# generated using pymatgen
data_TiAl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   23.54028741
_cell_length_b   12.53375279
_cell_length_c   49.34373912
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiAl2
_chemical_formula_sum   'Ti144 Al288'
_cell_volume   14558.7785999
_cell_formula_units_Z   144
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  0.170794  0.295051  0.286751  1
  Ti  Ti2  1  0.170786  0.896052  0.337323  1
  Ti  Ti3  1  0.169863  0.596432  0.311350  1
  Ti  Ti4  1  0.418933  0.153770  0.274465  1
  Ti  Ti5  1  0.420141  0.747947  0.323928  1
  Ti  Ti6  1  0.419863  0.447282  0.297755  1
  Ti  Ti7  1  0.338274  0.298953  0.285896  1
  Ti  Ti8  1  0.337636  0.896141  0.336688  1
  Ti  Ti9  1  0.337420  0.596578  0.310876  1
  Ti  Ti10  1  0.087839  0.246310  0.324559  1
  Ti  Ti11  1  0.087648  0.945441  0.298970  1
  Ti  Ti12  1  0.089253  0.649274  0.275369  1
  Ti  Ti13  1  0.669863  0.096432  0.311350  1
  Ti  Ti14  1  0.670794  0.795051  0.286751  1
  Ti  Ti15  1  0.670786  0.396052  0.337323  1
  Ti  Ti16  1  0.920141  0.247947  0.323928  1
  Ti  Ti17  1  0.919863  0.947282  0.297755  1
  Ti  Ti18  1  0.918933  0.653770  0.274465  1
  Ti  Ti19  1  0.837420  0.096578  0.310876  1
  Ti  Ti20  1  0.838274  0.798953  0.285896  1
  Ti  Ti21  1  0.837636  0.396141  0.336688  1
  Ti  Ti22  1  0.589253  0.149274  0.275369  1
  Ti  Ti23  1  0.587839  0.746310  0.324559  1
  Ti  Ti24  1  0.587648  0.445441  0.298970  1
  Ti  Ti25  1  0.170589  0.196036  0.362783  1
  Ti  Ti26  1  0.170460  0.795346  0.414151  1
  Ti  Ti27  1  0.170490  0.495709  0.388489  1
  Ti  Ti28  1  0.420160  0.045670  0.349385  1
  Ti  Ti29  1  0.420266  0.645669  0.401256  1
  Ti  Ti30  1  0.420309  0.346903  0.375995  1
  Ti  Ti31  1  0.337797  0.196195  0.362878  1
  Ti  Ti32  1  0.337601  0.795115  0.414088  1
  Ti  Ti33  1  0.337509  0.496122  0.388545  1
  Ti  Ti34  1  0.087354  0.145709  0.401327  1
  Ti  Ti35  1  0.087153  0.846582  0.375993  1
  Ti  Ti36  1  0.087132  0.545336  0.349570  1
  Ti  Ti37  1  0.670490  0.995709  0.388489  1
  Ti  Ti38  1  0.670589  0.696036  0.362783  1
  Ti  Ti39  1  0.670460  0.295346  0.414151  1
  Ti  Ti40  1  0.920266  0.145669  0.401256  1
  Ti  Ti41  1  0.920309  0.846903  0.375995  1
  Ti  Ti42  1  0.920160  0.545670  0.349385  1
  Ti  Ti43  1  0.837509  0.996122  0.388545  1
  Ti  Ti44  1  0.837797  0.696195  0.362878  1
  Ti  Ti45  1  0.837601  0.295115  0.414088  1
  Ti  Ti46  1  0.587132  0.045336  0.349570  1
  Ti  Ti47  1  0.587354  0.645709  0.401327  1
  Ti  Ti48  1  0.587153  0.346582  0.375993  1
  Ti  Ti49  1  0.170509  0.095061  0.439899  1
  Ti  Ti50  1  0.170446  0.694154  0.491252  1
  Ti  Ti51  1  0.170456  0.394566  0.465582  1
  Ti  Ti52  1  0.420407  0.944997  0.426950  1
  Ti  Ti53  1  0.420353  0.544542  0.478519  1
  Ti  Ti54  1  0.420304  0.244680  0.452702  1
  Ti  Ti55  1  0.337587  0.094833  0.439802  1
  Ti  Ti56  1  0.337500  0.694207  0.491292  1
  Ti  Ti57  1  0.337468  0.394648  0.465640  1
  Ti  Ti58  1  0.087379  0.044489  0.478480  1
  Ti  Ti59  1  0.087414  0.744634  0.452670  1
  Ti  Ti60  1  0.087294  0.445193  0.426979  1
  Ti  Ti61  1  0.670456  0.894566  0.465582  1
  Ti  Ti62  1  0.670509  0.595061  0.439899  1
  Ti  Ti63  1  0.670446  0.194154  0.491252  1
  Ti  Ti64  1  0.920353  0.044542  0.478519  1
  Ti  Ti65  1  0.920304  0.744680  0.452702  1
  Ti  Ti66  1  0.920407  0.444997  0.426950  1
  Ti  Ti67  1  0.837468  0.894648  0.465640  1
  Ti  Ti68  1  0.837587  0.594833  0.439802  1
  Ti  Ti69  1  0.837500  0.194207  0.491292  1
  Ti  Ti70  1  0.587294  0.945193  0.426979  1
  Ti  Ti71  1  0.587379  0.544489  0.478480  1
  Ti  Ti72  1  0.587414  0.244634  0.452670  1
  Ti  Ti73  1  0.170481  0.993642  0.516907  1
  Ti  Ti74  1  0.170565  0.592938  0.568409  1
  Ti  Ti75  1  0.170445  0.293497  0.542717  1
  Ti  Ti76  1  0.420360  0.843924  0.504095  1
  Ti  Ti77  1  0.420272  0.443298  0.555586  1
  Ti  Ti78  1  0.420391  0.143482  0.529748  1
  Ti  Ti79  1  0.337507  0.993589  0.516869  1
  Ti  Ti80  1  0.337452  0.593134  0.568437  1
  Ti  Ti81  1  0.337556  0.293451  0.542686  1
  Ti  Ti82  1  0.087350  0.943070  0.555489  1
  Ti  Ti83  1  0.087404  0.643565  0.529806  1
  Ti  Ti84  1  0.087413  0.343977  0.504136  1
  Ti  Ti85  1  0.670445  0.793497  0.542717  1
  Ti  Ti86  1  0.670481  0.493642  0.516907  1
  Ti  Ti87  1  0.670565  0.092938  0.568409  1
  Ti  Ti88  1  0.920272  0.943298  0.555586  1
  Ti  Ti89  1  0.920391  0.643482  0.529748  1
  Ti  Ti90  1  0.920360  0.343924  0.504095  1
  Ti  Ti91  1  0.837556  0.793451  0.542686  1
  Ti  Ti92  1  0.837507  0.493589  0.516869  1
  Ti  Ti93  1  0.837452  0.093134  0.568437  1
  Ti  Ti94  1  0.587413  0.843977  0.504136  1
  Ti  Ti95  1  0.587350  0.443070  0.555489  1
  Ti  Ti96  1  0.587404  0.143565  0.529806  1
  Ti  Ti97  1  0.170505  0.892422  0.594061  1
  Ti  Ti98  1  0.170727  0.492795  0.645818  1
  Ti  Ti99  1  0.170706  0.191549  0.619395  1
  Ti  Ti100  1  0.420258  0.743016  0.581299  1
  Ti  Ti101  1  0.420063  0.341936  0.632509  1
  Ti  Ti102  1  0.420350  0.042009  0.606843  1
  Ti  Ti103  1  0.337593  0.892462  0.594132  1
  Ti  Ti104  1  0.337699  0.492461  0.646003  1
  Ti  Ti105  1  0.337550  0.191228  0.619393  1
  Ti  Ti106  1  0.087270  0.842095  0.632604  1
  Ti  Ti107  1  0.087369  0.542422  0.606898  1
  Ti  Ti108  1  0.087399  0.242784  0.581236  1
  Ti  Ti109  1  0.670706  0.691549  0.619395  1
  Ti  Ti110  1  0.670505  0.392422  0.594061  1
  Ti  Ti111  1  0.670727  0.992795  0.645818  1
  Ti  Ti112  1  0.920063  0.841936  0.632509  1
  Ti  Ti113  1  0.920350  0.542009  0.606843  1
  Ti  Ti114  1  0.920258  0.243016  0.581299  1
  Ti  Ti115  1  0.837550  0.691228  0.619393  1
  Ti  Ti116  1  0.837593  0.392462  0.594132  1
  Ti  Ti117  1  0.837699  0.992461  0.646003  1
  Ti  Ti118  1  0.587399  0.742784  0.581236  1
  Ti  Ti119  1  0.587270  0.342095  0.632604  1
  Ti  Ti120  1  0.587369  0.042422  0.606898  1
  Ti  Ti121  1  0.170020  0.791821  0.670828  1
  Ti  Ti122  1  0.168607  0.388856  0.720018  1
  Ti  Ti123  1  0.170211  0.092690  0.696418  1
  Ti  Ti124  1  0.420223  0.641990  0.658700  1
  Ti  Ti125  1  0.419585  0.239178  0.709491  1
  Ti  Ti126  1  0.420439  0.941552  0.684512  1
  Ti  Ti127  1  0.337718  0.790184  0.671460  1
  Ti  Ti128  1  0.338926  0.384361  0.720923  1
  Ti  Ti129  1  0.337996  0.090848  0.697633  1
  Ti  Ti130  1  0.087065  0.743080  0.708637  1
  Ti  Ti131  1  0.087996  0.441699  0.684038  1
  Ti  Ti132  1  0.087074  0.142079  0.658065  1
  Ti  Ti133  1  0.670211  0.592690  0.696418  1
  Ti  Ti134  1  0.670020  0.291821  0.670828  1
  Ti  Ti135  1  0.668607  0.888856  0.720018  1
  Ti  Ti136  1  0.919585  0.739178  0.709491  1
  Ti  Ti137  1  0.920439  0.441552  0.684512  1
  Ti  Ti138  1  0.920223  0.141990  0.658700  1
  Ti  Ti139  1  0.837996  0.590848  0.697633  1
  Ti  Ti140  1  0.837718  0.290184  0.671460  1
  Ti  Ti141  1  0.838926  0.884361  0.720923  1
  Ti  Ti142  1  0.587074  0.642079  0.658065  1
  Ti  Ti143  1  0.587065  0.243080  0.708637  1
  Ti  Ti144  1  0.587996  0.941699  0.684038  1
  Al  Al145  1  0.421310  0.249117  0.325079  1
  Al  Al146  1  0.419923  0.948118  0.297957  1
  Al  Al147  1  0.421060  0.647135  0.274997  1
  Al  Al148  1  0.254392  0.248558  0.324944  1
  Al  Al149  1  0.253704  0.946466  0.299074  1
  Al  Al150  1  0.252888  0.647670  0.275451  1
  Al  Al151  1  0.255218  0.149442  0.275885  1
  Al  Al152  1  0.254306  0.746165  0.324755  1
  Al  Al153  1  0.253998  0.448070  0.297311  1
  Al  Al154  1  0.336360  0.096888  0.311736  1
  Al  Al155  1  0.336746  0.796641  0.286574  1
  Al  Al156  1  0.337177  0.397591  0.337172  1
  Al  Al157  1  0.171683  0.095040  0.311879  1
  Al  Al158  1  0.171828  0.798737  0.286706  1
  Al  Al159  1  0.171522  0.396846  0.337286  1
  Al  Al160  1  0.503630  0.095760  0.311318  1
  Al  Al161  1  0.504782  0.795010  0.287204  1
  Al  Al162  1  0.503640  0.397519  0.337213  1
  Al  Al163  1  0.504056  0.299310  0.285631  1
  Al  Al164  1  0.503455  0.896210  0.336777  1
  Al  Al165  1  0.503569  0.596132  0.311451  1
  Al  Al166  1  0.088281  0.144683  0.275809  1
  Al  Al167  1  0.086278  0.747509  0.325447  1
  Al  Al168  1  0.087119  0.445494  0.298147  1
  Al  Al169  1  0.921060  0.147135  0.274997  1
  Al  Al170  1  0.921310  0.749117  0.325079  1
  Al  Al171  1  0.919923  0.448118  0.297957  1
  Al  Al172  1  0.752888  0.147670  0.275451  1
  Al  Al173  1  0.754392  0.748558  0.324944  1
  Al  Al174  1  0.753704  0.446466  0.299074  1
  Al  Al175  1  0.754306  0.246165  0.324755  1
  Al  Al176  1  0.753998  0.948070  0.297311  1
  Al  Al177  1  0.755218  0.649442  0.275885  1
  Al  Al178  1  0.836746  0.296641  0.286574  1
  Al  Al179  1  0.837177  0.897591  0.337172  1
  Al  Al180  1  0.836360  0.596888  0.311736  1
  Al  Al181  1  0.671828  0.298737  0.286706  1
  Al  Al182  1  0.671522  0.896846  0.337286  1
  Al  Al183  1  0.671683  0.595040  0.311879  1
  Al  Al184  1  0.004782  0.295010  0.287204  1
  Al  Al185  1  1.003640  0.897519  0.337213  1
  Al  Al186  1  1.003630  0.595760  0.311318  1
  Al  Al187  1  1.003569  0.096132  0.311451  1
  Al  Al188  1  0.004056  0.799310  0.285631  1
  Al  Al189  1  1.003455  0.396210  0.336777  1
  Al  Al190  1  0.586278  0.247509  0.325447  1
  Al  Al191  1  0.587119  0.945494  0.298147  1
  Al  Al192  1  0.588281  0.644683  0.275809  1
  Al  Al193  1  0.420952  0.145156  0.401190  1
  Al  Al194  1  0.420780  0.845983  0.375448  1
  Al  Al195  1  0.420541  0.546742  0.349658  1
  Al  Al196  1  0.253779  0.145485  0.401340  1
  Al  Al197  1  0.254011  0.845867  0.375627  1
  Al  Al198  1  0.253776  0.546062  0.349757  1
  Al  Al199  1  0.254591  0.046074  0.350055  1
  Al  Al200  1  0.254291  0.645647  0.401244  1
  Al  Al201  1  0.254482  0.346033  0.375799  1
  Al  Al202  1  0.337278  0.995422  0.388300  1
  Al  Al203  1  0.337194  0.695854  0.362512  1
  Al  Al204  1  0.336918  0.295476  0.414264  1
  Al  Al205  1  0.171251  0.995873  0.388569  1
  Al  Al206  1  0.170797  0.695666  0.362823  1
  Al  Al207  1  0.171142  0.295375  0.414189  1
  Al  Al208  1  0.504003  0.995548  0.388259  1
  Al  Al209  1  0.503908  0.696083  0.362605  1
  Al  Al210  1  0.504085  0.295360  0.414306  1
  Al  Al211  1  0.503292  0.195792  0.362904  1
  Al  Al212  1  0.503491  0.795337  0.414092  1
  Al  Al213  1  0.503439  0.496365  0.388555  1
  Al  Al214  1  0.086794  0.046035  0.350096  1
  Al  Al215  1  0.086649  0.645272  0.401181  1
  Al  Al216  1  0.086685  0.345960  0.375655  1
  Al  Al217  1  0.920541  0.046742  0.349658  1
  Al  Al218  1  0.920952  0.645156  0.401190  1
  Al  Al219  1  0.920780  0.345983  0.375448  1
  Al  Al220  1  0.753776  0.046062  0.349757  1
  Al  Al221  1  0.753779  0.645485  0.401340  1
  Al  Al222  1  0.754011  0.345867  0.375627  1
  Al  Al223  1  0.754291  0.145647  0.401244  1
  Al  Al224  1  0.754482  0.846033  0.375799  1
  Al  Al225  1  0.754591  0.546074  0.350055  1
  Al  Al226  1  0.837194  0.195854  0.362512  1
  Al  Al227  1  0.836918  0.795476  0.414264  1
  Al  Al228  1  0.837278  0.495422  0.388300  1
  Al  Al229  1  0.670797  0.195666  0.362823  1
  Al  Al230  1  0.671142  0.795375  0.414189  1
  Al  Al231  1  0.671251  0.495873  0.388569  1
  Al  Al232  1  1.003908  0.196083  0.362605  1
  Al  Al233  1  0.004085  0.795360  0.414306  1
  Al  Al234  1  0.004003  0.495548  0.388259  1
  Al  Al235  1  1.003439  0.996365  0.388555  1
  Al  Al236  1  1.003292  0.695792  0.362904  1
  Al  Al237  1  1.003491  0.295337  0.414092  1
  Al  Al238  1  0.586649  0.145272  0.401181  1
  Al  Al239  1  0.586685  0.845960  0.375655  1
  Al  Al240  1  0.586794  0.546035  0.350096  1
  Al  Al241  1  0.420894  0.044247  0.478359  1
  Al  Al242  1  0.420857  0.744712  0.452703  1
  Al  Al243  1  0.420827  0.445626  0.427200  1
  Al  Al244  1  0.253728  0.044301  0.478369  1
  Al  Al245  1  0.253706  0.744718  0.452685  1
  Al  Al246  1  0.253680  0.445341  0.427075  1
  Al  Al247  1  0.254403  0.945070  0.426985  1
  Al  Al248  1  0.254290  0.544418  0.478448  1
  Al  Al249  1  0.254364  0.244746  0.452746  1
  Al  Al250  1  0.337046  0.894408  0.465493  1
  Al  Al251  1  0.337012  0.595062  0.439920  1
  Al  Al252  1  0.337002  0.194124  0.491252  1
  Al  Al253  1  0.171119  0.894543  0.465538  1
  Al  Al254  1  0.171116  0.594920  0.439854  1
  Al  Al255  1  0.171162  0.194219  0.491300  1
  Al  Al256  1  0.504188  0.894488  0.465548  1
  Al  Al257  1  0.504127  0.595198  0.439910  1
  Al  Al258  1  0.504203  0.194120  0.491228  1
  Al  Al259  1  0.503508  0.094912  0.439810  1
  Al  Al260  1  0.503562  0.694241  0.491310  1
  Al  Al261  1  0.503525  0.394565  0.465626  1
  Al  Al262  1  0.086711  0.945436  0.427180  1
  Al  Al263  1  0.086710  0.544322  0.478400  1
  Al  Al264  1  0.086717  0.244822  0.452726  1
  Al  Al265  1  0.920827  0.945626  0.427200  1
  Al  Al266  1  0.920894  0.544247  0.478359  1
  Al  Al267  1  0.920857  0.244712  0.452703  1
  Al  Al268  1  0.753680  0.945341  0.427075  1
  Al  Al269  1  0.753728  0.544301  0.478369  1
  Al  Al270  1  0.753706  0.244718  0.452685  1
  Al  Al271  1  0.754290  0.044418  0.478448  1
  Al  Al272  1  0.754364  0.744746  0.452746  1
  Al  Al273  1  0.754403  0.445070  0.426985  1
  Al  Al274  1  0.837012  0.095062  0.439920  1
  Al  Al275  1  0.837002  0.694124  0.491252  1
  Al  Al276  1  0.837046  0.394408  0.465493  1
  Al  Al277  1  0.671116  0.094920  0.439854  1
  Al  Al278  1  0.671162  0.694219  0.491300  1
  Al  Al279  1  0.671119  0.394543  0.465538  1
  Al  Al280  1  0.004127  0.095198  0.439910  1
  Al  Al281  1  0.004203  0.694120  0.491228  1
  Al  Al282  1  0.004188  0.394488  0.465548  1
  Al  Al283  1  1.003525  0.894565  0.465626  1
  Al  Al284  1  1.003508  0.594912  0.439810  1
  Al  Al285  1  1.003562  0.194241  0.491310  1
  Al  Al286  1  0.586710  0.044322  0.478400  1
  Al  Al287  1  0.586717  0.744822  0.452726  1
  Al  Al288  1  0.586711  0.445436  0.427180  1
  Al  Al289  1  0.420847  0.943068  0.555468  1
  Al  Al290  1  0.420813  0.643723  0.529895  1
  Al  Al291  1  0.420858  0.344006  0.504136  1
  Al  Al292  1  0.253732  0.942933  0.555477  1
  Al  Al293  1  0.253672  0.643643  0.529840  1
  Al  Al294  1  0.253656  0.344011  0.504160  1
  Al  Al295  1  0.254297  0.843890  0.504078  1
  Al  Al296  1  0.254352  0.443219  0.555578  1
  Al  Al297  1  0.254334  0.143566  0.529761  1
  Al  Al298  1  0.337002  0.793419  0.542685  1
  Al  Al299  1  0.336966  0.493884  0.517029  1
  Al  Al300  1  0.337032  0.092504  0.568188  1
  Al  Al301  1  0.171142  0.793309  0.542662  1
  Al  Al302  1  0.171149  0.493809  0.516988  1
  Al  Al303  1  0.171149  0.092695  0.568207  1
  Al  Al304  1  0.504154  0.793413  0.542702  1
  Al  Al305  1  0.504131  0.493830  0.517018  1
  Al  Al306  1  0.504179  0.092790  0.568313  1
  Al  Al307  1  0.503570  0.993713  0.516940  1
  Al  Al308  1  0.503456  0.593061  0.568403  1
  Al  Al309  1  0.503495  0.293385  0.542641  1
  Al  Al310  1  0.086697  0.843912  0.504088  1
  Al  Al311  1  0.086744  0.443211  0.555534  1
  Al  Al312  1  0.086741  0.143588  0.529849  1
  Al  Al313  1  0.920858  0.844006  0.504136  1
  Al  Al314  1  0.920847  0.443068  0.555468  1
  Al  Al315  1  0.920813  0.143723  0.529895  1
  Al  Al316  1  0.753656  0.844011  0.504160  1
  Al  Al317  1  0.753732  0.442933  0.555477  1
  Al  Al318  1  0.753672  0.143643  0.529840  1
  Al  Al319  1  0.754352  0.943219  0.555578  1
  Al  Al320  1  0.754334  0.643566  0.529761  1
  Al  Al321  1  0.754297  0.343890  0.504078  1
  Al  Al322  1  0.836966  0.993884  0.517029  1
  Al  Al323  1  0.837032  0.592504  0.568188  1
  Al  Al324  1  0.837002  0.293419  0.542685  1
  Al  Al325  1  0.671149  0.993809  0.516988  1
  Al  Al326  1  0.671149  0.592695  0.568207  1
  Al  Al327  1  0.671142  0.293309  0.542662  1
  Al  Al328  1  0.004131  0.993830  0.517018  1
  Al  Al329  1  0.004179  0.592790  0.568313  1
  Al  Al330  1  0.004154  0.293413  0.542702  1
  Al  Al331  1  1.003495  0.793385  0.542641  1
  Al  Al332  1  1.003570  0.493713  0.516940  1
  Al  Al333  1  1.003456  0.093061  0.568403  1
  Al  Al334  1  0.586744  0.943211  0.555534  1
  Al  Al335  1  0.586741  0.643588  0.529849  1
  Al  Al336  1  0.586697  0.343912  0.504088  1
  Al  Al337  1  0.420665  0.842277  0.632875  1
  Al  Al338  1  0.420581  0.542709  0.607087  1
  Al  Al339  1  0.420942  0.242654  0.581124  1
  Al  Al340  1  0.253951  0.842048  0.632783  1
  Al  Al341  1  0.253856  0.542583  0.607129  1
  Al  Al342  1  0.253774  0.242771  0.581082  1
  Al  Al343  1  0.254369  0.742794  0.581295  1
  Al  Al344  1  0.254567  0.342339  0.632483  1
  Al  Al345  1  0.254420  0.041766  0.606832  1
  Al  Al346  1  0.337079  0.692147  0.619939  1
  Al  Al347  1  0.336907  0.392975  0.594198  1
  Al  Al348  1  0.337318  0.991389  0.645729  1
  Al  Al349  1  0.171174  0.692171  0.619733  1
  Al  Al350  1  0.171210  0.392859  0.594206  1
  Al  Al351  1  0.171065  0.992096  0.645292  1
  Al  Al352  1  0.503848  0.692264  0.619761  1
  Al  Al353  1  0.504081  0.392645  0.594048  1
  Al  Al354  1  0.504083  0.992069  0.645630  1
  Al  Al355  1  0.503568  0.892484  0.594144  1
  Al  Al356  1  0.503269  0.492057  0.645332  1
  Al  Al357  1  0.503377  0.192098  0.619589  1
  Al  Al358  1  0.086718  0.742756  0.581199  1
  Al  Al359  1  0.087062  0.342465  0.632565  1
  Al  Al360  1  0.086608  0.042258  0.606818  1
  Al  Al361  1  0.920942  0.742654  0.581124  1
  Al  Al362  1  0.920665  0.342277  0.632875  1
  Al  Al363  1  0.920581  0.042709  0.607087  1
  Al  Al364  1  0.753774  0.742771  0.581082  1
  Al  Al365  1  0.753951  0.342048  0.632783  1
  Al  Al366  1  0.753856  0.042583  0.607129  1
  Al  Al367  1  0.754567  0.842339  0.632483  1
  Al  Al368  1  0.754420  0.541766  0.606832  1
  Al  Al369  1  0.754369  0.242794  0.581295  1
  Al  Al370  1  0.836907  0.892975  0.594198  1
  Al  Al371  1  0.837318  0.491389  0.645729  1
  Al  Al372  1  0.837079  0.192147  0.619939  1
  Al  Al373  1  0.671210  0.892859  0.594206  1
  Al  Al374  1  0.671065  0.492096  0.645292  1
  Al  Al375  1  0.671174  0.192171  0.619733  1
  Al  Al376  1  0.004081  0.892645  0.594048  1
  Al  Al377  1  0.004083  0.492069  0.645630  1
  Al  Al378  1  1.003848  0.192264  0.619761  1
  Al  Al379  1  1.003377  0.692098  0.619589  1
  Al  Al380  1  1.003568  0.392484  0.594144  1
  Al  Al381  1  1.003269  0.992057  0.645332  1
  Al  Al382  1  0.587062  0.842465  0.632565  1
  Al  Al383  1  0.586608  0.542258  0.606818  1
  Al  Al384  1  0.586718  0.242756  0.581199  1
  Al  Al385  1  0.421113  0.741490  0.708814  1
  Al  Al386  1  0.421499  0.441243  0.683652  1
  Al  Al387  1  0.420682  0.140540  0.658215  1
  Al  Al388  1  0.253077  0.743121  0.708183  1
  Al  Al389  1  0.254229  0.442371  0.684070  1
  Al  Al390  1  0.254219  0.140612  0.658175  1
  Al  Al391  1  0.254404  0.641921  0.658611  1
  Al  Al392  1  0.253804  0.238820  0.709756  1
  Al  Al393  1  0.254290  0.941999  0.683937  1
  Al  Al394  1  0.337936  0.590013  0.697431  1
  Al  Al395  1  0.336549  0.289014  0.670309  1
  Al  Al396  1  0.336799  0.890996  0.720391  1
  Al  Al397  1  0.170741  0.592637  0.697241  1
  Al  Al398  1  0.171581  0.290622  0.669941  1
  Al  Al399  1  0.169579  0.893448  0.719579  1
  Al  Al400  1  0.504156  0.591665  0.696313  1
  Al  Al401  1  0.503467  0.289573  0.670443  1
  Al  Al402  1  0.504971  0.890461  0.719937  1
  Al  Al403  1  0.503553  0.791966  0.670632  1
  Al  Al404  1  0.502641  0.388689  0.719503  1
  Al  Al405  1  0.503861  0.090061  0.698076  1
  Al  Al406  1  0.086337  0.641285  0.658102  1
  Al  Al407  1  0.086031  0.239394  0.708682  1
  Al  Al408  1  0.086176  0.943091  0.683508  1
  Al  Al409  1  0.920682  0.640540  0.658215  1
  Al  Al410  1  0.921113  0.241490  0.708814  1
  Al  Al411  1  0.921499  0.941243  0.683652  1
  Al  Al412  1  0.754219  0.640612  0.658175  1
  Al  Al413  1  0.753077  0.243121  0.708183  1
  Al  Al414  1  0.754229  0.942371  0.684070  1
  Al  Al415  1  0.753804  0.738820  0.709756  1
  Al  Al416  1  0.754290  0.441999  0.683937  1
  Al  Al417  1  0.754404  0.141921  0.658611  1
  Al  Al418  1  0.836549  0.789014  0.670309  1
  Al  Al419  1  0.836799  0.390996  0.720391  1
  Al  Al420  1  0.837936  0.090013  0.697431  1
  Al  Al421  1  0.671581  0.790622  0.669941  1
  Al  Al422  1  0.669579  0.393448  0.719579  1
  Al  Al423  1  0.670741  0.092637  0.697241  1
  Al  Al424  1  1.003467  0.789573  0.670443  1
  Al  Al425  1  0.004971  0.390461  0.719937  1
  Al  Al426  1  0.004156  0.091665  0.696313  1
  Al  Al427  1  1.003861  0.590061  0.698076  1
  Al  Al428  1  1.003553  0.291966  0.670632  1
  Al  Al429  1  1.002641  0.888689  0.719503  1
  Al  Al430  1  0.586031  0.739394  0.708682  1
  Al  Al431  1  0.586176  0.443091  0.683508  1
  Al  Al432  1  0.586337  0.141285  0.658102  1
