# generated using pymatgen
data_LiMn2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.70631317
_cell_length_b   13.10418449
_cell_length_c   13.20360767
_cell_angle_alpha   83.75446196
_cell_angle_beta   70.73092670
_cell_angle_gamma   70.60259348
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2O4
_chemical_formula_sum   'Li18 Mn36 O72'
_cell_volume   1341.28261115
_cell_formula_units_Z   18
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  0.78862081  0.75019512  0.41976590  1
  Li  Li1  1  0.46285638  0.74952626  0.07953652  1
  Li  Li2  1  0.20507004  0.91564421  0.91307425  1
  Li  Li3  1  0.79511920  0.08237243  0.08523166  1
  Li  Li4  1  0.88256173  0.91628609  0.58640260  1
  Li  Li5  1  0.20689197  0.58592951  0.24980252  1
  Li  Li6  1  0.45788190  0.08565459  0.74963848  1
  Li  Li7  1  0.87655418  0.25096232  0.25123986  1
  Li  Li8  1  0.54208409  0.25055644  0.91883077  1
  Li  Li9  1  0.79284069  0.41323722  0.75071872  1
  Li  Li10  1  0.54442158  0.91318256  0.25084701  1
  Li  Li11  1  0.11631929  0.41640213  0.08587934  1
  Li  Li12  1  0.46700424  0.41581960  0.41394229  1
  Li  Li13  1  0.20952613  0.24962247  0.58086587  1
  Li  Li14  1  0.88460099  0.58294216  0.91391893  1
  Li  Li15  1  0.53668972  0.58344797  0.58638139  1
  Li  Li16  1  0.12299228  0.75027848  0.75050315  1
  Li  Li17  1  0.11795184  0.08273557  0.41470569  1
  Mn  Mn18  1  0.82871187  0.33437743  0.49718954  1
  Mn  Mn19  1  0.99546617  0.16867474  0.83486846  1
  Mn  Mn20  1  0.16823430  0.83070516  0.33352543  1
  Mn  Mn21  1  0.67219414  0.50219682  0.16453668  1
  Mn  Mn22  1  0.16286066  0.16626096  0.00318606  1
  Mn  Mn23  1  0.16741206  0.99730682  0.16625347  1
  Mn  Mn24  1  0.50309863  0.66882848  0.33596305  1
  Mn  Mn25  1  0.16818785  0.66668245  0.50468074  1
  Mn  Mn26  1  0.50525586  0.16573492  0.33087355  1
  Mn  Mn27  1  0.16925175  0.33088576  0.83403172  1
  Mn  Mn28  1  0.00176305  0.83120911  0.16571784  1
  Mn  Mn29  1  0.84168568  0.83405359  0.99554493  1
  Mn  Mn30  1  0.67537574  0.16485478  0.49682508  1
  Mn  Mn31  1  0.33076737  0.49802297  0.83395535  1
  Mn  Mn32  1  0.50481050  0.33212875  0.16830585  1
  Mn  Mn33  1  0.83713673  0.33403701  0.00406499  1
  Mn  Mn34  1  0.32452050  0.83430565  0.50522296  1
  Mn  Mn35  1  0.99827218  0.49982731  0.49960786  1
  Mn  Mn36  1  0.82521221  0.50223252  0.33578376  1
  Mn  Mn37  1  0.83856884  0.66623624  0.66945564  1
  Mn  Mn38  1  0.32539343  0.16661224  0.16912396  1
  Mn  Mn39  1  0.16080338  0.33189713  0.33070479  1
  Mn  Mn40  1  0.49621301  0.83213672  0.66838325  1
  Mn  Mn41  1  0.50026545  0.50057771  0.00056765  1
  Mn  Mn42  1  0.67796202  0.83109272  0.83059396  1
  Mn  Mn43  1  0.50332943  0.99952079  0.99879696  1
  Mn  Mn44  1  0.49969956  0.00027870  0.50073413  1
  Mn  Mn45  1  0.49996019  0.66574526  0.83115345  1
  Mn  Mn46  1  0.16872894  0.49749094  0.66715691  1
  Mn  Mn47  1  0.16280785  0.00231092  0.66557496  1
  Mn  Mn48  1  0.82911044  0.66885902  0.16471372  1
  Mn  Mn49  1  0.16389301  0.66548932  0.99477976  1
  Mn  Mn50  1  0.83892847  0.99781970  0.33438273  1
  Mn  Mn51  1  0.83556730  0.16927613  0.66634842  1
  Mn  Mn52  1  0.50073429  0.33114029  0.66603141  1
  Mn  Mn53  1  0.83676673  0.00225892  0.83466274  1
  O  O54  1  0.54889455  0.16883840  0.17197845  1
  O  O55  1  0.39253660  0.00683134  0.15910760  1
  O  O56  1  0.76286614  0.82363362  0.15016466  1
  O  O57  1  0.24172061  0.84389372  0.17294240  1
  O  O58  1  0.24710230  0.50920918  0.98822519  1
  O  O59  1  0.06684605  0.82430014  0.00534585  1
  O  O60  1  0.76269522  0.15727855  0.82786957  1
  O  O61  1  0.75654319  0.00830583  0.48882205  1
  O  O62  1  0.76117008  0.32478706  0.65172085  1
  O  O63  1  0.61421799  0.84063654  0.98811955  1
  O  O64  1  0.42455551  0.32275623  0.32222490  1
  O  O65  1  0.88806971  0.51071358  0.17765847  1
  O  O66  1  0.60510233  0.00609236  0.34096294  1
  O  O67  1  0.92604284  0.01068749  0.67695977  1
  O  O68  1  0.76472502  0.99072828  0.98910119  1
  O  O69  1  0.93500660  0.17619527  0.00096209  1
  O  O70  1  0.60998483  0.66938971  0.67213876  1
  O  O71  1  0.05328135  0.49443731  0.34096891  1
  O  O72  1  0.94095004  0.50657078  0.65970814  1
  O  O73  1  0.23630630  0.01016477  0.01225091  1
  O  O74  1  0.07159111  0.32386956  0.99597026  1
  O  O75  1  0.89800730  0.34681290  0.34336373  1
  O  O76  1  0.75841449  0.15308672  0.34164619  1
  O  O77  1  0.45256648  0.49611914  0.15880782  1
  O  O78  1  0.75477933  0.49048160  0.48990574  1
  O  O79  1  0.39042467  0.15909589  0.01084421  1
  O  O80  1  0.59153840  0.17414066  0.65160467  1
  O  O81  1  0.75328484  0.82115391  0.67516666  1
  O  O82  1  0.93822074  0.99205132  0.17663262  1
  O  O83  1  0.54984572  0.50569088  0.84117826  1
  O  O84  1  0.25031429  0.67378275  0.34928305  1
  O  O85  1  0.54638862  0.84075265  0.51150647  1
  O  O86  1  0.41471556  0.34266849  0.82440572  1
  O  O87  1  0.59967866  0.65652458  0.16711414  1
  O  O88  1  0.38370225  0.67733881  0.50627266  1
  O  O89  1  0.60218271  0.34058850  0.01160714  1
  O  O90  1  0.39766709  0.65916332  0.99017540  1
  O  O91  1  0.07451762  0.65729499  0.66150473  1
  O  O92  1  0.75567616  0.48989292  0.01048892  1
  O  O93  1  0.24416088  0.84551901  0.65865189  1
  O  O94  1  0.06460537  0.01087619  0.82369237  1
  O  O95  1  0.23403440  0.17429418  0.84949376  1
  O  O96  1  0.10632391  0.15703992  0.16064065  1
  O  O97  1  0.45474643  0.15904689  0.49004783  1
  O  O98  1  0.93579789  0.67762589  0.99616676  1
  O  O99  1  0.25166906  0.65376629  0.84009620  1
  O  O100  1  0.93974481  0.65919522  0.51079827  1
  O  O101  1  0.92008351  0.84178100  0.32364767  1
  O  O102  1  0.10881396  0.82424435  0.49602658  1
  O  O103  1  0.60104476  0.51105513  0.32287001  1
  O  O104  1  0.41263316  0.82356822  0.35037847  1
  O  O105  1  0.07577998  0.67323657  0.15141384  1
  O  O106  1  0.11274214  0.48937210  0.82401695  1
  O  O107  1  0.74395232  0.65682411  0.33346223  1
  O  O108  1  0.24056099  0.51064251  0.51306386  1
  O  O109  1  0.91562247  0.32369232  0.84933841  1
  O  O110  1  0.05702628  0.34112133  0.48908935  1
  O  O111  1  0.75291731  0.67141207  0.82248606  1
  O  O112  1  0.60511873  0.32360825  0.50543927  1
  O  O113  1  0.24510634  0.99068831  0.51112952  1
  O  O114  1  0.07592771  0.98873265  0.32356606  1
  O  O115  1  0.91282972  0.84703178  0.84215998  1
  O  O116  1  0.89037668  0.17641626  0.50314606  1
  O  O117  1  0.25170369  0.17273540  0.32200888  1
  O  O118  1  0.43312311  0.82301927  0.82245423  1
  O  O119  1  0.75274385  0.34520917  0.15805006  1
  O  O120  1  0.39385735  0.49188565  0.67649803  1
  O  O121  1  0.25234295  0.32171731  0.17474439  1
  O  O122  1  0.39515087  0.99474857  0.65930977  1
  O  O123  1  0.08316702  0.15647473  0.67214880  1
  O  O124  1  0.24088466  0.34454792  0.67386786  1
  O  O125  1  0.61208371  0.99403155  0.84039961  1
