# generated using pymatgen
data_Li14Ni9(P2O7)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.69446455
_cell_length_b   9.57745237
_cell_length_c   12.71343854
_cell_angle_alpha   69.67727044
_cell_angle_beta   116.23440890
_cell_angle_gamma   108.64100558
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li14Ni9(P2O7)8
_chemical_formula_sum   'Li14 Ni9 P16 O56'
_cell_volume   1073.76888759
_cell_formula_units_Z   1
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  0.02573900  0.13632400  0.90223400  1
  Li  Li1  1  0.10057700  0.91758500  0.57054000  1
  Li  Li2  1  0.38175800  0.05329100  0.89763900  1
  Li  Li3  1  0.10484000  0.41899300  0.07274400  1
  Li  Li4  1  0.49767400  0.37616800  0.81840900  1
  Li  Li5  1  0.38227300  0.55009000  0.39995900  1
  Li  Li6  1  0.46458700  0.87732200  0.32614700  1
  Li  Li7  1  0.53541300  0.12267800  0.67385300  1
  Li  Li8  1  0.61772700  0.44991000  0.60004100  1
  Li  Li9  1  0.50232600  0.62383200  0.18159100  1
  Li  Li10  1  0.89516000  0.58100700  0.92725600  1
  Li  Li11  1  0.61824200  0.94670900  0.10236100  1
  Li  Li12  1  0.89942300  0.08241500  0.42946000  1
  Li  Li13  1  0.97426100  0.86367600  0.09776600  1
  Ni  Ni14  1  0.22117500  0.70150600  0.91905600  1
  Ni  Ni15  1  0.00000000  0.50000000  0.50000000  1
  Ni  Ni16  1  0.25861700  0.56809500  0.70056400  1
  Ni  Ni17  1  0.21910900  0.19776600  0.42053400  1
  Ni  Ni18  1  0.74957200  0.93244400  0.80561400  1
  Ni  Ni19  1  0.25042800  0.06755600  0.19438600  1
  Ni  Ni20  1  0.78089100  0.80223400  0.57946600  1
  Ni  Ni21  1  0.74138300  0.43190500  0.29943600  1
  Ni  Ni22  1  0.77882500  0.29849400  0.08094400  1
  P  P23  1  0.05253100  0.96405600  0.77599600  1
  P  P24  1  0.30072700  0.37054900  0.98525900  1
  P  P25  1  0.05371200  0.46703300  0.27726900  1
  P  P26  1  0.19526700  0.23510900  0.65367700  1
  P  P27  1  0.46694400  0.80147700  0.86890100  1
  P  P28  1  0.29012000  0.85699100  0.48137400  1
  P  P29  1  0.20017500  0.73317600  0.15276800  1
  P  P30  1  0.53351900  0.70259600  0.62928200  1
  P  P31  1  0.46648100  0.29740400  0.37071800  1
  P  P32  1  0.79982500  0.26682400  0.84723200  1
  P  P33  1  0.70988000  0.14300900  0.51862600  1
  P  P34  1  0.53305600  0.19852300  0.13109900  1
  P  P35  1  0.80473300  0.76489100  0.34632300  1
  P  P36  1  0.94628800  0.53296700  0.72273100  1
  P  P37  1  0.69927300  0.62945100  0.01474100  1
  P  P38  1  0.94746900  0.03594400  0.22400400  1
  O  O39  1  0.01982500  0.60059900  0.83285000  1
  O  O40  1  0.19649100  0.91921300  0.85897300  1
  O  O41  1  0.04264400  0.55670600  0.65523300  1
  O  O42  1  0.08924200  0.14841700  0.72809800  1
  O  O43  1  0.31242700  0.73885900  0.79066100  1
  O  O44  1  0.46124900  0.84407100  0.97338600  1
  O  O45  1  0.26497000  0.98461500  0.51243200  1
  O  O46  1  0.19673300  0.70340300  0.51737600  1
  O  O47  1  0.29455500  0.40535600  0.85759900  1
  O  O48  1  0.17130300  0.39917200  0.60615900  1
  O  O49  1  0.09199500  0.64980400  0.22728700  1
  O  O50  1  0.01613600  0.10499300  0.33319900  1
  O  O51  1  0.13714100  0.15544000  0.55030300  1
  O  O52  1  0.29480200  0.89603100  0.35627500  1
  O  O53  1  0.17465600  0.89487900  0.10722300  1
  O  O54  1  0.54837200  0.92801000  0.79751100  1
  O  O55  1  0.19622700  0.41885600  0.35985300  1
  O  O56  1  0.54014900  0.65657000  0.92520100  1
  O  O57  1  0.34637600  0.21803600  0.74034400  1
  O  O58  1  0.45317400  0.84190100  0.57463600  1
  O  O59  1  0.13864600  0.65238800  0.04960500  1
  O  O60  1  0.04236100  0.05476100  0.15773100  1
  O  O61  1  0.45663900  0.57126700  0.70209700  1
  O  O62  1  0.35099100  0.70944100  0.23896500  1
  O  O63  1  0.71348600  0.49939700  0.97823600  1
  O  O64  1  0.80053500  0.77721700  0.98116800  1
  O  O65  1  0.31222800  0.23236100  0.29437500  1
  O  O66  1  0.53871900  0.66339100  0.52264000  1
  O  O67  1  0.46128100  0.33660900  0.47736000  1
  O  O68  1  0.68777200  0.76763900  0.70562500  1
  O  O69  1  0.19946500  0.22278300  0.01883200  1
  O  O70  1  0.28651400  0.50060300  0.02176400  1
  O  O71  1  0.64900900  0.29055900  0.76103500  1
  O  O72  1  0.54336100  0.42873300  0.29790300  1
  O  O73  1  0.95763900  0.94523900  0.84226900  1
  O  O74  1  0.86135400  0.34761200  0.95039500  1
  O  O75  1  0.54682600  0.15809900  0.42536400  1
  O  O76  1  0.65362400  0.78196400  0.25965600  1
  O  O77  1  0.45985000  0.34343000  0.07479900  1
  O  O78  1  0.80377300  0.58114400  0.64014700  1
  O  O79  1  0.45162800  0.07199000  0.20248900  1
  O  O80  1  0.82534400  0.10512100  0.89277700  1
  O  O81  1  0.70519800  0.10396900  0.64372500  1
  O  O82  1  0.86285900  0.84456000  0.44969700  1
  O  O83  1  0.98386400  0.89500700  0.66680100  1
  O  O84  1  0.90800500  0.35019600  0.77271300  1
  O  O85  1  0.82869700  0.60082800  0.39384100  1
  O  O86  1  0.70544500  0.59464400  0.14240100  1
  O  O87  1  0.80326700  0.29659700  0.48262400  1
  O  O88  1  0.73503000  0.01538500  0.48756800  1
  O  O89  1  0.53875100  0.15592900  0.02661400  1
  O  O90  1  0.68757300  0.26114100  0.20933900  1
  O  O91  1  0.91075800  0.85158300  0.27190200  1
  O  O92  1  0.95735600  0.44329400  0.34476700  1
  O  O93  1  0.80350900  0.08078700  0.14102700  1
  O  O94  1  0.98017500  0.39940100  0.16715000  1
