# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.40599107
_cell_length_b   14.40717751
_cell_length_c   47.10000628
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.07978686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al252
_cell_volume   9301.33692599
_cell_formula_units_Z   252
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
  Al  Al1  1  0.893363  0.227766  0.319043  1
  Al  Al2  1  0.229697  0.895161  0.320887  1
  Al  Al3  1  0.268609  0.268625  0.299180  1
  Al  Al4  1  0.521285  0.189451  0.341715  1
  Al  Al5  1  0.855051  0.855686  0.341715  1
  Al  Al6  1  0.308852  0.643237  0.280721  1
  Al  Al7  1  0.560755  0.564103  0.320888  1
  Al  Al8  1  0.601846  0.936246  0.299256  1
  Al  Al9  1  0.934224  0.603007  0.299180  1
  Al  Al10  1  0.688400  0.022801  0.341745  1
  Al  Al11  1  0.140738  0.811393  0.281375  1
  Al  Al12  1  0.060596  0.058606  0.318285  1
  Al  Al13  1  0.435127  0.101912  0.299290  1
  Al  Al14  1  0.767510  0.769527  0.299291  1
  Al  Al15  1  0.100852  0.435252  0.299191  1
  Al  Al16  1  0.477010  0.475123  0.281376  1
  Al  Al17  1  0.394823  0.729230  0.320470  1
  Al  Al18  1  0.724201  0.395000  0.318284  1
  Al  Al19  1  0.875343  0.042522  0.330362  1
  Al  Al20  1  0.208134  0.708608  0.332047  1
  Al  Al21  1  0.247419  0.081100  0.309138  1
  Al  Al22  1  0.622662  0.123996  0.290437  1
  Al  Al23  1  0.954988  0.790826  0.290122  1
  Al  Al24  1  0.288320  0.456044  0.289422  1
  Al  Al25  1  0.541883  0.374812  0.331666  1
  Al  Al26  1  0.580174  0.748410  0.309000  1
  Al  Al27  1  0.913398  0.415119  0.309234  1
  Al  Al28  1  0.708116  0.209749  0.330363  1
  Al  Al29  1  0.040410  0.876287  0.331664  1
  Al  Al30  1  0.080718  0.247801  0.309234  1
  Al  Al31  1  0.456439  0.289384  0.290122  1
  Al  Al32  1  0.789607  0.957051  0.290437  1
  Al  Al33  1  0.121648  0.622714  0.289422  1
  Al  Al34  1  0.374209  0.542534  0.332047  1
  Al  Al35  1  0.414007  0.914577  0.309000  1
  Al  Al36  1  0.746697  0.581820  0.309138  1
  Al  Al37  1  0.777772  0.112178  0.382350  1
  Al  Al38  1  0.110212  0.779033  0.383054  1
  Al  Al39  1  0.149062  0.150203  0.360967  1
  Al  Al40  1  0.404670  0.072500  0.403418  1
  Al  Al41  1  0.738094  0.739076  0.403418  1
  Al  Al42  1  0.188366  0.522768  0.341170  1
  Al  Al43  1  0.444627  0.444617  0.383055  1
  Al  Al44  1  0.483637  0.818043  0.361623  1
  Al  Al45  1  0.815798  0.483467  0.360968  1
  Al  Al46  1  0.571417  0.905822  0.403435  1
  Al  Al47  1  0.022237  0.689079  0.341340  1
  Al  Al48  1  0.943403  0.946045  0.382873  1
  Al  Al49  1  0.317009  0.984806  0.361658  1
  Al  Al50  1  0.650401  0.651415  0.361659  1
  Al  Al51  1  0.982588  0.316992  0.361043  1
  Al  Al52  1  0.354677  0.356639  0.341340  1
  Al  Al53  1  0.277221  0.611626  0.383360  1
  Al  Al54  1  0.611640  0.277807  0.382873  1
  Al  Al55  1  0.757605  0.925405  0.393279  1
  Al  Al56  1  0.090688  0.591681  0.393219  1
  Al  Al57  1  0.130195  0.965579  0.372027  1
  Al  Al58  1  0.502391  1.003433  0.351050  1
  Al  Al59  1  0.835794  0.669742  0.351066  1
  Al  Al60  1  0.168733  0.336510  0.351055  1
  Al  Al61  1  0.424018  0.258678  0.393260  1
  Al  Al62  1  0.463998  0.631787  0.372492  1
  Al  Al63  1  0.797199  0.298419  0.371509  1
  Al  Al64  1  0.591001  0.092009  0.393279  1
  Al  Al65  1  0.924273  0.758423  0.393260  1
  Al  Al66  1  0.964013  0.131605  0.371509  1
  Al  Al67  1  0.335338  0.170197  0.351066  1
  Al  Al68  1  0.669030  0.836795  0.351050  1
  Al  Al69  1  1.002106  0.503137  0.351055  1
  Al  Al70  1  0.257277  0.425092  0.393219  1
  Al  Al71  1  0.297381  0.798404  0.372492  1
  Al  Al72  1  0.631174  0.464601  0.372028  1
  Al  Al73  1  0.659527  0.993934  0.445298  1
  Al  Al74  1  0.992713  0.660439  0.445274  1
  Al  Al75  1  0.032080  0.033532  0.424241  1
  Al  Al76  1  0.286912  0.954744  0.466098  1
  Al  Al77  1  0.620336  0.621320  0.466098  1
  Al  Al78  1  0.070953  0.405358  0.403220  1
  Al  Al79  1  0.326032  0.327120  0.445274  1
  Al  Al80  1  0.365611  0.700018  0.424592  1
  Al  Al81  1  0.699126  0.366487  0.424241  1
  Al  Al82  1  0.453644  0.788053  0.466173  1
  Al  Al83  1  0.904365  0.571988  0.403231  1
  Al  Al84  1  0.826167  0.827249  0.445299  1
  Al  Al85  1  0.198745  0.866880  0.424431  1
  Al  Al86  1  0.532473  0.533152  0.424432  1
  Al  Al87  1  0.865573  0.199980  0.424032  1
  Al  Al88  1  0.237583  0.238770  0.403231  1
  Al  Al89  1  0.159352  0.493759  0.445277  1
  Al  Al90  1  0.492842  0.160574  0.445299  1
  Al  Al91  1  0.639913  0.807626  0.455656  1
  Al  Al92  1  0.973116  0.474159  0.455499  1
  Al  Al93  1  0.012337  0.847119  0.434931  1
  Al  Al94  1  0.385204  0.886348  0.413946  1
  Al  Al95  1  0.718597  0.552716  0.413747  1
  Al  Al96  1  0.051609  0.219420  0.413534  1
  Al  Al97  1  0.306465  0.140950  0.455579  1
  Al  Al98  1  0.345927  0.513385  0.435044  1
  Al  Al99  1  0.679459  0.180145  0.434811  1
  Al  Al100  1  0.473218  0.974321  0.455656  1
  Al  Al101  1  0.806543  0.640872  0.455579  1
  Al  Al102  1  0.845739  0.013865  0.434811  1
  Al  Al103  1  0.218310  0.053003  0.413747  1
  Al  Al104  1  0.551941  0.719611  0.413946  1
  Al  Al105  1  0.885014  0.386015  0.413534  1
  Al  Al106  1  0.139752  0.307523  0.455499  1
  Al  Al107  1  0.178978  0.680334  0.435043  1
  Al  Al108  1  0.512712  0.346743  0.434932  1
  Al  Al109  1  0.541718  0.876128  0.507838  1
  Al  Al110  1  0.875040  0.542846  0.507732  1
  Al  Al111  1  0.914336  0.915486  0.487013  1
  Al  Al112  1  0.169211  0.836855  0.528854  1
  Al  Al113  1  0.502445  0.503621  0.528854  1
  Al  Al114  1  0.953562  0.287969  0.465882  1
  Al  Al115  1  0.208437  0.209449  0.507733  1
  Al  Al116  1  0.247691  0.582099  0.487126  1
  Al  Al117  1  0.581077  0.248745  0.487013  1
  Al  Al118  1  0.335862  0.670272  0.528939  1
  Al  Al119  1  0.786978  0.454620  0.465967  1
  Al  Al120  1  0.708346  0.709497  0.507808  1
  Al  Al121  1  0.080986  0.748792  0.487089  1
  Al  Al122  1  0.414383  0.415395  0.487089  1
  Al  Al123  1  0.747705  0.082113  0.486983  1
  Al  Al124  1  0.120212  0.121386  0.465967  1
  Al  Al125  1  0.041733  0.376142  0.507695  1
  Al  Al126  1  0.375087  0.042755  0.507808  1
  Al  Al127  1  0.522030  0.689864  0.518378  1
  Al  Al128  1  0.855377  0.356526  0.518147  1
  Al  Al129  1  0.894716  0.729116  0.497411  1
  Al  Al130  1  0.267307  0.768455  0.476675  1
  Al  Al131  1  0.600735  0.435028  0.476563  1
  Al  Al132  1  0.933969  0.101801  0.476443  1
  Al  Al133  1  0.188803  0.023098  0.518259  1
  Al  Al134  1  0.228043  0.395789  0.497411  1
  Al  Al135  1  0.561378  0.062454  0.497411  1
  Al  Al136  1  0.355454  0.856440  0.518378  1
  Al  Al137  1  0.688688  0.523213  0.518258  1
  Al  Al138  1  0.728045  0.895787  0.497411  1
  Al  Al139  1  0.100620  0.935143  0.476563  1
  Al  Al140  1  0.434047  0.601715  0.476675  1
  Al  Al141  1  0.767393  0.268377  0.476443  1
  Al  Al142  1  0.022117  0.189786  0.518147  1
  Al  Al143  1  0.061380  0.562452  0.497411  1
  Al  Al144  1  0.394707  0.229125  0.497411  1
  Al  Al145  1  0.423850  0.758261  0.570789  1
  Al  Al146  1  0.756950  0.425089  0.570390  1
  Al  Al147  1  0.796581  0.797667  0.549522  1
  Al  Al148  1  0.051840  0.719471  0.591591  1
  Al  Al149  1  0.385058  0.386253  0.591590  1
  Al  Al150  1  0.835779  0.170189  0.528649  1
  Al  Al151  1  0.090678  0.091361  0.570390  1
  Al  Al152  1  0.130071  0.464482  0.549544  1
  Al  Al153  1  0.463256  0.130992  0.549522  1
  Al  Al154  1  0.218471  0.552884  0.591601  1
  Al  Al155  1  0.669087  0.336921  0.528724  1
  Al  Al156  1  0.590298  0.591755  0.570580  1
  Al  Al157  1  0.963392  0.631122  0.549548  1
  Al  Al158  1  0.296710  0.297803  0.549548  1
  Al  Al159  1  0.629896  0.964308  0.549524  1
  Al  Al160  1  1.002511  1.003497  0.528724  1
  Al  Al161  1  0.923812  0.258223  0.570229  1
  Al  Al162  1  0.257343  0.924709  0.570580  1
  Al  Al163  1  0.404409  0.572227  0.581287  1
  Al  Al164  1  0.737482  0.238630  0.580875  1
  Al  Al165  1  0.776711  0.611498  0.559890  1
  Al  Al166  1  0.149671  0.650718  0.539323  1
  Al  Al167  1  0.482881  0.317369  0.539242  1
  Al  Al168  1  0.816205  0.983921  0.539165  1
  Al  Al169  1  0.071113  0.905238  0.581074  1
  Al  Al170  1  0.110445  0.277907  0.559778  1
  Al  Al171  1  0.443684  0.944376  0.560010  1
  Al  Al172  1  0.237815  0.738822  0.581287  1
  Al  Al173  1  0.570827  0.405525  0.581074  1
  Al  Al174  1  0.609965  0.778096  0.560010  1
  Al  Al175  1  0.982959  0.817291  0.539242  1
  Al  Al176  1  0.316307  0.484082  0.539323  1
  Al  Al177  1  0.649510  0.150615  0.539165  1
  Al  Al178  1  0.904219  0.071894  0.580875  1
  Al  Al179  1  0.943496  0.444856  0.559778  1
  Al  Al180  1  0.277086  0.111122  0.559890  1
  Al  Al181  1  0.306835  0.641249  0.633778  1
  Al  Al182  1  0.639022  0.306826  0.633163  1
  Al  Al183  1  0.677783  0.680435  0.611948  1
  Al  Al184  1  0.934747  0.601603  0.653482  1
  Al  Al185  1  0.267186  0.269163  0.653481  1
  Al  Al186  1  0.718007  0.052419  0.591387  1
  Al  Al187  1  0.972414  0.973435  0.633163  1
  Al  Al188  1  0.012202  0.346615  0.611461  1
  Al  Al189  1  0.346021  0.012196  0.611948  1
  Al  Al190  1  0.101057  0.435473  0.653651  1
  Al  Al191  1  0.551329  0.219166  0.591403  1
  Al  Al192  1  0.473625  0.474775  0.633854  1
  Al  Al193  1  0.844796  0.513624  0.611766  1
  Al  Al194  1  0.179211  0.179208  0.611767  1
  Al  Al195  1  0.511651  0.846064  0.612471  1
  Al  Al196  1  0.884753  0.885741  0.591403  1
  Al  Al197  1  0.805786  0.140198  0.633198  1
  Al  Al198  1  0.140361  0.808039  0.633854  1
  Al  Al199  1  0.287317  0.455105  0.643766  1
  Al  Al200  1  0.620394  0.121446  0.643771  1
  Al  Al201  1  0.658250  0.493641  0.622793  1
  Al  Al202  1  0.032147  0.533149  0.601602  1
  Al  Al203  1  0.365150  0.199819  0.601561  1
  Al  Al204  1  0.698423  0.866232  0.601543  1
  Al  Al205  1  0.954085  0.788044  0.643756  1
  Al  Al206  1  0.992042  0.159837  0.622330  1
  Al  Al207  1  0.325410  0.826637  0.623312  1
  Al  Al208  1  0.120690  0.621732  0.643766  1
  Al  Al209  1  0.453629  0.288499  0.643755  1
  Al  Al210  1  0.492224  0.659822  0.623312  1
  Al  Al211  1  0.865405  0.699564  0.601562  1
  Al  Al212  1  0.198736  0.366560  0.601602  1
  Al  Al213  1  0.531819  0.032836  0.601542  1
  Al  Al214  1  0.787032  0.954808  0.643771  1
  Al  Al215  1  0.825425  0.326454  0.622329  1
  Al  Al216  1  0.159228  0.992662  0.622794  1
  Al  Al217  1  0.188571  0.522989  0.695630  1
  Al  Al218  1  0.521913  0.188715  0.695530  1
  Al  Al219  1  0.565222  0.563241  0.676537  1
  Al  Al220  1  0.812414  0.483119  0.713445  1
  Al  Al221  1  0.148686  0.146849  0.713446  1
  Al  Al222  1  0.601023  0.935440  0.653076  1
  Al  Al223  1  0.854296  0.856329  0.695531  1
  Al  Al224  1  0.894600  0.229011  0.674351  1
  Al  Al225  1  0.228827  0.899635  0.676536  1
  Al  Al226  1  0.980571  0.315004  0.714100  1
  Al  Al227  1  0.434373  0.102556  0.653106  1
  Al  Al228  1  0.355200  0.355234  0.695641  1
  Al  Al229  1  0.728668  0.394138  0.673934  1
  Al  Al230  1  0.059727  0.063080  0.673934  1
  Al  Al231  1  0.396060  0.730476  0.675778  1
  Al  Al232  1  0.768139  0.768790  0.653106  1
  Al  Al233  1  0.687578  0.021996  0.695565  1
  Al  Al234  1  0.020814  0.689616  0.695641  1
  Al  Al235  1  0.167775  0.335527  0.705399  1
  Al  Al236  1  0.499817  1.001190  0.704384  1
  Al  Al237  1  0.542726  0.376421  0.685683  1
  Al  Al238  1  0.915215  0.415708  0.662774  1
  Al  Al239  1  0.249014  0.081954  0.663157  1
  Al  Al240  1  0.581307  0.748492  0.664459  1
  Al  Al241  1  0.832985  0.668857  0.704699  1
  Al  Al242  1  0.875416  0.043664  0.685821  1
  Al  Al243  1  0.208705  0.710441  0.685588  1
  Al  Al244  1  1.001103  0.502197  0.705399  1
  Al  Al245  1  0.334435  0.167415  0.704699  1
  Al  Al246  1  0.376025  0.543122  0.685587  1
  Al  Al247  1  0.747540  0.583429  0.663155  1
  Al  Al248  1  0.081290  0.249633  0.662774  1
  Al  Al249  1  0.414080  0.915720  0.664459  1
  Al  Al250  1  0.666761  0.834245  0.704384  1
  Al  Al251  1  0.709249  0.209832  0.685821  1
  Al  Al252  1  0.042005  0.877141  0.685684  1
