# generated using pymatgen
data_Li2FeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.32542183
_cell_length_b   18.53893000
_cell_length_c   7.70910538
_cell_angle_alpha   90.00000000
_cell_angle_beta   92.78788600
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeP2O7
_chemical_formula_sum   'Li16 Fe8 P16 O56'
_cell_volume   1188.44907791
_cell_formula_units_Z   8
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  0.00524300  0.54448500  0.67696300  1
  Li  Li1  1  0.01443500  0.29607700  0.17282100  1
  Li  Li2  1  0.06082900  0.79482100  0.34509300  1
  Li  Li3  1  0.11643800  0.10110800  0.68023000  1
  Li  Li4  1  0.14672400  0.56219000  0.13512100  1
  Li  Li5  1  0.24607000  0.36421800  0.40800400  1
  Li  Li6  1  0.26812400  0.94348700  0.11187000  1
  Li  Li7  1  0.50806000  0.18275800  0.78508400  1
  Li  Li8  1  0.49194000  0.68275800  0.21491600  1
  Li  Li9  1  0.73187600  0.44348700  0.88813000  1
  Li  Li10  1  0.75393000  0.86421800  0.59199600  1
  Li  Li11  1  0.85327600  0.06219000  0.86487900  1
  Li  Li12  1  0.88356200  0.60110800  0.31977000  1
  Li  Li13  1  0.93917100  0.29482100  0.65490700  1
  Li  Li14  1  0.98556500  0.79607700  0.82717900  1
  Li  Li15  1  0.99475700  0.04448500  0.32303700  1
  Fe  Fe16  1  0.41735800  0.53776800  0.88080500  1
  Fe  Fe17  1  0.41183800  0.79099400  0.59633300  1
  Fe  Fe18  1  0.41061200  0.29187000  0.10196500  1
  Fe  Fe19  1  0.40645700  0.04245500  0.40911000  1
  Fe  Fe20  1  0.59354300  0.54245500  0.59089000  1
  Fe  Fe21  1  0.58938800  0.79187000  0.89803500  1
  Fe  Fe22  1  0.58816200  0.29099400  0.40366700  1
  Fe  Fe23  1  0.58264200  0.03776800  0.11919500  1
  P  P24  1  0.13566500  0.40761200  0.92968300  1
  P  P25  1  0.13615200  0.92454700  0.55297200  1
  P  P26  1  0.23795600  0.63312900  0.55407500  1
  P  P27  1  0.21475500  0.20218700  0.40141000  1
  P  P28  1  0.23981900  0.69589700  0.90780000  1
  P  P29  1  0.23364700  0.13114200  0.05887500  1
  P  P30  1  0.43392200  0.37307800  0.74158200  1
  P  P31  1  0.43435200  0.95565800  0.76240900  1
  P  P32  1  0.56564800  0.45565800  0.23759100  1
  P  P33  1  0.56607800  0.87307800  0.25841800  1
  P  P34  1  0.76635300  0.63114200  0.94112500  1
  P  P35  1  0.76018100  0.19589700  0.09220000  1
  P  P36  1  0.78524500  0.70218700  0.59859000  1
  P  P37  1  0.76204400  0.13312900  0.44592500  1
  P  P38  1  0.86384800  0.42454700  0.44702800  1
  P  P39  1  0.86433500  0.90761200  0.07031700  1
  O  O40  1  0.96160800  0.39990900  0.86428700  1
  O  O41  1  0.96424400  0.91772600  0.60313100  1
  O  O42  1  0.09894100  0.59514500  0.45344400  1
  O  O43  1  0.08418900  0.25027400  0.46797600  1
  O  O44  1  0.10680800  0.09399600  0.94034100  1
  O  O45  1  0.15526400  0.66040200  0.73037300  1
  O  O46  1  0.11431800  0.74032500  0.99100200  1
  O  O47  1  0.13837500  0.16494300  0.22122600  1
  O  O48  1  0.18778200  0.48663700  0.96578000  1
  O  O49  1  0.20951500  0.85214800  0.49516200  1
  O  O50  1  0.16870700  0.98873000  0.42992500  1
  O  O51  1  0.18464900  0.35302700  0.07468200  1
  O  O52  1  0.24246800  0.38408400  0.76516700  1
  O  O53  1  0.24034400  0.94676600  0.73166500  1
  O  O54  1  0.32629400  0.19018200  0.96738100  1
  O  O55  1  0.27533600  0.14158900  0.52419300  1
  O  O56  1  0.30881500  0.63319200  0.02313600  1
  O  O57  1  0.31413800  0.69508700  0.45621800  1
  O  O58  1  0.36065400  0.57872700  0.63518900  1
  O  O59  1  0.35087700  0.24753800  0.32986300  1
  O  O60  1  0.37390100  0.74090500  0.83066300  1
  O  O61  1  0.34616300  0.07727000  0.16065100  1
  O  O62  1  0.43025700  0.33113800  0.57403500  1
  O  O63  1  0.44581200  0.97969200  0.95015100  1
  O  O64  1  0.50314800  0.51301100  0.35855400  1
  O  O65  1  0.51329800  0.44720900  0.72853700  1
  O  O66  1  0.48785200  0.38208800  0.26378400  1
  O  O67  1  0.51106900  0.32914400  0.89158800  1
  O  O68  1  0.48893100  0.82914400  0.10841200  1
  O  O69  1  0.51214800  0.88208800  0.73621600  1
  O  O70  1  0.48670200  0.94720900  0.27146300  1
  O  O71  1  0.49685200  0.01301100  0.64144600  1
  O  O72  1  0.55418800  0.47969200  0.04984900  1
  O  O73  1  0.56974300  0.83113800  0.42596500  1
  O  O74  1  0.65383700  0.57727000  0.83934900  1
  O  O75  1  0.62609900  0.24090500  0.16933700  1
  O  O76  1  0.64912300  0.74753800  0.67013700  1
  O  O77  1  0.63934600  0.07872700  0.36481100  1
  O  O78  1  0.68586200  0.19508700  0.54378200  1
  O  O79  1  0.69118500  0.13319200  0.97686400  1
  O  O80  1  0.72466400  0.64158900  0.47580700  1
  O  O81  1  0.67370600  0.69018200  0.03261900  1
  O  O82  1  0.75965600  0.44676600  0.26833500  1
  O  O83  1  0.75753200  0.88408400  0.23483300  1
  O  O84  1  0.81535100  0.85302700  0.92531800  1
  O  O85  1  0.83129300  0.48873000  0.57007500  1
  O  O86  1  0.79048500  0.35214800  0.50483800  1
  O  O87  1  0.81221800  0.98663700  0.03422000  1
  O  O88  1  0.86162500  0.66494300  0.77877400  1
  O  O89  1  0.88568200  0.24032500  0.00899800  1
  O  O90  1  0.84473600  0.16040200  0.26962700  1
  O  O91  1  0.89319200  0.59399600  0.05965900  1
  O  O92  1  0.91581100  0.75027400  0.53202400  1
  O  O93  1  0.90105900  0.09514500  0.54655600  1
  O  O94  1  0.03575600  0.41772600  0.39686900  1
  O  O95  1  0.03839200  0.89990900  0.13571300  1
