# generated using pymatgen
data_Li5Fe4(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.76434900
_cell_length_b   9.80606052
_cell_length_c   11.09501432
_cell_angle_alpha   89.96229177
_cell_angle_beta   78.41890613
_cell_angle_gamma   89.98127352
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe4(P2O7)4
_chemical_formula_sum   'Li10 Fe8 P16 O56'
_cell_volume   1040.71741715
_cell_formula_units_Z   2
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  0.12170200  0.28654300  0.54856800  1
  Li  Li1  1  0.08946300  0.89089900  0.97387600  1
  Li  Li2  1  0.40856100  0.39151400  0.02751100  1
  Li  Li3  1  0.38596900  0.79384100  0.45442900  1
  Li  Li4  1  0.58785100  0.60492900  0.96823200  1
  Li  Li5  1  0.85552300  0.41208500  0.04647200  1
  Li  Li6  1  0.64497200  0.91094900  0.95241900  1
  Li  Li7  1  0.91073300  0.10600300  0.03082400  1
  Li  Li8  1  0.82018900  0.41272600  0.54981900  1
  Li  Li9  1  0.88625500  0.71684400  0.45449400  1
  Fe  Fe10  1  0.20950400  0.07867600  0.33006200  1
  Fe  Fe11  1  0.24959900  0.79361300  0.17741200  1
  Fe  Fe12  1  0.25545700  0.28943700  0.82192800  1
  Fe  Fe13  1  0.29282100  0.57721200  0.66989700  1
  Fe  Fe14  1  0.70305600  0.41971100  0.32565000  1
  Fe  Fe15  1  0.75277600  0.71524200  0.17423600  1
  Fe  Fe16  1  0.74291000  0.21360400  0.82558200  1
  Fe  Fe17  1  0.79083900  0.93047000  0.66789400  1
  P  P18  1  0.02317300  0.54940000  0.25029700  1
  P  P19  1  0.11963800  0.28902400  0.11647300  1
  P  P20  1  0.06006500  0.07366600  0.76227100  1
  P  P21  1  0.12357700  0.85325700  0.57490900  1
  P  P22  1  0.37759600  0.35419700  0.42507000  1
  P  P23  1  0.43880500  0.57363500  0.23879600  1
  P  P24  1  0.52605000  0.94672900  0.24255200  1
  P  P25  1  0.38032300  0.78967200  0.88256900  1
  P  P26  1  0.61549800  0.20565300  0.11718800  1
  P  P27  1  0.47373100  0.05147600  0.74447300  1
  P  P28  1  0.56225200  0.42641500  0.75794300  1
  P  P29  1  0.62145600  0.64968200  0.57554200  1
  P  P30  1  0.87789500  0.14696700  0.42804300  1
  P  P31  1  0.93923600  0.92625200  0.24245000  1
  P  P32  1  0.88199900  0.70903900  0.88116000  1
  P  P33  1  0.97661200  0.44898500  0.75947600  1
  O  O34  1  0.01180800  0.57332700  0.38472000  1
  O  O35  1  0.03350200  0.15885500  0.43774200  1
  O  O36  1  0.09289600  0.91775100  0.26631300  1
  O  O37  1  0.11143400  0.41111400  0.21476800  1
  O  O38  1  0.10614200  0.65855500  0.16444200  1
  O  O39  1  0.17963900  0.17093100  0.17893700  1
  O  O40  1  0.22353400  0.33741000  0.99741200  1
  O  O41  1  0.02082200  0.73971800  0.91027800  1
  O  O42  1  0.12816300  0.93741600  0.69825600  1
  O  O43  1  0.06447100  0.06333200  0.89671600  1
  O  O44  1  0.13306800  0.46383100  0.77636600  1
  O  O45  1  0.19244000  0.71649000  0.59325900  1
  O  O46  1  0.15390800  0.19470000  0.70603100  1
  O  O47  1  0.21343400  0.92852400  0.46662100  1
  O  O48  1  0.28728700  0.42863900  0.53406400  1
  O  O49  1  0.34619900  0.69546200  0.29482700  1
  O  O50  1  0.30873700  0.21730700  0.40794500  1
  O  O51  1  0.36826200  0.96382600  0.22361700  1
  O  O52  1  0.36691700  0.43860500  0.30191900  1
  O  O53  1  0.43671100  0.56413400  0.10396800  1
  O  O54  1  0.47697000  0.23886700  0.08943600  1
  O  O55  1  0.27515400  0.83599000  0.00220300  1
  O  O56  1  0.32158300  0.66998200  0.82026500  1
  O  O57  1  0.38679200  0.91128400  0.78592200  1
  O  O58  1  0.41007800  0.41435200  0.73197500  1
  O  O59  1  0.39513100  0.15769200  0.83888100  1
  O  O60  1  0.46922500  0.65880900  0.55986700  1
  O  O61  1  0.53459100  0.89663000  0.36724000  1
  O  O62  1  0.47316600  0.07696700  0.61384500  1
  O  O63  1  0.53305400  0.34668800  0.42730100  1
  O  O64  1  0.60825500  0.86381300  0.13367500  1
  O  O65  1  0.58842600  0.58054000  0.26776600  1
  O  O66  1  0.59443200  0.09760000  0.22903400  1
  O  O67  1  0.69199100  0.32608900  0.16840800  1
  O  O68  1  0.71930600  0.14086000  0.00560300  1
  O  O69  1  0.52270500  0.76819800  0.91112600  1
  O  O70  1  0.56274800  0.43040300  0.89340200  1
  O  O71  1  0.61625300  0.57407000  0.70543000  1
  O  O72  1  0.62277800  0.02830200  0.78021100  1
  O  O73  1  0.69221500  0.78541500  0.58950000  1
  O  O74  1  0.66765000  0.32285500  0.69093100  1
  O  O75  1  0.71654000  0.56134400  0.47749100  1
  O  O76  1  0.79203600  0.06534600  0.53212600  1
  O  O77  1  0.84829700  0.80945000  0.30524900  1
  O  O78  1  0.81888900  0.28953200  0.40875600  1
  O  O79  1  0.87549500  0.52535700  0.21445900  1
  O  O80  1  0.93466700  0.93442500  0.10801300  1
  O  O81  1  0.87761200  0.06843000  0.30066700  1
  O  O82  1  0.97646600  0.26787300  0.08956600  1
  O  O83  1  0.77877100  0.64165800  0.99179200  1
  O  O84  1  0.80793400  0.82826300  0.82755300  1
  O  O85  1  0.89305200  0.36321100  0.86437200  1
  O  O86  1  0.90641600  0.59826500  0.76917800  1
  O  O87  1  0.91120600  0.08340600  0.73380200  1
  O  O88  1  0.96842200  0.83978000  0.56827200  1
  O  O89  1  0.97045200  0.40112400  0.63144900  1
