# generated using pymatgen
data_TiAl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.22405384
_cell_length_b   24.93506999
_cell_length_c   47.67550445
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.89738821
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiAl3
_chemical_formula_sum   'Ti126 Al378'
_cell_volume   16647.2642102
_cell_formula_units_Z   126
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
  Ti  Ti1  1  0.124716  0.741233  0.330663  1
  Ti  Ti2  1  0.791773  0.575014  0.330886  1
  Ti  Ti3  1  0.886923  0.765931  0.286862  1
  Ti  Ti4  1  0.125057  0.241679  0.330754  1
  Ti  Ti5  1  0.220879  0.433115  0.286929  1
  Ti  Ti6  1  0.173366  0.587493  0.308157  1
  Ti  Ti7  1  0.601078  0.443297  0.266135  1
  Ti  Ti8  1  0.553785  0.599251  0.286453  1
  Ti  Ti9  1  0.506696  0.754041  0.308113  1
  Ti  Ti10  1  0.934067  0.110064  0.266014  1
  Ti  Ti11  1  0.886989  0.265978  0.286396  1
  Ti  Ti12  1  0.839783  0.420652  0.307705  1
  Ti  Ti13  1  0.220749  0.932422  0.286717  1
  Ti  Ti14  1  0.172154  0.087639  0.308204  1
  Ti  Ti15  1  0.457958  0.907964  0.330593  1
  Ti  Ti16  1  0.554299  0.099638  0.286857  1
  Ti  Ti17  1  0.506350  0.253429  0.308279  1
  Ti  Ti18  1  0.839047  0.920569  0.308806  1
  Ti  Ti19  1  0.982081  0.705802  0.397462  1
  Ti  Ti20  1  0.648655  0.539108  0.397374  1
  Ti  Ti21  1  0.744375  0.729446  0.352268  1
  Ti  Ti22  1  0.981877  0.205822  0.397389  1
  Ti  Ti23  1  0.077912  0.396208  0.352212  1
  Ti  Ti24  1  0.029271  0.551422  0.375084  1
  Ti  Ti25  1  0.458217  0.408008  0.330039  1
  Ti  Ti26  1  0.410454  0.563464  0.352785  1
  Ti  Ti27  1  0.362842  0.718088  0.375051  1
  Ti  Ti28  1  0.791653  0.074401  0.329941  1
  Ti  Ti29  1  0.743730  0.230185  0.352730  1
  Ti  Ti30  1  0.696612  0.384428  0.375536  1
  Ti  Ti31  1  0.078027  0.896370  0.352455  1
  Ti  Ti32  1  0.029901  0.051143  0.375520  1
  Ti  Ti33  1  0.315410  0.872328  0.397384  1
  Ti  Ti34  1  0.411417  0.062909  0.352453  1
  Ti  Ti35  1  0.362620  0.218191  0.375025  1
  Ti  Ti36  1  0.696091  0.884802  0.375020  1
  Ti  Ti37  1  0.838671  0.670010  0.464196  1
  Ti  Ti38  1  0.505314  0.503395  0.464264  1
  Ti  Ti39  1  0.600930  0.693956  0.419671  1
  Ti  Ti40  1  0.838664  0.170018  0.464202  1
  Ti  Ti41  1  0.934180  0.360660  0.419601  1
  Ti  Ti42  1  0.886675  0.515233  0.441941  1
  Ti  Ti43  1  0.315412  0.372511  0.397417  1
  Ti  Ti44  1  0.267621  0.527175  0.419578  1
  Ti  Ti45  1  0.219790  0.681936  0.442010  1
  Ti  Ti46  1  0.648515  0.039185  0.397446  1
  Ti  Ti47  1  0.601003  0.193784  0.419616  1
  Ti  Ti48  1  0.553064  0.348694  0.441892  1
  Ti  Ti49  1  0.934201  0.860479  0.419751  1
  Ti  Ti50  1  0.886518  0.015251  0.441838  1
  Ti  Ti51  1  0.172059  0.836671  0.464203  1
  Ti  Ti52  1  0.267547  0.027267  0.419632  1
  Ti  Ti53  1  0.219967  0.181972  0.441932  1
  Ti  Ti54  1  0.553276  0.848522  0.441885  1
  Ti  Ti55  1  0.695560  0.634057  0.531091  1
  Ti  Ti56  1  0.362233  0.467437  0.531064  1
  Ti  Ti57  1  0.457620  0.658016  0.486496  1
  Ti  Ti58  1  0.695551  0.134059  0.531082  1
  Ti  Ti59  1  0.790971  0.324684  0.486559  1
  Ti  Ti60  1  0.743201  0.479499  0.508788  1
  Ti  Ti61  1  0.171968  0.336732  0.464136  1
  Ti  Ti62  1  0.124261  0.491381  0.486501  1
  Ti  Ti63  1  0.076587  0.646071  0.508763  1
  Ti  Ti64  1  0.505362  0.003340  0.464161  1
  Ti  Ti65  1  0.457603  0.158061  0.486451  1
  Ti  Ti66  1  0.409953  0.312736  0.508811  1
  Ti  Ti67  1  0.790945  0.824707  0.486473  1
  Ti  Ti68  1  0.743283  0.979351  0.508804  1
  Ti  Ti69  1  0.028925  0.800728  0.531166  1
  Ti  Ti70  1  0.124394  0.991304  0.486534  1
  Ti  Ti71  1  0.076551  0.146077  0.508706  1
  Ti  Ti72  1  0.409908  0.812728  0.508731  1
  Ti  Ti73  1  0.552170  0.598460  0.598017  1
  Ti  Ti74  1  0.218858  0.431650  0.597947  1
  Ti  Ti75  1  0.314237  0.622170  0.553488  1
  Ti  Ti76  1  0.552341  0.098229  0.597797  1
  Ti  Ti77  1  0.647728  0.288782  0.553283  1
  Ti  Ti78  1  0.599876  0.443550  0.575714  1
  Ti  Ti79  1  0.028875  0.300770  0.531034  1
  Ti  Ti80  1  0.981044  0.455459  0.553384  1
  Ti  Ti81  1  0.933325  0.610329  0.575787  1
  Ti  Ti82  1  0.362232  0.967400  0.531014  1
  Ti  Ti83  1  0.314524  0.122107  0.553371  1
  Ti  Ti84  1  0.266557  0.276920  0.575555  1
  Ti  Ti85  1  0.647884  0.788715  0.553375  1
  Ti  Ti86  1  0.599899  0.943654  0.575596  1
  Ti  Ti87  1  0.885575  0.764864  0.597826  1
  Ti  Ti88  1  0.980941  0.955483  0.553334  1
  Ti  Ti89  1  0.933367  0.110088  0.575600  1
  Ti  Ti90  1  0.266706  0.776822  0.575652  1
  Ti  Ti91  1  0.408657  0.562613  0.665240  1
  Ti  Ti92  1  0.075259  0.395839  0.665135  1
  Ti  Ti93  1  0.171166  0.586295  0.619834  1
  Ti  Ti94  1  0.409193  0.063053  0.665448  1
  Ti  Ti95  1  0.504797  0.252660  0.620332  1
  Ti  Ti96  1  0.457013  0.407352  0.642501  1
  Ti  Ti97  1  0.885606  0.264903  0.597846  1
  Ti  Ti98  1  0.837734  0.419742  0.619895  1
  Ti  Ti99  1  0.790338  0.573929  0.642646  1
  Ti  Ti100  1  0.219074  0.931640  0.597895  1
  Ti  Ti101  1  0.170921  0.086330  0.619816  1
  Ti  Ti102  1  0.123711  0.240565  0.642448  1
  Ti  Ti103  1  0.504244  0.752926  0.619802  1
  Ti  Ti104  1  0.457046  0.907312  0.642369  1
  Ti  Ti105  1  0.742721  0.729654  0.665394  1
  Ti  Ti106  1  0.838316  0.919281  0.620293  1
  Ti  Ti107  1  0.789611  0.074537  0.642888  1
  Ti  Ti108  1  0.123032  0.741301  0.643110  1
  Ti  Ti109  1  0.265969  0.527359  0.729319  1
  Ti  Ti110  1  0.932816  0.360058  0.729400  1
  Ti  Ti111  1  0.027996  0.550618  0.687497  1
  Ti  Ti112  1  0.266597  0.027035  0.729341  1
  Ti  Ti113  1  0.361795  0.216715  0.686555  1
  Ti  Ti114  1  0.313660  0.371672  0.709104  1
  Ti  Ti115  1  0.742360  0.229090  0.664579  1
  Ti  Ti116  1  0.695154  0.382961  0.687084  1
  Ti  Ti117  1  0.646983  0.538434  0.709102  1
  Ti  Ti118  1  0.075798  0.895791  0.664513  1
  Ti  Ti119  1  0.028718  0.049765  0.687095  1
  Ti  Ti120  1  0.980114  0.205198  0.709150  1
  Ti  Ti121  1  0.361517  0.717511  0.687531  1
  Ti  Ti122  1  0.313689  0.871557  0.708997  1
  Ti  Ti123  1  0.600093  0.694520  0.729267  1
  Ti  Ti124  1  0.695324  0.883575  0.686486  1
  Ti  Ti125  1  0.647018  0.038047  0.708574  1
  Ti  Ti126  1  0.980153  0.704344  0.708452  1
  Al  Al127  1  0.220428  0.682809  0.287662  1
  Al  Al128  1  0.887298  0.516255  0.287665  1
  Al  Al129  1  0.839982  0.669731  0.307826  1
  Al  Al130  1  0.220141  0.182371  0.287392  1
  Al  Al131  1  0.173459  0.336648  0.307729  1
  Al  Al132  1  0.125684  0.491980  0.331261  1
  Al  Al133  1  0.552937  0.348139  0.286241  1
  Al  Al134  1  0.505250  0.504435  0.308638  1
  Al  Al135  1  0.459185  0.658491  0.331149  1
  Al  Al136  1  0.885730  0.014474  0.285911  1
  Al  Al137  1  0.838583  0.171046  0.308614  1
  Al  Al138  1  0.792114  0.325298  0.330927  1
  Al  Al139  1  0.172292  0.836482  0.307748  1
  Al  Al140  1  0.267470  0.026838  0.266875  1
  Al  Al141  1  0.553551  0.849340  0.287622  1
  Al  Al142  1  0.505822  0.003360  0.307686  1
  Al  Al143  1  0.459223  0.158388  0.331339  1
  Al  Al144  1  0.933995  0.860180  0.267187  1
  Al  Al145  1  0.030121  0.676083  0.296926  1
  Al  Al146  1  0.697809  0.509833  0.296884  1
  Al  Al147  1  0.648567  0.664710  0.319265  1
  Al  Al148  1  0.031040  0.176492  0.296703  1
  Al  Al149  1  0.981856  0.331444  0.319233  1
  Al  Al150  1  0.078499  0.521057  0.278206  1
  Al  Al151  1  0.363207  0.342583  0.296784  1
  Al  Al152  1  0.315676  0.498340  0.319389  1
  Al  Al153  1  0.411734  0.687680  0.278160  1
  Al  Al154  1  0.696350  0.009041  0.296627  1
  Al  Al155  1  0.649243  0.164746  0.319401  1
  Al  Al156  1  0.744155  0.355330  0.276960  1
  Al  Al157  1  0.981693  0.830829  0.320497  1
  Al  Al158  1  0.078000  0.021947  0.276098  1
  Al  Al159  1  0.363422  0.842627  0.296907  1
  Al  Al160  1  0.314887  0.997659  0.320339  1
  Al  Al161  1  0.411383  0.187348  0.278085  1
  Al  Al162  1  0.745370  0.854823  0.277601  1
  Al  Al163  1  0.075596  0.771791  0.277270  1
  Al  Al164  1  0.742811  0.604640  0.277504  1
  Al  Al165  1  0.696596  0.758931  0.296943  1
  Al  Al166  1  0.076029  0.271454  0.277436  1
  Al  Al167  1  0.030175  0.425369  0.296938  1
  Al  Al168  1  0.981813  0.581723  0.319479  1
  Al  Al169  1  0.410798  0.439140  0.276418  1
  Al  Al170  1  0.363295  0.592236  0.297096  1
  Al  Al171  1  0.314939  0.748379  0.319437  1
  Al  Al172  1  0.744046  0.105742  0.276354  1
  Al  Al173  1  0.696583  0.258893  0.297059  1
  Al  Al174  1  0.649575  0.414050  0.320532  1
  Al  Al175  1  0.030191  0.926097  0.297084  1
  Al  Al176  1  0.982704  0.080431  0.320372  1
  Al  Al177  1  0.409254  0.938507  0.277195  1
  Al  Al178  1  0.363500  0.092387  0.297092  1
  Al  Al179  1  0.314826  0.248217  0.319371  1
  Al  Al180  1  0.647922  0.914858  0.319335  1
  Al  Al181  1  0.077495  0.646315  0.352783  1
  Al  Al182  1  0.744595  0.479537  0.352775  1
  Al  Al183  1  0.696058  0.634679  0.375080  1
  Al  Al184  1  0.077299  0.146493  0.352897  1
  Al  Al185  1  0.029446  0.301383  0.375004  1
  Al  Al186  1  0.982292  0.455730  0.397164  1
  Al  Al187  1  0.410778  0.313164  0.352667  1
  Al  Al188  1  0.363017  0.467799  0.374858  1
  Al  Al189  1  0.315315  0.622666  0.397436  1
  Al  Al190  1  0.743694  0.980004  0.352870  1
  Al  Al191  1  0.696410  0.134387  0.374813  1
  Al  Al192  1  0.648579  0.289159  0.397444  1
  Al  Al193  1  0.030036  0.801163  0.375250  1
  Al  Al194  1  0.125347  0.992033  0.330929  1
  Al  Al195  1  0.410873  0.812950  0.352704  1
  Al  Al196  1  0.363272  0.967784  0.375178  1
  Al  Al197  1  0.315601  0.122508  0.397241  1
  Al  Al198  1  0.791654  0.825054  0.331120  1
  Al  Al199  1  0.886820  0.640604  0.363916  1
  Al  Al200  1  0.553031  0.473669  0.363951  1
  Al  Al201  1  0.505753  0.628596  0.386338  1
  Al  Al202  1  0.886210  0.140311  0.363891  1
  Al  Al203  1  0.839288  0.295130  0.386308  1
  Al  Al204  1  0.935253  0.485683  0.341591  1
  Al  Al205  1  0.220185  0.307320  0.363806  1
  Al  Al206  1  0.172282  0.461759  0.386185  1
  Al  Al207  1  0.268485  0.652613  0.341713  1
  Al  Al208  1  0.553372  0.973768  0.363749  1
  Al  Al209  1  0.505651  0.128509  0.386253  1
  Al  Al210  1  0.601473  0.319245  0.341624  1
  Al  Al211  1  0.838938  0.795070  0.386217  1
  Al  Al212  1  0.935183  0.985778  0.341702  1
  Al  Al213  1  0.220046  0.807090  0.363769  1
  Al  Al214  1  0.172699  0.961681  0.386261  1
  Al  Al215  1  0.268592  0.152408  0.341626  1
  Al  Al216  1  0.601803  0.819086  0.341702  1
  Al  Al217  1  0.934976  0.735132  0.341909  1
  Al  Al218  1  0.601582  0.568867  0.341875  1
  Al  Al219  1  0.553691  0.724084  0.363940  1
  Al  Al220  1  0.934826  0.235613  0.341822  1
  Al  Al221  1  0.887015  0.390764  0.363770  1
  Al  Al222  1  0.839189  0.545117  0.386331  1
  Al  Al223  1  0.268651  0.401947  0.341862  1
  Al  Al224  1  0.220026  0.557539  0.363998  1
  Al  Al225  1  0.172558  0.711784  0.386300  1
  Al  Al226  1  0.602027  0.068449  0.341825  1
  Al  Al227  1  0.553446  0.224145  0.364057  1
  Al  Al228  1  0.505672  0.378560  0.386060  1
  Al  Al229  1  0.887100  0.890741  0.364216  1
  Al  Al230  1  0.838969  0.045189  0.386040  1
  Al  Al231  1  0.268356  0.901776  0.341821  1
  Al  Al232  1  0.220302  0.057568  0.363966  1
  Al  Al233  1  0.172463  0.211878  0.386285  1
  Al  Al234  1  0.505880  0.878408  0.386218  1
  Al  Al235  1  0.934104  0.610607  0.419688  1
  Al  Al236  1  0.600696  0.444035  0.419750  1
  Al  Al237  1  0.553163  0.598619  0.441937  1
  Al  Al238  1  0.934002  0.110667  0.419715  1
  Al  Al239  1  0.886471  0.265316  0.441948  1
  Al  Al240  1  0.838798  0.419997  0.464255  1
  Al  Al241  1  0.267414  0.277326  0.419636  1
  Al  Al242  1  0.219765  0.431985  0.441910  1
  Al  Al243  1  0.172129  0.586590  0.464208  1
  Al  Al244  1  0.600711  0.943913  0.419624  1
  Al  Al245  1  0.553098  0.098621  0.441937  1
  Al  Al246  1  0.505431  0.253339  0.464186  1
  Al  Al247  1  0.886400  0.765242  0.441945  1
  Al  Al248  1  0.982298  0.955612  0.397328  1
  Al  Al249  1  0.267413  0.777215  0.419657  1
  Al  Al250  1  0.219894  0.931905  0.441923  1
  Al  Al251  1  0.172176  0.086640  0.464223  1
  Al  Al252  1  0.649043  0.789078  0.397194  1
  Al  Al253  1  0.743682  0.604581  0.430783  1
  Al  Al254  1  0.410381  0.437992  0.430754  1
  Al  Al255  1  0.362550  0.592615  0.453079  1
  Al  Al256  1  0.743756  0.104574  0.430735  1
  Al  Al257  1  0.695858  0.259303  0.453077  1
  Al  Al258  1  0.791621  0.449985  0.408584  1
  Al  Al259  1  0.076972  0.271308  0.430740  1
  Al  Al260  1  0.029328  0.425985  0.453015  1
  Al  Al261  1  0.124769  0.616526  0.408571  1
  Al  Al262  1  0.410343  0.937871  0.430782  1
  Al  Al263  1  0.362646  0.092649  0.453020  1
  Al  Al264  1  0.458112  0.283228  0.408519  1
  Al  Al265  1  0.696011  0.759296  0.453040  1
  Al  Al266  1  0.791388  0.949881  0.408546  1
  Al  Al267  1  0.077020  0.771228  0.430871  1
  Al  Al268  1  0.029288  0.925943  0.453086  1
  Al  Al269  1  0.124908  0.116675  0.408615  1
  Al  Al270  1  0.458224  0.783175  0.408503  1
  Al  Al271  1  0.791319  0.699926  0.408341  1
  Al  Al272  1  0.458040  0.533242  0.408480  1
  Al  Al273  1  0.410299  0.687997  0.430787  1
  Al  Al274  1  0.791323  0.199866  0.408436  1
  Al  Al275  1  0.743806  0.354576  0.430990  1
  Al  Al276  1  0.695965  0.509350  0.453099  1
  Al  Al277  1  0.124632  0.366625  0.408284  1
  Al  Al278  1  0.077061  0.521245  0.430748  1
  Al  Al279  1  0.029259  0.675959  0.453124  1
  Al  Al280  1  0.457979  0.033238  0.408384  1
  Al  Al281  1  0.410349  0.188000  0.430723  1
  Al  Al282  1  0.362610  0.342668  0.453106  1
  Al  Al283  1  0.743623  0.854604  0.430730  1
  Al  Al284  1  0.695987  0.009284  0.453104  1
  Al  Al285  1  0.124717  0.866542  0.408411  1
  Al  Al286  1  0.077193  0.021159  0.430950  1
  Al  Al287  1  0.029287  0.176016  0.453066  1
  Al  Al288  1  0.362671  0.842580  0.453061  1
  Al  Al289  1  0.791062  0.574716  0.486500  1
  Al  Al290  1  0.457652  0.408044  0.486499  1
  Al  Al291  1  0.409813  0.562798  0.508852  1
  Al  Al292  1  0.791017  0.074651  0.486469  1
  Al  Al293  1  0.743216  0.229353  0.508764  1
  Al  Al294  1  0.695367  0.384185  0.531077  1
  Al  Al295  1  0.124334  0.241412  0.486454  1
  Al  Al296  1  0.076531  0.396090  0.508764  1
  Al  Al297  1  0.028716  0.550822  0.531110  1
  Al  Al298  1  0.457742  0.907996  0.486448  1
  Al  Al299  1  0.409908  0.062745  0.508746  1
  Al  Al300  1  0.362160  0.217431  0.531042  1
  Al  Al301  1  0.743279  0.729369  0.508784  1
  Al  Al302  1  0.838726  0.920008  0.464231  1
  Al  Al303  1  0.124353  0.741395  0.486560  1
  Al  Al304  1  0.076581  0.896017  0.508807  1
  Al  Al305  1  0.028766  0.050754  0.531014  1
  Al  Al306  1  0.505445  0.753294  0.464218  1
  Al  Al307  1  0.600401  0.568756  0.497673  1
  Al  Al308  1  0.267096  0.402058  0.497629  1
  Al  Al309  1  0.219373  0.556755  0.519940  1
  Al  Al310  1  0.600458  0.068704  0.497621  1
  Al  Al311  1  0.552700  0.223377  0.519902  1
  Al  Al312  1  0.648130  0.414047  0.475401  1
  Al  Al313  1  0.933780  0.235386  0.497621  1
  Al  Al314  1  0.886018  0.390120  0.519924  1
  Al  Al315  1  0.981508  0.580692  0.475370  1
  Al  Al316  1  0.267153  0.902016  0.497619  1
  Al  Al317  1  0.219439  0.056758  0.519899  1
  Al  Al318  1  0.314863  0.247423  0.475340  1
  Al  Al319  1  0.552753  0.723383  0.519904  1
  Al  Al320  1  0.648172  0.914009  0.475329  1
  Al  Al321  1  0.933776  0.735396  0.497660  1
  Al  Al322  1  0.886038  0.890023  0.519942  1
  Al  Al323  1  0.981482  0.080636  0.475337  1
  Al  Al324  1  0.314836  0.747338  0.475368  1
  Al  Al325  1  0.648204  0.663984  0.475372  1
  Al  Al326  1  0.314810  0.497345  0.475345  1
  Al  Al327  1  0.267144  0.652014  0.497711  1
  Al  Al328  1  0.648197  0.163965  0.475351  1
  Al  Al329  1  0.600392  0.318737  0.497606  1
  Al  Al330  1  0.552699  0.473488  0.519980  1
  Al  Al331  1  0.981485  0.330708  0.475326  1
  Al  Al332  1  0.933783  0.485402  0.497670  1
  Al  Al333  1  0.886070  0.640101  0.519968  1
  Al  Al334  1  0.314884  0.997327  0.475327  1
  Al  Al335  1  0.267153  0.152050  0.497641  1
  Al  Al336  1  0.219339  0.306819  0.519861  1
  Al  Al337  1  0.600491  0.818674  0.497636  1
  Al  Al338  1  0.552707  0.973431  0.519873  1
  Al  Al339  1  0.981571  0.830638  0.475438  1
  Al  Al340  1  0.933764  0.985359  0.497601  1
  Al  Al341  1  0.886041  0.140048  0.519895  1
  Al  Al342  1  0.219384  0.806749  0.519935  1
  Al  Al343  1  0.647643  0.538885  0.553423  1
  Al  Al344  1  0.314391  0.372201  0.553354  1
  Al  Al345  1  0.266882  0.526745  0.575591  1
  Al  Al346  1  0.647841  0.038801  0.553319  1
  Al  Al347  1  0.600123  0.193511  0.575638  1
  Al  Al348  1  0.552245  0.348067  0.597888  1
  Al  Al349  1  0.981072  0.205449  0.553291  1
  Al  Al350  1  0.933477  0.360131  0.575579  1
  Al  Al351  1  0.885621  0.514994  0.597926  1
  Al  Al352  1  0.314401  0.872144  0.553307  1
  Al  Al353  1  0.266916  0.026785  0.575565  1
  Al  Al354  1  0.218946  0.181565  0.597790  1
  Al  Al355  1  0.600206  0.693428  0.575587  1
  Al  Al356  1  0.695470  0.884079  0.531067  1
  Al  Al357  1  0.981146  0.705457  0.553357  1
  Al  Al358  1  0.933475  0.860142  0.575658  1
  Al  Al359  1  0.885286  0.014936  0.598045  1
  Al  Al360  1  0.362096  0.717399  0.531062  1
  Al  Al361  1  0.457179  0.532910  0.564579  1
  Al  Al362  1  0.123851  0.366222  0.564490  1
  Al  Al363  1  0.075988  0.520820  0.586748  1
  Al  Al364  1  0.457181  0.032853  0.564456  1
  Al  Al365  1  0.409566  0.187551  0.586725  1
  Al  Al366  1  0.504966  0.378140  0.542229  1
  Al  Al367  1  0.790596  0.199461  0.564446  1
  Al  Al368  1  0.742730  0.354163  0.586680  1
  Al  Al369  1  0.838360  0.544865  0.542268  1
  Al  Al370  1  0.123938  0.866173  0.564535  1
  Al  Al371  1  0.076033  0.020765  0.586667  1
  Al  Al372  1  0.171669  0.211447  0.542138  1
  Al  Al373  1  0.409196  0.687462  0.586783  1
  Al  Al374  1  0.505061  0.878105  0.542161  1
  Al  Al375  1  0.790513  0.699428  0.564559  1
  Al  Al376  1  0.742883  0.854208  0.586719  1
  Al  Al377  1  0.838247  0.044756  0.542219  1
  Al  Al378  1  0.171590  0.711449  0.542275  1
  Al  Al379  1  0.504870  0.628137  0.542241  1
  Al  Al380  1  0.171605  0.461466  0.542203  1
  Al  Al381  1  0.123674  0.616278  0.564400  1
  Al  Al382  1  0.504964  0.128138  0.542140  1
  Al  Al383  1  0.457267  0.282759  0.564546  1
  Al  Al384  1  0.409458  0.437499  0.586816  1
  Al  Al385  1  0.838309  0.294780  0.542186  1
  Al  Al386  1  0.790343  0.449615  0.564394  1
  Al  Al387  1  0.742850  0.604242  0.586908  1
  Al  Al388  1  0.171633  0.961424  0.542198  1
  Al  Al389  1  0.123789  0.116182  0.564302  1
  Al  Al390  1  0.076168  0.270828  0.586755  1
  Al  Al391  1  0.457134  0.782820  0.564307  1
  Al  Al392  1  0.409522  0.937582  0.586742  1
  Al  Al393  1  0.838302  0.794766  0.542165  1
  Al  Al394  1  0.790572  0.949452  0.564561  1
  Al  Al395  1  0.742934  0.104132  0.586889  1
  Al  Al396  1  0.076301  0.770861  0.587012  1
  Al  Al397  1  0.504070  0.503122  0.620293  1
  Al  Al398  1  0.170761  0.336364  0.620201  1
  Al  Al399  1  0.123047  0.491037  0.642629  1
  Al  Al400  1  0.504005  0.003226  0.620261  1
  Al  Al401  1  0.457254  0.157365  0.642441  1
  Al  Al402  1  0.408542  0.312408  0.664322  1
  Al  Al403  1  0.837676  0.169520  0.620074  1
  Al  Al404  1  0.790198  0.324215  0.642365  1
  Al  Al405  1  0.742357  0.478833  0.664651  1
  Al  Al406  1  0.171492  0.836101  0.620272  1
  Al  Al407  1  0.123558  0.990969  0.642373  1
  Al  Al408  1  0.075386  0.145511  0.664534  1
  Al  Al409  1  0.456449  0.657778  0.642727  1
  Al  Al410  1  0.552345  0.848198  0.597778  1
  Al  Al411  1  0.837794  0.669668  0.620537  1
  Al  Al412  1  0.790658  0.824038  0.642435  1
  Al  Al413  1  0.742207  0.979031  0.664157  1
  Al  Al414  1  0.218607  0.681877  0.598143  1
  Al  Al415  1  0.314316  0.496966  0.631399  1
  Al  Al416  1  0.980964  0.330259  0.631321  1
  Al  Al417  1  0.932785  0.485026  0.653794  1
  Al  Al418  1  0.314578  0.997190  0.631442  1
  Al  Al419  1  0.265924  0.151480  0.653603  1
  Al  Al420  1  0.361683  0.342165  0.609007  1
  Al  Al421  1  0.647322  0.163505  0.631461  1
  Al  Al422  1  0.599251  0.318188  0.653626  1
  Al  Al423  1  0.694738  0.509029  0.609089  1
  Al  Al424  1  0.980753  0.830126  0.631471  1
  Al  Al425  1  0.932476  0.985060  0.653631  1
  Al  Al426  1  0.028154  0.175585  0.608958  1
  Al  Al427  1  0.265839  0.651902  0.653848  1
  Al  Al428  1  0.361601  0.842279  0.608917  1
  Al  Al429  1  0.647944  0.663815  0.631471  1
  Al  Al430  1  0.599304  0.818167  0.653593  1
  Al  Al431  1  0.695233  0.008939  0.609062  1
  Al  Al432  1  0.028462  0.675839  0.609152  1
  Al  Al433  1  0.361785  0.592369  0.609289  1
  Al  Al434  1  0.028451  0.425619  0.609195  1
  Al  Al435  1  0.980847  0.580031  0.631468  1
  Al  Al436  1  0.361905  0.092238  0.609245  1
  Al  Al437  1  0.314077  0.246619  0.631094  1
  Al  Al438  1  0.265709  0.402056  0.653588  1
  Al  Al439  1  0.695028  0.258881  0.608970  1
  Al  Al440  1  0.647563  0.413283  0.631353  1
  Al  Al441  1  0.599045  0.568685  0.653630  1
  Al  Al442  1  0.028461  0.925571  0.608978  1
  Al  Al443  1  0.980587  0.079930  0.631338  1
  Al  Al444  1  0.932694  0.235252  0.653535  1
  Al  Al445  1  0.313846  0.746724  0.631488  1
  Al  Al446  1  0.266073  0.901958  0.653494  1
  Al  Al447  1  0.695252  0.758824  0.609250  1
  Al  Al448  1  0.647494  0.913292  0.631048  1
  Al  Al449  1  0.598948  0.068995  0.653501  1
  Al  Al450  1  0.932334  0.735485  0.653484  1
  Al  Al451  1  0.363317  0.466215  0.686949  1
  Al  Al452  1  0.029859  0.299516  0.686828  1
  Al  Al453  1  0.980448  0.455658  0.709171  1
  Al  Al454  1  0.363388  0.966244  0.686831  1
  Al  Al455  1  0.314706  0.122867  0.709448  1
  Al  Al456  1  0.266712  0.276729  0.728293  1
  Al  Al457  1  0.695025  0.134051  0.687590  1
  Al  Al458  1  0.647182  0.288260  0.707983  1
  Al  Al459  1  0.599648  0.443445  0.728523  1
  Al  Al460  1  0.027347  0.800845  0.687574  1
  Al  Al461  1  0.980907  0.955045  0.707942  1
  Al  Al462  1  0.933374  0.110340  0.728488  1
  Al  Al463  1  0.313654  0.622751  0.709162  1
  Al  Al464  1  0.408567  0.812410  0.664281  1
  Al  Al465  1  0.695667  0.633186  0.686767  1
  Al  Al466  1  0.648516  0.789829  0.709387  1
  Al  Al467  1  0.600263  0.943505  0.728247  1
  Al  Al468  1  0.075784  0.645579  0.664269  1
  Al  Al469  1  0.169544  0.460693  0.698769  1
  Al  Al470  1  0.835901  0.293942  0.698695  1
  Al  Al471  1  0.789026  0.448351  0.719299  1
  Al  Al472  1  0.169893  0.960917  0.698508  1
  Al  Al473  1  0.122784  0.115294  0.719305  1
  Al  Al474  1  0.219142  0.306574  0.675047  1
  Al  Al475  1  0.504448  0.128262  0.698774  1
  Al  Al476  1  0.455236  0.282510  0.717914  1
  Al  Al477  1  0.552651  0.473138  0.675167  1
  Al  Al478  1  0.837856  0.795023  0.698715  1
  Al  Al479  1  0.788843  0.949326  0.717843  1
  Al  Al480  1  0.886190  0.139835  0.675095  1
  Al  Al481  1  0.123385  0.615614  0.718423  1
  Al  Al482  1  0.218913  0.806218  0.676043  1
  Al  Al483  1  0.502944  0.627624  0.698908  1
  Al  Al484  1  0.457192  0.782535  0.718497  1
  Al  Al485  1  0.552320  0.973230  0.674905  1
  Al  Al486  1  0.885093  0.639217  0.675976  1
  Al  Al487  1  0.217966  0.556565  0.674860  1
  Al  Al488  1  0.884533  0.389978  0.674992  1
  Al  Al489  1  0.837373  0.544999  0.698353  1
  Al  Al490  1  0.218176  0.056912  0.674970  1
  Al  Al491  1  0.170668  0.211035  0.698173  1
  Al  Al492  1  0.123422  0.364614  0.719519  1
  Al  Al493  1  0.552670  0.222594  0.676052  1
  Al  Al494  1  0.504141  0.377637  0.698227  1
  Al  Al495  1  0.456796  0.531486  0.719595  1
  Al  Al496  1  0.886171  0.889405  0.676026  1
  Al  Al497  1  0.837541  0.044603  0.698276  1
  Al  Al498  1  0.791341  0.198468  0.718201  1
  Al  Al499  1  0.170694  0.712278  0.698420  1
  Al  Al500  1  0.124659  0.866037  0.717873  1
  Al  Al501  1  0.551566  0.723550  0.674860  1
  Al  Al502  1  0.504227  0.878030  0.698073  1
  Al  Al503  1  0.457187  0.031518  0.719544  1
  Al  Al504  1  0.790342  0.698393  0.718990  1
