# generated using pymatgen
data_TiAl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.95455679
_cell_length_b   71.16334827
_cell_length_c   51.76563980
_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   14567.8605833
_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  0.003538  0.923569  0.296844  1
  Ti  Ti2  1  0.003538  0.260221  0.272108  1
  Ti  Ti3  1  0.003538  0.588891  0.321614  1
  Ti  Ti4  1  0.503538  0.841847  0.283420  1
  Ti  Ti5  1  0.503538  0.170615  0.333304  1
  Ti  Ti6  1  0.503538  0.506245  0.307875  1
  Ti  Ti7  1  0.003538  0.868661  0.287515  1
  Ti  Ti8  1  0.003538  0.197716  0.337310  1
  Ti  Ti9  1  0.003538  0.533834  0.312637  1
  Ti  Ti10  1  0.003538  0.947782  0.338696  1
  Ti  Ti11  1  0.003538  0.283556  0.312671  1
  Ti  Ti12  1  0.003538  0.619223  0.288234  1
  Ti  Ti13  1  0.503538  0.756440  0.309676  1
  Ti  Ti14  1  0.503538  0.091135  0.284013  1
  Ti  Ti15  1  0.503538  0.420974  0.333730  1
  Ti  Ti16  1  0.003538  0.674310  0.295390  1
  Ti  Ti17  1  0.003538  0.009637  0.270873  1
  Ti  Ti18  1  0.003538  0.338783  0.320543  1
  Ti  Ti19  1  0.503538  0.700963  0.299416  1
  Ti  Ti20  1  0.503538  0.036193  0.274683  1
  Ti  Ti21  1  0.503538  0.365908  0.324680  1
  Ti  Ti22  1  0.503538  0.786749  0.276111  1
  Ti  Ti23  1  0.503538  0.115444  0.325726  1
  Ti  Ti24  1  0.503538  0.451244  0.300180  1
  Ti  Ti25  1  0.003538  0.917438  0.373408  1
  Ti  Ti26  1  0.003538  0.252648  0.346553  1
  Ti  Ti27  1  0.003538  0.582343  0.398470  1
  Ti  Ti28  1  0.503538  0.835461  0.360898  1
  Ti  Ti29  1  0.503538  0.164445  0.410821  1
  Ti  Ti30  1  0.503538  0.500099  0.385202  1
  Ti  Ti31  1  0.003538  0.862539  0.365046  1
  Ti  Ti32  1  0.003538  0.191633  0.414927  1
  Ti  Ti33  1  0.003538  0.527335  0.389494  1
  Ti  Ti34  1  0.003538  0.941644  0.416188  1
  Ti  Ti35  1  0.003538  0.277212  0.389234  1
  Ti  Ti36  1  0.003538  0.612993  0.364529  1
  Ti  Ti37  1  0.503538  0.749815  0.386127  1
  Ti  Ti38  1  0.503538  0.085100  0.360351  1
  Ti  Ti39  1  0.503538  0.414562  0.410644  1
  Ti  Ti40  1  0.003538  0.667907  0.373121  1
  Ti  Ti41  1  0.003538  1.002683  0.347606  1
  Ti  Ti42  1  0.003538  0.332328  0.397767  1
  Ti  Ti43  1  0.503538  0.694976  0.377311  1
  Ti  Ti44  1  0.503538  0.030095  0.352142  1
  Ti  Ti45  1  0.503538  0.359611  0.402003  1
  Ti  Ti46  1  0.503538  0.780489  0.352381  1
  Ti  Ti47  1  0.503538  0.109512  0.402713  1
  Ti  Ti48  1  0.503538  0.445146  0.376633  1
  Ti  Ti49  1  0.003538  0.911283  0.450615  1
  Ti  Ti50  1  0.003538  0.246605  0.423336  1
  Ti  Ti51  1  0.003538  0.575933  0.475437  1
  Ti  Ti52  1  0.503538  0.829078  0.437946  1
  Ti  Ti53  1  0.503538  0.158302  0.488052  1
  Ti  Ti54  1  0.503538  0.493735  0.462299  1
  Ti  Ti55  1  0.003538  0.856348  0.442193  1
  Ti  Ti56  1  0.003538  0.185571  0.492157  1
  Ti  Ti57  1  0.003538  0.520987  0.466629  1
  Ti  Ti58  1  0.003538  0.935516  0.493458  1
  Ti  Ti59  1  0.003538  0.270944  0.466183  1
  Ti  Ti60  1  0.003538  0.606494  0.441466  1
  Ti  Ti61  1  0.503538  0.743575  0.463241  1
  Ti  Ti62  1  0.503538  0.078983  0.437259  1
  Ti  Ti63  1  0.503538  0.408268  0.487699  1
  Ti  Ti64  1  0.003538  0.661449  0.450259  1
  Ti  Ti65  1  0.003538  0.996524  0.424635  1
  Ti  Ti66  1  0.003538  0.325964  0.474740  1
  Ti  Ti67  1  0.503538  0.688666  0.454577  1
  Ti  Ti68  1  0.503538  0.023854  0.428858  1
  Ti  Ti69  1  0.503538  0.353277  0.479030  1
  Ti  Ti70  1  0.503538  0.774063  0.429215  1
  Ti  Ti71  1  0.503538  0.103289  0.479751  1
  Ti  Ti72  1  0.503538  0.438767  0.453604  1
  Ti  Ti73  1  0.003538  0.905082  0.527754  1
  Ti  Ti74  1  0.003538  0.240510  0.500479  1
  Ti  Ti75  1  0.003538  0.569532  0.552471  1
  Ti  Ti76  1  0.503538  0.822749  0.514907  1
  Ti  Ti77  1  0.503538  0.152172  0.565079  1
  Ti  Ti78  1  0.503538  0.487360  0.539360  1
  Ti  Ti79  1  0.003538  0.850062  0.519197  1
  Ti  Ti80  1  0.003538  0.179502  0.569302  1
  Ti  Ti81  1  0.003538  0.514577  0.543679  1
  Ti  Ti82  1  0.003538  0.929421  0.570601  1
  Ti  Ti83  1  0.003538  0.264743  0.543323  1
  Ti  Ti84  1  0.003538  0.600092  0.518500  1
  Ti  Ti85  1  0.503538  0.737259  0.540333  1
  Ti  Ti86  1  0.503538  0.072736  0.514186  1
  Ti  Ti87  1  0.503538  0.401963  0.564722  1
  Ti  Ti88  1  0.003538  0.655038  0.527308  1
  Ti  Ti89  1  0.003538  0.990454  0.501780  1
  Ti  Ti90  1  0.003538  0.319677  0.551745  1
  Ti  Ti91  1  0.503538  0.682291  0.531638  1
  Ti  Ti92  1  0.503538  0.017723  0.505886  1
  Ti  Ti93  1  0.503538  0.346947  0.555991  1
  Ti  Ti94  1  0.503538  0.767758  0.506238  1
  Ti  Ti95  1  0.503538  0.097043  0.556678  1
  Ti  Ti96  1  0.503538  0.432451  0.530697  1
  Ti  Ti97  1  0.003538  0.898813  0.604703  1
  Ti  Ti98  1  0.003538  0.234382  0.577749  1
  Ti  Ti99  1  0.003538  0.563032  0.629409  1
  Ti  Ti100  1  0.503538  0.816415  0.591935  1
  Ti  Ti101  1  0.503538  0.145931  0.641795  1
  Ti  Ti102  1  0.503538  0.481049  0.616626  1
  Ti  Ti103  1  0.003538  0.843698  0.596170  1
  Ti  Ti104  1  0.003538  0.173343  0.646331  1
  Ti  Ti105  1  0.003538  0.508119  0.620817  1
  Ti  Ti106  1  0.003538  0.923378  0.647384  1
  Ti  Ti107  1  0.003538  0.258588  0.620529  1
  Ti  Ti108  1  0.003538  0.593683  0.595468  1
  Ti  Ti109  1  0.503538  0.730879  0.617304  1
  Ti  Ti110  1  0.503538  0.066514  0.591224  1
  Ti  Ti111  1  0.503538  0.395537  0.641556  1
  Ti  Ti112  1  0.003538  0.648690  0.604444  1
  Ti  Ti113  1  0.003538  0.984392  0.579011  1
  Ti  Ti114  1  0.003538  0.313486  0.628891  1
  Ti  Ti115  1  0.503538  0.675927  0.608736  1
  Ti  Ti116  1  0.503538  0.011580  0.583117  1
  Ti  Ti117  1  0.503538  0.340565  0.633040  1
  Ti  Ti118  1  0.503538  0.761464  0.583293  1
  Ti  Ti119  1  0.503538  0.090926  0.633586  1
  Ti  Ti120  1  0.503538  0.426210  0.607811  1
  Ti  Ti121  1  0.003538  0.892470  0.681266  1
  Ti  Ti122  1  0.003538  0.228244  0.655241  1
  Ti  Ti123  1  0.003538  0.556803  0.705703  1
  Ti  Ti124  1  0.503538  0.810118  0.669257  1
  Ti  Ti125  1  0.503538  0.139833  0.719254  1
  Ti  Ti126  1  0.503538  0.475062  0.694522  1
  Ti  Ti127  1  0.003538  0.837243  0.673394  1
  Ti  Ti128  1  0.003538  0.166389  0.723064  1
  Ti  Ti129  1  0.003538  0.501716  0.698547  1
  Ti  Ti130  1  0.003538  0.915804  0.721829  1
  Ti  Ti131  1  0.003538  0.252456  0.697093  1
  Ti  Ti132  1  0.003538  0.587135  0.672323  1
  Ti  Ti133  1  0.503538  0.724782  0.693757  1
  Ti  Ti134  1  0.503538  0.060581  0.668211  1
  Ti  Ti135  1  0.503538  0.389277  0.717826  1
  Ti  Ti136  1  0.003538  0.642192  0.681300  1
  Ti  Ti137  1  0.003538  0.978310  0.656627  1
  Ti  Ti138  1  0.003538  0.307365  0.706422  1
  Ti  Ti139  1  0.503538  0.669780  0.686062  1
  Ti  Ti140  1  0.503538  0.005411  0.660633  1
  Ti  Ti141  1  0.503538  0.334179  0.710517  1
  Ti  Ti142  1  0.503538  0.755051  0.660208  1
  Ti  Ti143  1  0.503538  0.084890  0.709925  1
  Ti  Ti144  1  0.503538  0.419586  0.684261  1
  Al  Al145  1  0.003538  0.838354  0.322226  1
  Al  Al146  1  0.003538  0.173208  0.295963  1
  Al  Al147  1  0.003538  0.509959  0.271736  1
  Al  Al148  1  0.003538  0.893034  0.330684  1
  Al  Al149  1  0.003538  0.228484  0.303733  1
  Al  Al150  1  0.003538  0.564575  0.280308  1
  Al  Al151  1  0.503538  0.896081  0.291771  1
  Al  Al152  1  0.503538  0.225025  0.342044  1
  Al  Al153  1  0.503538  0.561243  0.317350  1
  Al  Al154  1  0.503538  0.865890  0.326429  1
  Al  Al155  1  0.503538  0.200907  0.299935  1
  Al  Al156  1  0.503538  0.537199  0.275501  1
  Al  Al157  1  0.503538  0.920160  0.335023  1
  Al  Al158  1  0.503538  0.255610  0.308842  1
  Al  Al159  1  0.503538  0.591901  0.283858  1
  Al  Al160  1  0.503538  0.811205  0.318207  1
  Al  Al161  1  0.503538  0.145669  0.292629  1
  Al  Al162  1  0.503538  0.475763  0.342349  1
  Al  Al163  1  0.003538  0.814399  0.279321  1
  Al  Al164  1  0.003538  0.143117  0.329815  1
  Al  Al165  1  0.003538  0.478870  0.302776  1
  Al  Al166  1  0.503538  0.950990  0.300290  1
  Al  Al167  1  0.503538  0.287325  0.274987  1
  Al  Al168  1  0.503538  0.616488  0.326387  1
  Al  Al169  1  0.503538  0.670813  0.334382  1
  Al  Al170  1  0.503538  0.006066  0.309583  1
  Al  Al171  1  0.503538  0.341527  0.283227  1
  Al  Al172  1  0.503538  0.732421  0.269062  1
  Al  Al173  1  0.503538  0.060605  0.317789  1
  Al  Al174  1  0.503538  0.396665  0.292413  1
  Al  Al175  1  0.003538  0.728506  0.304810  1
  Al  Al176  1  0.003538  0.063637  0.278873  1
  Al  Al177  1  0.003538  0.393307  0.329458  1
  Al  Al178  1  0.003538  0.698258  0.338547  1
  Al  Al179  1  0.003538  0.033546  0.313701  1
  Al  Al180  1  0.003538  0.369208  0.287458  1
  Al  Al181  1  0.003538  0.759494  0.271921  1
  Al  Al182  1  0.003538  0.087762  0.322077  1
  Al  Al183  1  0.003538  0.423922  0.295949  1
  Al  Al184  1  0.003538  0.978350  0.304722  1
  Al  Al185  1  0.003538  0.314010  0.279749  1
  Al  Al186  1  0.003538  0.643704  0.330329  1
  Al  Al187  1  0.503538  0.646861  0.291448  1
  Al  Al188  1  0.503538  0.982905  0.268827  1
  Al  Al189  1  0.503538  0.311273  0.317032  1
  Al  Al190  1  0.003538  0.784034  0.314269  1
  Al  Al191  1  0.003538  0.118483  0.287961  1
  Al  Al192  1  0.003538  0.448574  0.338426  1
  Al  Al193  1  0.003538  0.832084  0.399428  1
  Al  Al194  1  0.003538  0.167412  0.372059  1
  Al  Al195  1  0.003538  0.503056  0.346516  1
  Al  Al196  1  0.003538  0.887014  0.407851  1
  Al  Al197  1  0.003538  0.222140  0.380517  1
  Al  Al198  1  0.003538  0.558166  0.355547  1
  Al  Al199  1  0.503538  0.889862  0.369239  1
  Al  Al200  1  0.503538  0.219001  0.419078  1
  Al  Al201  1  0.503538  0.554721  0.393935  1
  Al  Al202  1  0.503538  0.859643  0.403680  1
  Al  Al203  1  0.503538  0.194803  0.376164  1
  Al  Al204  1  0.503538  0.530558  0.350908  1
  Al  Al205  1  0.503538  0.914119  0.411976  1
  Al  Al206  1  0.503538  0.249512  0.384919  1
  Al  Al207  1  0.503538  0.585395  0.360012  1
  Al  Al208  1  0.503538  0.804689  0.395125  1
  Al  Al209  1  0.503538  0.140001  0.368091  1
  Al  Al210  1  0.503538  0.469356  0.419425  1
  Al  Al211  1  0.003538  0.808100  0.356725  1
  Al  Al212  1  0.003538  0.137103  0.406760  1
  Al  Al213  1  0.003538  0.472751  0.380931  1
  Al  Al214  1  0.503538  0.944987  0.377495  1
  Al  Al215  1  0.503538  0.280440  0.350952  1
  Al  Al216  1  0.503538  0.609930  0.403020  1
  Al  Al217  1  0.503538  0.664504  0.411691  1
  Al  Al218  1  0.503538  0.999434  0.386122  1
  Al  Al219  1  0.503538  0.335434  0.359159  1
  Al  Al220  1  0.503538  0.725506  0.343002  1
  Al  Al221  1  0.503538  0.054619  0.394721  1
  Al  Al222  1  0.503538  0.390306  0.367732  1
  Al  Al223  1  0.003538  0.722273  0.381665  1
  Al  Al224  1  0.003538  0.057482  0.356304  1
  Al  Al225  1  0.003538  0.386976  0.406281  1
  Al  Al226  1  0.003538  0.692018  0.416002  1
  Al  Al227  1  0.003538  0.027053  0.390440  1
  Al  Al228  1  0.003538  0.362901  0.363402  1
  Al  Al229  1  0.003538  0.752807  0.347768  1
  Al  Al230  1  0.003538  0.081874  0.398779  1
  Al  Al231  1  0.003538  0.417541  0.372150  1
  Al  Al232  1  0.003538  0.972003  0.381719  1
  Al  Al233  1  0.003538  0.307960  0.355066  1
  Al  Al234  1  0.003538  0.637130  0.407354  1
  Al  Al235  1  0.503538  0.640575  0.368890  1
  Al  Al236  1  0.503538  0.975330  0.343063  1
  Al  Al237  1  0.503538  0.304885  0.393497  1
  Al  Al238  1  0.003538  0.777426  0.390803  1
  Al  Al239  1  0.003538  0.112742  0.364257  1
  Al  Al240  1  0.003538  0.442152  0.415137  1
  Al  Al241  1  0.003538  0.825768  0.476416  1
  Al  Al242  1  0.003538  0.161222  0.449440  1
  Al  Al243  1  0.003538  0.496780  0.423750  1
  Al  Al244  1  0.003538  0.880805  0.484990  1
  Al  Al245  1  0.003538  0.216171  0.457723  1
  Al  Al246  1  0.003538  0.551726  0.432497  1
  Al  Al247  1  0.503538  0.883710  0.446410  1
  Al  Al248  1  0.503538  0.212934  0.496283  1
  Al  Al249  1  0.503538  0.548352  0.471001  1
  Al  Al250  1  0.503538  0.853358  0.480718  1
  Al  Al251  1  0.503538  0.188754  0.453566  1
  Al  Al252  1  0.503538  0.524317  0.428078  1
  Al  Al253  1  0.503538  0.907957  0.489161  1
  Al  Al254  1  0.503538  0.243353  0.461878  1
  Al  Al255  1  0.503538  0.578914  0.436917  1
  Al  Al256  1  0.503538  0.798309  0.472053  1
  Al  Al257  1  0.503538  0.133812  0.445347  1
  Al  Al258  1  0.503538  0.462977  0.496455  1
  Al  Al259  1  0.003538  0.801676  0.433613  1
  Al  Al260  1  0.003538  0.130907  0.483928  1
  Al  Al261  1  0.003538  0.466360  0.457961  1
  Al  Al262  1  0.503538  0.938823  0.454862  1
  Al  Al263  1  0.503538  0.274243  0.427721  1
  Al  Al264  1  0.503538  0.603500  0.480006  1
  Al  Al265  1  0.503538  0.658082  0.488773  1
  Al  Al266  1  0.503538  0.993347  0.463196  1
  Al  Al267  1  0.503538  0.329001  0.436234  1
  Al  Al268  1  0.503538  0.719344  0.420341  1
  Al  Al269  1  0.503538  0.048409  0.471529  1
  Al  Al270  1  0.503538  0.384027  0.444868  1
  Al  Al271  1  0.003538  0.716011  0.458895  1
  Al  Al272  1  0.003538  0.051309  0.433064  1
  Al  Al273  1  0.003538  0.380668  0.483345  1
  Al  Al274  1  0.003538  0.685639  0.493127  1
  Al  Al275  1  0.003538  0.020918  0.467358  1
  Al  Al276  1  0.003538  0.356586  0.440544  1
  Al  Al277  1  0.003538  0.746493  0.424665  1
  Al  Al278  1  0.003538  0.075656  0.475676  1
  Al  Al279  1  0.003538  0.411197  0.449147  1
  Al  Al280  1  0.003538  0.965921  0.459011  1
  Al  Al281  1  0.003538  0.301518  0.431935  1
  Al  Al282  1  0.003538  0.630670  0.484368  1
  Al  Al283  1  0.503538  0.634081  0.445892  1
  Al  Al284  1  0.503538  0.969185  0.420422  1
  Al  Al285  1  0.503538  0.298561  0.470451  1
  Al  Al286  1  0.003538  0.771133  0.467749  1
  Al  Al287  1  0.003538  0.106612  0.441277  1
  Al  Al288  1  0.003538  0.435827  0.492170  1
  Al  Al289  1  0.003538  0.819440  0.553393  1
  Al  Al290  1  0.003538  0.155107  0.526579  1
  Al  Al291  1  0.003538  0.490387  0.500810  1
  Al  Al292  1  0.003538  0.874508  0.562002  1
  Al  Al293  1  0.003538  0.210105  0.534926  1
  Al  Al294  1  0.003538  0.545356  0.509570  1
  Al  Al295  1  0.503538  0.877465  0.523486  1
  Al  Al296  1  0.503538  0.206841  0.573515  1
  Al  Al297  1  0.503538  0.541945  0.548045  1
  Al  Al298  1  0.503538  0.847025  0.557704  1
  Al  Al299  1  0.503538  0.182678  0.530742  1
  Al  Al300  1  0.503538  0.517944  0.505164  1
  Al  Al301  1  0.503538  0.901783  0.566217  1
  Al  Al302  1  0.503538  0.237203  0.539075  1
  Al  Al303  1  0.503538  0.572526  0.513932  1
  Al  Al304  1  0.503538  0.791998  0.549069  1
  Al  Al305  1  0.503538  0.127617  0.522408  1
  Al  Al306  1  0.503538  0.456682  0.573597  1
  Al  Al307  1  0.003538  0.795358  0.510592  1
  Al  Al308  1  0.003538  0.124716  0.560873  1
  Al  Al309  1  0.003538  0.460014  0.535043  1
  Al  Al310  1  0.503538  0.932673  0.532059  1
  Al  Al311  1  0.503538  0.268068  0.504776  1
  Al  Al312  1  0.503538  0.597111  0.557021  1
  Al  Al313  1  0.503538  0.651709  0.565859  1
  Al  Al314  1  0.503538  0.987272  0.540371  1
  Al  Al315  1  0.503538  0.322668  0.513219  1
  Al  Al316  1  0.503538  0.713049  0.497483  1
  Al  Al317  1  0.503538  0.042214  0.548590  1
  Al  Al318  1  0.503538  0.377717  0.521884  1
  Al  Al319  1  0.003538  0.709665  0.535976  1
  Al  Al320  1  0.003538  0.045119  0.510009  1
  Al  Al321  1  0.003538  0.374350  0.560324  1
  Al  Al322  1  0.003538  0.679246  0.570188  1
  Al  Al323  1  0.003538  0.014804  0.544497  1
  Al  Al324  1  0.003538  0.350258  0.517522  1
  Al  Al325  1  0.003538  0.740199  0.501767  1
  Al  Al326  1  0.003538  0.069414  0.552660  1
  Al  Al327  1  0.003538  0.404893  0.526188  1
  Al  Al328  1  0.003538  0.959855  0.536214  1
  Al  Al329  1  0.003538  0.295220  0.508947  1
  Al  Al330  1  0.003538  0.624299  0.561440  1
  Al  Al331  1  0.503538  0.627674  0.522937  1
  Al  Al332  1  0.503538  0.963092  0.497654  1
  Al  Al333  1  0.503538  0.292316  0.547527  1
  Al  Al334  1  0.003538  0.764828  0.544791  1
  Al  Al335  1  0.003538  0.100369  0.518262  1
  Al  Al336  1  0.003538  0.429533  0.569272  1
  Al  Al337  1  0.003538  0.813125  0.630535  1
  Al  Al338  1  0.003538  0.148973  0.603498  1
  Al  Al339  1  0.003538  0.484008  0.577935  1
  Al  Al340  1  0.003538  0.868065  0.638871  1
  Al  Al341  1  0.003538  0.204023  0.612218  1
  Al  Al342  1  0.003538  0.538896  0.586584  1
  Al  Al343  1  0.503538  0.871141  0.600440  1
  Al  Al344  1  0.503538  0.200695  0.650874  1
  Al  Al345  1  0.503538  0.535451  0.625048  1
  Al  Al346  1  0.503538  0.840592  0.634778  1
  Al  Al347  1  0.503538  0.176591  0.607815  1
  Al  Al348  1  0.503538  0.511521  0.582246  1
  Al  Al349  1  0.503538  0.895585  0.642985  1
  Al  Al350  1  0.503538  0.231039  0.616442  1
  Al  Al351  1  0.503538  0.566096  0.590917  1
  Al  Al352  1  0.503538  0.785720  0.626205  1
  Al  Al353  1  0.503538  0.121407  0.599216  1
  Al  Al354  1  0.503538  0.450520  0.650936  1
  Al  Al355  1  0.003538  0.789050  0.587656  1
  Al  Al356  1  0.003538  0.118544  0.637633  1
  Al  Al357  1  0.003538  0.453753  0.612273  1
  Al  Al358  1  0.503538  0.926514  0.609019  1
  Al  Al359  1  0.503538  0.261907  0.581962  1
  Al  Al360  1  0.503538  0.590631  0.633925  1
  Al  Al361  1  0.503538  0.645467  0.643030  1
  Al  Al362  1  0.503538  0.981222  0.617774  1
  Al  Al363  1  0.503538  0.316383  0.590257  1
  Al  Al364  1  0.503538  0.706670  0.574512  1
  Al  Al365  1  0.503538  0.036025  0.625846  1
  Al  Al366  1  0.503538  0.371336  0.598812  1
  Al  Al367  1  0.003538  0.703274  0.613006  1
  Al  Al368  1  0.003538  0.038923  0.587177  1
  Al  Al369  1  0.003538  0.367926  0.637213  1
  Al  Al370  1  0.003538  0.672970  0.647422  1
  Al  Al371  1  0.003538  0.008614  0.621878  1
  Al  Al372  1  0.003538  0.343942  0.594509  1
  Al  Al373  1  0.003538  0.733874  0.578800  1
  Al  Al374  1  0.003538  0.063284  0.629681  1
  Al  Al375  1  0.003538  0.398600  0.603134  1
  Al  Al376  1  0.003538  0.953886  0.613420  1
  Al  Al377  1  0.003538  0.289012  0.586087  1
  Al  Al378  1  0.003538  0.617860  0.638390  1
  Al  Al379  1  0.503538  0.621305  0.600003  1
  Al  Al380  1  0.503538  0.957025  0.574859  1
  Al  Al381  1  0.503538  0.286163  0.624699  1
  Al  Al382  1  0.003538  0.758485  0.621787  1
  Al  Al383  1  0.003538  0.094152  0.595159  1
  Al  Al384  1  0.003538  0.423219  0.646169  1
  Al  Al385  1  0.003538  0.806817  0.706479  1
  Al  Al386  1  0.003538  0.142480  0.680236  1
  Al  Al387  1  0.003538  0.477768  0.655390  1
  Al  Al388  1  0.003538  0.862016  0.714188  1
  Al  Al389  1  0.003538  0.197676  0.689215  1
  Al  Al390  1  0.003538  0.532321  0.663609  1
  Al  Al391  1  0.503538  0.864753  0.676905  1
  Al  Al392  1  0.503538  0.193120  0.725110  1
  Al  Al393  1  0.503538  0.529165  0.702489  1
  Al  Al394  1  0.503538  0.834499  0.710710  1
  Al  Al395  1  0.503538  0.169960  0.684355  1
  Al  Al396  1  0.503538  0.505212  0.659556  1
  Al  Al397  1  0.503538  0.888701  0.718950  1
  Al  Al398  1  0.503538  0.225036  0.693647  1
  Al  Al399  1  0.503538  0.559538  0.667550  1
  Al  Al400  1  0.503538  0.779361  0.701524  1
  Al  Al401  1  0.503538  0.115420  0.676149  1
  Al  Al402  1  0.503538  0.443605  0.724875  1
  Al  Al403  1  0.003538  0.782719  0.664479  1
  Al  Al404  1  0.003538  0.112388  0.715064  1
  Al  Al405  1  0.003538  0.447519  0.689128  1
  Al  Al406  1  0.503538  0.920415  0.685095  1
  Al  Al407  1  0.503538  0.255866  0.658914  1
  Al  Al408  1  0.503538  0.584125  0.710080  1
  Al  Al409  1  0.503538  0.638827  0.718436  1
  Al  Al410  1  0.503538  0.975119  0.694002  1
  Al  Al411  1  0.503538  0.310136  0.667508  1
  Al  Al412  1  0.503538  0.700263  0.651588  1
  Al  Al413  1  0.503538  0.030357  0.701309  1
  Al  Al414  1  0.503538  0.364820  0.675730  1
  Al  Al415  1  0.003538  0.697155  0.691161  1
  Al  Al416  1  0.003538  0.032909  0.664122  1
  Al  Al417  1  0.003538  0.361627  0.714616  1
  Al  Al418  1  0.003538  0.666066  0.722201  1
  Al  Al419  1  0.003538  1.002818  0.697975  1
  Al  Al420  1  0.003538  0.337671  0.671712  1
  Al  Al421  1  0.003538  0.727452  0.655511  1
  Al  Al422  1  0.003538  0.057543  0.705977  1
  Al  Al423  1  0.003538  0.391992  0.679668  1
  Al  Al424  1  0.003538  0.947542  0.690204  1
  Al  Al425  1  0.003538  0.282991  0.663254  1
  Al  Al426  1  0.003538  0.611450  0.713630  1
  Al  Al427  1  0.503538  0.614782  0.676587  1
  Al  Al428  1  0.503538  0.951001  0.651893  1
  Al  Al429  1  0.503538  0.279944  0.702167  1
  Al  Al430  1  0.003538  0.752103  0.697988  1
  Al  Al431  1  0.003538  0.088264  0.671860  1
  Al  Al432  1  0.003538  0.416531  0.722016  1
