  0.24950200  1
  O  O24  1  0.26569700  0.60287700  0.88111900  1
  O  O25  1  0.76579500  0.10374800  0.88212000  1
  O  O26  1  0.71248100  0.41833700  0.61908200  1
  O  O27  1  0.21397900  0.91806100  0.61841200  1
  O  O28  1  0.28541700  0.58158200  0.38124000  1
  O  O29  1  0.78752500  0.08191000  0.38143700  1
  O  O30  1  0.73367800  0.39641300  0.11785600  1
  O  O31  1  0.23532600  0.89717700  0.11862900  1
  O  O32  1  0.88805900  0.77150800  0.92746000  1
  O  O33  1  0.38532100  0.27121800  0.92657700  1
  O  O34  1  0.64941000  0.69151900  0.57254700  1
  O  O35  1  0.14996600  0.19140200  0.57244600  1
  O  O36  1  0.34985900  0.30857500  0.42787400  1
  O  O37  1  0.85013900  0.80837700  0.42722400  1
  O  O38  1  0.11399800  0.22875400  0.07344200  1
  O  O39  1  0.61325600  0.72867800  0.07241700  1
  O  O40  1  0.88805000  0.42045300  0.39797100  1
  O  O41  1  0.38844100  0.91957800  0.39503500  1
  O  O42  1  0.17668100  0.51535600  0.10485900  1
  O  O43  1  0.67597500  0.01538400  0.10230200  1
  O  O44  1  0.82478100  0.48497900  0.89737900  1
  O  O45  1  0.32348700  0.98444900  0.89563800  1
  O  O46  1  0.11127600  0.58037500  0.60456400  1
  O  O47  1  0.61164600  0.07939400  0.60243200  1
