# generated using pymatgen
data_Li6Mn5(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.22273900
_cell_length_b   10.69110702
_cell_length_c   13.20790143
_cell_angle_alpha   88.00672634
_cell_angle_beta   106.44226636
_cell_angle_gamma   114.09691396
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Mn5(P2O7)4
_chemical_formula_sum   'Li12 Mn10 P16 O56'
_cell_volume   1135.34700504
_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  0.87881300  0.39028000  0.67483000  1
  Li  Li1  1  0.10746500  0.13835500  0.55516400  1
  Li  Li2  1  0.12118700  0.60972000  0.32517000  1
  Li  Li3  1  0.50000000  0.50000000  0.50000000  1
  Li  Li4  1  0.91088900  0.87052300  0.94510900  1
  Li  Li5  1  0.12762100  0.60532100  0.83040300  1
  Li  Li6  1  0.08911100  0.12947700  0.05489100  1
  Li  Li7  1  0.80881600  0.99142500  0.72601800  1
  Li  Li8  1  0.19118400  0.00857500  0.27398200  1
  Li  Li9  1  0.87237900  0.39467900  0.16959700  1
  Li  Li10  1  0.50000000  0.50000000  0.00000000  1
  Li  Li11  1  0.89253500  0.86164500  0.44483600  1
  Mn  Mn12  1  0.90134000  0.29417800  0.89023400  1
  Mn  Mn13  1  0.48799000  0.75641000  0.06866000  1
  Mn  Mn14  1  0.49684100  0.76008200  0.56984000  1
  Mn  Mn15  1  0.51201000  0.24359000  0.93134000  1
  Mn  Mn16  1  0.81414800  0.01456000  0.24068300  1
  Mn  Mn17  1  0.50315900  0.23991800  0.43016000  1
  Mn  Mn18  1  0.18585200  0.98544000  0.75931700  1
  Mn  Mn19  1  0.90136300  0.29911300  0.39495700  1
  Mn  Mn20  1  0.09863700  0.70088700  0.60504300  1
  Mn  Mn21  1  0.09866000  0.70582200  0.10976600  1
  P  P22  1  0.80589100  0.55986500  0.89840200  1
  P  P23  1  0.20047300  0.44283500  0.60230300  1
  P  P24  1  0.81812900  0.70141200  0.70939700  1
  P  P25  1  0.71724400  0.03808200  0.97188400  1
  P  P26  1  0.44864200  0.81090700  0.81382700  1
  P  P27  1  0.71389000  0.03812700  0.46992400  1
  P  P28  1  0.80875900  0.70189300  0.21093800  1
  P  P29  1  0.54332400  0.19183700  0.68299000  1
  P  P30  1  0.19124100  0.29810700  0.78906200  1
  P  P31  1  0.79952700  0.55716500  0.39769700  1
  P  P32  1  0.28611000  0.96187300  0.53007600  1
  P  P33  1  0.45667600  0.80816300  0.31701000  1
  P  P34  1  0.19410900  0.44013500  0.10159800  1
  P  P35  1  0.18187100  0.29858800  0.29060300  1
  P  P36  1  0.28275600  0.96191800  0.02811600  1
  P  P37  1  0.55135800  0.18909300  0.18617300  1
  O  O38  1  0.91184200  0.49458100  0.37356700  1
  O  O39  1  0.28090900  0.39324700  0.21173700  1
  O  O40  1  0.27332600  0.80890000  0.76015500  1
  O  O41  1  0.71909100  0.60675300  0.78826300  1
  O  O42  1  0.08815800  0.50541900  0.62643300  1
  O  O43  1  0.66463200  0.45645200  0.44074700  1
  O  O44  1  0.29093600  0.39928300  0.71250700  1
  O  O45  1  0.09192700  0.30752000  0.53123500  1
  O  O46  1  0.68418000  0.68368000  0.60622100  1
  O  O47  1  0.54458400  0.96077500  0.88222700  1
  O  O48  1  0.55663900  0.82773300  0.23765100  1
  O  O49  1  0.44336100  0.17226700  0.76234900  1
  O  O50  1  0.32279700  0.31764800  0.89428300  1
  O  O51  1  0.14812400  0.96454100  0.57642700  1
  O  O52  1  0.06092300  0.36014500  0.29924700  1
  O  O53  1  0.33302000  0.54091700  0.06172400  1
  O  O54  1  0.70483700  0.96468800  0.07293400  1
  O  O55  1  0.54521700  0.81568100  0.73646300  1
  O  O56  1  0.67720300  0.68235200  0.10571700  1
  O  O57  1  0.66698000  0.45908300  0.93827600  1
  O  O58  1  0.52854600  0.29104900  0.59933000  1
  O  O59  1  0.85187600  0.03545900  0.42357300  1
  O  O60  1  0.14072800  0.96537000  0.06615300  1
  O  O61  1  0.08888500  0.30528400  0.02973700  1
  O  O62  1  0.90807300  0.69248000  0.46876500  1
  O  O63  1  0.72667400  0.19110000  0.23984500  1
  O  O64  1  0.08366700  0.14728300  0.23810600  1
  O  O65  1  0.08179100  0.50386900  0.12403700  1
  O  O66  1  0.31582000  0.31632000  0.39377900  1
  O  O67  1  0.53753800  0.96069900  0.38222800  1
  O  O68  1  0.89644100  0.85025200  0.26707900  1
  O  O69  1  0.85927200  0.03463000  0.93384700  1
  O  O70  1  0.71356900  0.96476500  0.57063800  1
  O  O71  1  0.33536800  0.54354800  0.55925300  1
  O  O72  1  0.45478300  0.18431900  0.26353700  1
  O  O73  1  0.91111500  0.69471600  0.97026300  1
  O  O74  1  0.72565300  0.18574600  0.47919500  1
  O  O75  1  0.91633300  0.85271700  0.76189400  1
  O  O76  1  0.91820900  0.49613100  0.87596300  1
  O  O77  1  0.93600800  0.64700200  0.20325600  1
  O  O78  1  0.27432500  0.78331400  0.26396600  1
  O  O79  1  0.72740500  0.18545900  0.97943900  1
  O  O80  1  0.47145400  0.70895100  0.40067000  1
  O  O81  1  0.70906400  0.60071700  0.28749300  1
  O  O82  1  0.46246200  0.03930100  0.61777200  1
  O  O83  1  0.27434700  0.81425400  0.52080500  1
  O  O84  1  0.29516300  0.03531200  0.92706600  1
  O  O85  1  0.43676000  0.70322000  0.89391400  1
  O  O86  1  0.27259500  0.81454100  0.02056100  1
  O  O87  1  0.93907700  0.63985500  0.70075300  1
  O  O88  1  0.72567500  0.21668600  0.73603400  1
  O  O89  1  0.28643100  0.03523500  0.42936200  1
  O  O90  1  0.56324000  0.29678000  0.10608600  1
  O  O91  1  0.06399200  0.35299800  0.79674400  1
  O  O92  1  0.10355900  0.14974800  0.73292100  1
  O  O93  1  0.45541600  0.03922500  0.11777300  1
