# generated using pymatgen
data_Li5Ti12O24
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.99322721
_cell_length_b   5.99324959
_cell_length_c   53.86653266
_cell_angle_alpha   59.95563641
_cell_angle_beta   59.95543479
_cell_angle_gamma   59.99463170
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Ti12O24
_chemical_formula_sum   'Li15 Ti36 O72'
_cell_volume   1367.15364330
_cell_formula_units_Z   3
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  0.12399398  0.12399034  0.01422087  1
  Li  Li1  1  0.12551025  0.12550637  0.12483054  1
  Li  Li2  1  0.12530866  0.12530422  0.34712589  1
  Li  Li3  1  0.12493441  0.12492868  0.45836413  1
  Li  Li4  1  0.87446877  0.87447325  0.20851198  1
  Li  Li5  1  0.12496467  0.12496130  0.56945910  1
  Li  Li6  1  0.87638778  0.87639114  0.31898108  1
  Li  Li7  1  0.12496909  0.12496369  0.68056803  1
  Li  Li8  1  0.87502952  0.87503431  0.43054262  1
  Li  Li9  1  0.12473360  0.12473415  0.79175712  1
  Li  Li10  1  0.87503404  0.87503923  0.54164833  1
  Li  Li11  1  0.87507717  0.87508018  0.65274719  1
  Li  Li12  1  0.87454595  0.87454919  0.76403330  1
  Li  Li13  1  0.87424121  0.87424124  0.87524797  1
  Li  Li14  1  0.87606010  0.87606577  0.98575944  1
  Ti  Ti15  1  0.99629396  0.49953968  0.05606746  1
  Ti  Ti16  1  0.50012145  0.50011961  0.99995697  1
  Ti  Ti17  1  0.49953966  0.99629104  0.05606802  1
  Ti  Ti18  1  0.99993937  0.49999767  0.16667621  1
  Ti  Ti19  1  0.49951375  0.49951449  0.05607734  1
  Ti  Ti20  1  0.50183831  0.50183999  0.11050650  1
  Ti  Ti21  1  0.49999875  0.99994054  0.16667579  1
  Ti  Ti22  1  0.00441746  0.50048534  0.27718543  1
  Ti  Ti23  1  0.50000184  0.50000089  0.16667278  1
  Ti  Ti24  1  0.49814388  0.49814874  0.22283237  1
  Ti  Ti25  1  0.50048659  0.00442004  0.27718552  1
  Ti  Ti26  1  0.50047228  0.50047190  0.27717883  1
  Ti  Ti27  1  0.00036935  0.50006731  0.38883887  1
  Ti  Ti28  1  0.50175713  0.50175158  0.33274581  1
  Ti  Ti29  1  0.50006639  0.00036918  0.38883916  1
  Ti  Ti30  1  0.50001430  0.50001472  0.38883810  1
  Ti  Ti31  1  0.99980005  0.50001159  0.50002222  1
  Ti  Ti32  1  0.49982928  0.49983037  0.44449986  1
  Ti  Ti33  1  0.50001251  0.99980166  0.50002166  1
  Ti  Ti34  1  0.49999025  0.49998752  0.50002409  1
  Ti  Ti35  1  0.49992631  0.49992990  0.55557661  1
  Ti  Ti36  1  0.50000521  0.00008027  0.61109878  1
  Ti  Ti37  1  0.50001711  0.50001907  0.61109923  1
  Ti  Ti38  1  -0.00004968  0.49997756  0.72223034  1
  Ti  Ti39  1  0.50012615  0.50012454  0.66662617  1
  Ti  Ti40  1  0.49997869  -0.00004877  0.72222989  1
  Ti  Ti41  1  0.00008098  0.50000428  0.61109893  1
  Ti  Ti42  1  0.50001588  0.50001643  0.72222461  1
  Ti  Ti43  1  -0.00007196  0.49801410  0.83377865  1
  Ti  Ti44  1  0.49945003  0.49946045  0.77796290  1
  Ti  Ti45  1  0.49801250  -0.00007280  0.83377939  1
  Ti  Ti46  1  0.49802594  0.49802581  0.83378712  1
  Ti  Ti47  1  0.49752564  0.49750759  0.88971194  1
  Ti  Ti48  1  0.50041758  0.00379261  0.94392982  1
  Ti  Ti49  1  0.50045015  0.50045080  0.94392422  1
  Ti  Ti50  1  0.00379325  0.50041812  0.94392941  1
  O  O51  1  0.26391501  0.26391304  0.02910167  1
  O  O52  1  0.26320741  0.26320869  0.07895337  1
  O  O53  1  0.26380558  0.71025713  0.02911398  1
  O  O54  1  0.71025981  0.26380449  0.02911346  1
  O  O55  1  0.26259091  0.26259259  0.14033294  1
  O  O56  1  0.29748721  0.73498252  0.08141121  1
  O  O57  1  0.26720022  0.26720127  0.18873796  1
  O  O58  1  0.73498035  0.29749359  0.08141120  1
  O  O59  1  0.26239657  0.71188262  0.14035046  1
  O  O60  1  0.73813609  0.73813716  0.03171243  1
  O  O61  1  0.73476484  0.73476218  0.08144209  1
  O  O62  1  0.71188747  0.26239635  0.14035028  1
  O  O63  1  0.26512031  0.26512146  0.25190957  1
  O  O64  1  0.28802426  0.73760655  0.19299424  1
  O  O65  1  0.73760338  0.28803055  0.19299425  1
  O  O66  1  0.26158697  0.26158882  0.30170124  1
  O  O67  1  0.26494280  0.70259338  0.25193545  1
  O  O68  1  0.73274422  0.73274282  0.14461794  1
  O  O69  1  0.73742950  0.73743320  0.19300926  1
  O  O70  1  0.70259666  0.26494111  0.25193543  1
  O  O71  1  0.26256880  0.26256587  0.36258309  1
  O  O72  1  0.28892253  0.73628766  0.30428253  1
  O  O73  1  0.26233666  0.26233798  0.41253871  1
  O  O74  1  0.73628883  0.28892134  0.30428249  1
  O  O75  1  0.26264830  0.71161311  0.36256725  1
  O  O76  1  0.73670888  0.73671076  0.25441383  1
  O  O77  1  0.73627785  0.73627552  0.30428073  1
  O  O78  1  0.71161807  0.26264465  0.36256728  1
  O  O79  1  0.26238015  0.26237692  0.47364446  1
  O  O80  1  0.28775796  0.73740381  0.41526037  1
  O  O81  1  0.26239324  0.26238997  0.52361696  1
  O  O82  1  0.73740340  0.28776281  0.41526028  1
  O  O83  1  0.26260492  0.71238663  0.47362029  1
  O  O84  1  0.73740627  0.73740853  0.36533003  1
  O  O85  1  0.73757828  0.73758130  0.41524166  1
  O  O86  1  0.71239001  0.26260236  0.47362024  1
  O  O87  1  0.26221520  0.26221497  0.58477249  1
  O  O88  1  0.28749342  0.73755939  0.52635566  1
  O  O89  1  0.26238307  0.26238435  0.63472948  1
  O  O90  1  0.26244738  0.71250976  0.58474225  1
  O  O91  1  0.73755557  0.28749795  0.52635549  1
  O  O92  1  0.73759974  0.73760312  0.47638267  1
  O  O93  1  0.71251072  0.26244636  0.58474235  1
  O  O94  1  0.73779255  0.73779640  0.52633283  1
  O  O95  1  0.26238447  0.26238242  0.69586282  1
  O  O96  1  0.28756983  0.73750395  0.63748326  1
  O  O97  1  0.73750231  0.28756982  0.63748343  1
  O  O98  1  0.26256351  0.26256174  0.74578658  1
  O  O99  1  0.26255829  0.71242895  0.69584131  1
  O  O100  1  0.73764942  0.73764828  0.58748270  1
  O  O101  1  0.73769027  0.73768955  0.63745607  1
  O  O102  1  0.71243305  0.26255528  0.69584082  1
  O  O103  1  0.26265097  0.26265202  0.80686106  1
  O  O104  1  0.28802327  0.73740520  0.74856004  1
  O  O105  1  0.26656771  0.26656988  0.85557818  1
  O  O106  1  0.73739856  0.28803006  0.74856018  1
  O  O107  1  0.26275813  0.71289955  0.80685255  1
  O  O108  1  0.73767345  0.73767346  0.69858524  1
  O  O109  1  0.73761901  0.73762347  0.74853412  1
  O  O110  1  0.71289507  0.26276162  0.80685243  1
  O  O111  1  0.26499410  0.26499163  0.91854709  1
  O  O112  1  0.28880070  0.73786712  0.85949834  1
  O  O113  1  0.26490967  0.70302945  0.91855934  1
  O  O114  1  0.73787206  0.28879665  0.85949835  1
  O  O115  1  0.26189527  0.26189604  0.96827213  1
  O  O116  1  0.73717019  0.73716738  0.80982567  1
  O  O117  1  0.70304015  0.26490273  0.91855923  1
  O  O118  1  0.73785808  0.73785747  0.85949520  1
  O  O119  1  0.28969798  0.73620441  0.97089070  1
  O  O120  1  0.73620317  0.28970187  0.97089061  1
  O  O121  1  0.73702909  0.73703011  0.92097482  1
  O  O122  1  0.73606126  0.73606191  0.97090630  1
