# generated using pymatgen
data_Li2FeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07146500
_cell_length_b   8.50338000
_cell_length_c   14.03935883
_cell_angle_alpha   65.59292073
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeP2O7
_chemical_formula_sum   'Li8 Fe4 P8 O28'
_cell_volume   551.33491132
_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  0.24168400  0.04488800  0.82573700  1
  Li  Li1  1  0.22091100  0.50591800  0.57610500  1
  Li  Li2  1  0.25831600  0.04488800  0.32573700  1
  Li  Li3  1  0.74168400  0.95511200  0.67426300  1
  Li  Li4  1  0.77908900  0.49408200  0.42389500  1
  Li  Li5  1  0.75831600  0.95511200  0.17426300  1
  Li  Li6  1  0.72091100  0.49408200  0.92389500  1
  Li  Li7  1  0.27908900  0.50591800  0.07610500  1
  Fe  Fe8  1  0.25590200  0.22058700  0.52130400  1
  Fe  Fe9  1  0.24409800  0.22058700  0.02130400  1
  Fe  Fe10  1  0.75590200  0.77941300  0.97869600  1
  Fe  Fe11  1  0.74409800  0.77941300  0.47869600  1
  P  P12  1  0.23849300  0.80785000  0.62287900  1
  P  P13  1  0.76150700  0.19215000  0.37712100  1
  P  P14  1  0.73849300  0.19215000  0.87712100  1
  P  P15  1  0.26150700  0.80785000  0.12287900  1
  P  P16  1  0.26491500  0.67128400  0.35302000  1
  P  P17  1  0.76491500  0.32871600  0.14698000  1
  P  P18  1  0.23508500  0.67128400  0.85302000  1
  P  P19  1  0.73508500  0.32871600  0.64698000  1
  O  O20  1  0.87248400  0.27444000  0.94239100  1
  O  O21  1  0.44162400  0.16568800  0.89873700  1
  O  O22  1  0.94162400  0.83431200  0.60126300  1
  O  O23  1  0.55837600  0.83431200  0.10126300  1
  O  O24  1  0.59189600  0.18380700  0.14224700  1
  O  O25  1  0.93880500  0.69925500  0.86159400  1
  O  O26  1  0.71733400  0.33852300  0.25858400  1
  O  O27  1  0.87524800  0.02856000  0.88015200  1
  O  O28  1  0.56119500  0.69925500  0.36159400  1
  O  O29  1  0.28266600  0.66147700  0.74141600  1
  O  O30  1  0.37248400  0.72556000  0.55760900  1
  O  O31  1  0.37524800  0.97144000  0.61984800  1
  O  O32  1  0.78266600  0.33852300  0.75858400  1
  O  O33  1  0.05837600  0.16568800  0.39873700  1
  O  O34  1  0.12751600  0.72556000  0.05760900  1
  O  O35  1  0.82886200  0.50785700  0.56836400  1
  O  O36  1  0.67113800  0.50785700  0.06836400  1
  O  O37  1  0.32886200  0.49214300  0.93163600  1
  O  O38  1  0.21733400  0.66147700  0.24141600  1
  O  O39  1  0.90810400  0.18380700  0.64224700  1
  O  O40  1  0.17113800  0.49214300  0.43163600  1
  O  O41  1  0.12475200  0.97144000  0.11984800  1
  O  O42  1  0.62475200  0.02856000  0.38015200  1
  O  O43  1  0.09189600  0.81619300  0.35775300  1
  O  O44  1  0.40810400  0.81619300  0.85775300  1
  O  O45  1  0.43880500  0.30074500  0.63840600  1
  O  O46  1  0.62751600  0.27444000  0.44239100  1
  O  O47  1  0.06119500  0.30074500  0.13840600  1
