# generated using pymatgen
data_Li5Mn9(P2O7)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.68571800
_cell_length_b   11.01132133
_cell_length_c   12.67754248
_cell_angle_alpha   100.89286439
_cell_angle_beta   111.02351509
_cell_angle_gamma   108.28362042
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Mn9(P2O7)8
_chemical_formula_sum   'Li5 Mn9 P16 O56'
_cell_volume   1126.89321445
_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  0.83948200  0.47823700  0.69831500  1
  Li  Li1  1  0.15505000  0.52006100  0.78391800  1
  Li  Li2  1  0.02379400  0.01727600  0.99040000  1
  Li  Li3  1  0.84242400  0.48101500  0.20427600  1
  Li  Li4  1  0.15960600  0.52047900  0.31105500  1
  Mn  Mn5  1  0.74777400  0.74695800  0.80272500  1
  Mn  Mn6  1  0.60130500  0.20938400  0.41679900  1
  Mn  Mn7  1  0.26541300  0.26824600  0.70345100  1
  Mn  Mn8  1  0.38485800  0.78389100  0.07286300  1
  Mn  Mn9  1  0.00048800  0.00066000  0.49834400  1
  Mn  Mn10  1  0.61128000  0.21319300  0.92311500  1
  Mn  Mn11  1  0.73685900  0.73211800  0.29505300  1
  Mn  Mn12  1  0.39941500  0.79054800  0.57803000  1
  Mn  Mn13  1  0.25360600  0.25855600  0.19859500  1
  P  P14  1  0.10259600  0.78675200  0.83936000  1
  P  P15  1  0.35598400  0.54642900  0.62950300  1
  P  P16  1  0.26173300  0.95503600  0.22071300  1
  P  P17  1  0.34801600  0.29495200  0.48612100  1
  P  P18  1  0.89019500  0.20290500  0.65179700  1
  P  P19  1  0.65246400  0.45516000  0.86663000  1
  P  P20  1  0.74267900  0.05302000  0.27445000  1
  P  P21  1  0.35093500  0.29846900  0.98664000  1
  P  P22  1  0.64335000  0.69769100  0.00929600  1
  P  P23  1  0.25623500  0.94442200  0.71992500  1
  P  P24  1  0.11076400  0.79870400  0.34383800  1
  P  P25  1  0.34861800  0.54307700  0.13557500  1
  P  P26  1  0.65707600  0.70758700  0.51432500  1
  P  P27  1  0.73984000  0.04789300  0.77664300  1
  P  P28  1  0.64724000  0.45471400  0.36797200  1
  P  P29  1  0.89717800  0.21363300  0.15770200  1
  O  O30  1  0.98415600  0.81865600  0.88506000  1
  O  O31  1  0.27332700  0.84525900  0.94074200  1
  O  O32  1  0.04019200  0.63964600  0.76420300  1
  O  O33  1  0.50876900  0.67908200  0.71846300  1
  O  O34  1  0.74746500  0.40966800  0.46464600  1
  O  O35  1  0.75436100  0.78181200  0.96532500  1
  O  O36  1  0.48449200  0.71423000  0.98231000  1
  O  O37  1  0.20515500  0.04091200  0.15010400  1
  O  O38  1  0.26774200  0.46788000  0.68996000  1
  O  O39  1  0.42529200  0.45149700  0.57124800  1
  O  O40  1  0.95985100  0.35265600  0.72095000  1
  O  O41  1  0.72371200  0.17670900  0.33331400  1
  O  O42  1  0.57731900  0.54093800  0.92815100  1
  O  O43  1  0.73363600  0.53380700  0.80342400  1
  O  O44  1  0.24840500  0.28253100  0.35736100  1
  O  O45  1  0.42357900  0.03421600  0.33371600  1
  O  O46  1  0.88449200  0.11373600  0.23789200  1
  O  O47  1  0.72731400  0.14397000  0.54478400  1
  O  O48  1  0.58973400  0.94672600  0.16774000  1
  O  O49  1  0.01886200  0.17026900  0.61178200  1
  O  O50  1  0.23614300  0.21383500  0.53398700  1
  O  O51  1  0.49817700  0.26610300  0.51043300  1
  O  O52  1  0.25553600  0.28634000  0.85531800  1
  O  O53  1  0.26267500  0.82553400  0.14994900  1
  O  O54  1  0.49803200  0.32040400  0.77797100  1
  O  O55  1  0.75649200  0.41292300  0.96329300  1
  O  O56  1  0.88023100  0.11127400  0.73616200  1
  O  O57  1  0.81167400  0.97859900  0.35974000  1
  O  O58  1  0.18873400  0.02156100  0.63711200  1
  O  O59  1  0.12037000  0.89169400  0.26036900  1
  O  O60  1  0.24307700  0.58645800  0.04140800  1
  O  O61  1  0.73541900  0.17692800  0.84517500  1
  O  O62  1  0.50470400  0.67612100  0.22371600  1
  O  O63  1  0.74191300  0.71353600  0.14123100  1
  O  O64  1  0.50549900  0.73524600  0.48682000  1
  O  O65  1  0.98296800  0.83154400  0.38502000  1
  O  O66  1  0.76985000  0.78800000  0.46673300  1
  O  O67  1  0.41101400  0.04786000  0.82695100  1
  O  O68  1  0.27430500  0.85638300  0.45020400  1
  O  O69  1  0.11501000  0.88458800  0.75719600  1
  O  O70  1  0.57796600  0.96516500  0.66461400  1
  O  O71  1  0.75372400  0.72241500  0.64457200  1
  O  O72  1  0.26894400  0.46482800  0.20005600  1
  O  O73  1  0.41865400  0.45420800  0.07079300  1
  O  O74  1  0.27189700  0.82010500  0.65814300  1
  O  O75  1  0.04000700  0.64882200  0.27478000  1
  O  O76  1  0.58323800  0.55058900  0.43165300  1
  O  O77  1  0.80251100  0.96625500  0.84985800  1
  O  O78  1  0.73362600  0.53316100  0.30651200  1
  O  O79  1  0.50743700  0.27809500  0.01310400  1
  O  O80  1  0.23650200  0.21326300  0.02804300  1
  O  O81  1  0.25563800  0.58776400  0.52922500  1
  O  O82  1  0.49130800  0.32375600  0.27920700  1
  O  O83  1  0.95558900  0.35983100  0.23336600  1
  O  O84  1  0.72764100  0.15378300  0.05449100  1
  O  O85  1  0.01963000  0.18680000  0.11418900  1
