# generated using pymatgen
data_LiFeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.41612600
_cell_length_b   6.95849500
_cell_length_c   9.33130325
_cell_angle_alpha   68.61715168
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeP2O7
_chemical_formula_sum   'Li4 Fe4 P8 O28'
_cell_volume   508.85787015
_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  0.57589800  0.19219800  0.91095800  1
  Li  Li1  1  0.07589800  0.80780200  0.58904200  1
  Li  Li2  1  0.92410200  0.19219800  0.41095800  1
  Li  Li3  1  0.42410200  0.80780200  0.08904200  1
  Fe  Fe4  1  0.93208100  0.31014500  0.80720600  1
  Fe  Fe5  1  0.43208100  0.68985500  0.69279400  1
  Fe  Fe6  1  0.56791900  0.31014500  0.30720600  1
  Fe  Fe7  1  0.06791900  0.68985500  0.19279400  1
  P  P8  1  0.71792900  0.52706300  0.52997200  1
  P  P9  1  0.21792900  0.47293700  0.97002800  1
  P  P10  1  0.73698400  0.93221900  0.24194800  1
  P  P11  1  0.23698400  0.06778100  0.25805200  1
  P  P12  1  0.76301600  0.93221900  0.74194800  1
  P  P13  1  0.26301600  0.06778100  0.75805200  1
  P  P14  1  0.78207100  0.52706300  0.02997200  1
  P  P15  1  0.28207100  0.47293700  0.47002800  1
  O  O16  1  0.58268600  0.50029800  0.64547600  1
  O  O17  1  0.88166600  0.52187000  0.60748800  1
  O  O18  1  0.78120900  0.36633200  0.95152700  1
  O  O19  1  0.28120900  0.63366800  0.54847300  1
  O  O20  1  0.38166600  0.47813000  0.89251200  1
  O  O21  1  0.69174500  0.74935000  0.40367700  1
  O  O22  1  0.08268600  0.49970200  0.85452400  1
  O  O23  1  0.24383600  0.87806700  0.20895000  1
  O  O24  1  0.90254800  0.88014900  0.19584700  1
  O  O25  1  0.60988000  0.94968100  0.12490900  1
  O  O26  1  0.80825500  0.74935000  0.90367700  1
  O  O27  1  0.10988000  0.05031900  0.37509100  1
  O  O28  1  0.25616400  0.87806700  0.70895000  1
  O  O29  1  0.59745200  0.88014900  0.69584700  1
  O  O30  1  0.40254800  0.11985100  0.30415300  1
  O  O31  1  0.74383600  0.12193300  0.29105000  1
  O  O32  1  0.89012000  0.94968100  0.62490900  1
  O  O33  1  0.19174500  0.25065000  0.09632300  1
  O  O34  1  0.39012000  0.05031900  0.87509100  1
  O  O35  1  0.09745200  0.11985100  0.80415300  1
  O  O36  1  0.75616400  0.12193300  0.79105000  1
  O  O37  1  0.91731400  0.50029800  0.14547600  1
  O  O38  1  0.30825500  0.25065000  0.59632300  1
  O  O39  1  0.61833400  0.52187000  0.10748800  1
  O  O40  1  0.71879100  0.36633200  0.45152700  1
  O  O41  1  0.21879100  0.63366800  0.04847300  1
  O  O42  1  0.11833400  0.47813000  0.39251200  1
  O  O43  1  0.41731400  0.49970200  0.35452400  1
