# generated using pymatgen
data_Li2FeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.84961516
_cell_length_b   7.84304922
_cell_length_c   10.12516304
_cell_angle_alpha   90.00911162
_cell_angle_beta   89.99630370
_cell_angle_gamma   89.54014045
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeP2O7
_chemical_formula_sum   'Li8 Fe4 P8 O28'
_cell_volume   623.33474681
_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  0.22707200  0.72682300  0.26440600  1
  Li  Li1  1  0.22704100  0.72691600  0.76460500  1
  Li  Li2  1  0.27425200  0.22562800  0.23529800  1
  Li  Li3  1  0.27417000  0.22557200  0.73507800  1
  Li  Li4  1  0.72571700  0.77436000  0.23532900  1
  Li  Li5  1  0.72581000  0.77443400  0.73511500  1
  Li  Li6  1  0.77289100  0.27316900  0.26441300  1
  Li  Li7  1  0.77292200  0.27308900  0.76461300  1
  Fe  Fe8  1  0.00000300  0.00000800  0.49939400  1
  Fe  Fe9  1  0.50005900  0.49997200  0.99904700  1
  Fe  Fe10  1  0.00019000  0.00008600  0.99931300  1
  Fe  Fe11  1  0.49998600  0.49996800  0.49935000  1
  P  P12  1  0.14034200  0.35968500  0.45328600  1
  P  P13  1  0.14019400  0.35984600  0.95352800  1
  P  P14  1  0.36053700  0.86052200  0.04671600  1
  P  P15  1  0.36047700  0.86062000  0.54685200  1
  P  P16  1  0.63952800  0.13946100  0.04669100  1
  P  P17  1  0.63949200  0.13936000  0.54686400  1
  P  P18  1  0.85961100  0.64030600  0.45330200  1
  P  P19  1  0.85981600  0.64022700  0.95353300  1
  O  O20  1  0.99998900  0.49999800  0.40777200  1
  O  O21  1  0.00000100  0.50000800  0.90830700  1
  O  O22  1  0.50002600  0.99999500  0.09091300  1
  O  O23  1  0.49999600  0.99998000  0.59044200  1
  O  O24  1  0.15281300  0.34712100  0.10138800  1
  O  O25  1  0.15256900  0.34738100  0.60119200  1
  O  O26  1  0.34650500  0.84663100  0.39906400  1
  O  O27  1  0.34707100  0.84709200  0.89887300  1
  O  O28  1  0.65346600  0.15335500  0.39907500  1
  O  O29  1  0.65286500  0.15291700  0.89884800  1
  O  O30  1  0.84712500  0.65284900  0.10139500  1
  O  O31  1  0.84741000  0.65263200  0.60120900  1
  O  O32  1  0.08211400  0.19460600  0.38256700  1
  O  O33  1  0.08125400  0.19516200  0.88266400  1
  O  O34  1  0.19616100  0.92186500  0.11780400  1
  O  O35  1  0.19652700  0.92284400  0.61812100  1
  O  O36  1  0.30520000  0.41826400  0.38262200  1
  O  O37  1  0.30469300  0.41913500  0.88275900  1
  O  O38  1  0.42156800  0.69590300  0.11774600  1
  O  O39  1  0.42229900  0.69640600  0.61808400  1
  O  O40  1  0.57845900  0.30406500  0.11776500  1
  O  O41  1  0.57763200  0.30357000  0.61812100  1
  O  O42  1  0.69474900  0.58169100  0.38265600  1
  O  O43  1  0.69535300  0.58090000  0.88272600  1
  O  O44  1  0.80394300  0.07813300  0.11770300  1
  O  O45  1  0.80344700  0.07717800  0.61812200  1
  O  O46  1  0.91782000  0.80536200  0.38258500  1
  O  O47  1  0.91883400  0.80490800  0.88274400  1
