# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.48232201
_cell_length_b   14.47932363
_cell_length_c   47.11981407
_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   9401.39729731
_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  0.795705  0.130311  0.288437  1
  Al  Al2  1  0.129038  0.796977  0.288437  1
  Al  Al3  1  0.051836  0.053084  0.326795  1
  Al  Al4  1  0.424920  0.092829  0.307713  1
  Al  Al5  1  0.758253  0.759495  0.307713  1
  Al  Al6  1  0.091587  0.426162  0.307713  1
  Al  Al7  1  0.462371  0.463644  0.288437  1
  Al  Al8  1  0.385169  0.719750  0.326795  1
  Al  Al9  1  0.718503  0.386417  0.326795  1
  Al  Al10  1  0.885169  0.219750  0.326795  1
  Al  Al11  1  0.218503  0.886417  0.326795  1
  Al  Al12  1  0.258253  0.259495  0.307713  1
  Al  Al13  1  0.629038  0.296977  0.288437  1
  Al  Al14  1  0.962371  0.963644  0.288437  1
  Al  Al15  1  0.295705  0.630311  0.288437  1
  Al  Al16  1  0.551836  0.553084  0.326795  1
  Al  Al17  1  0.591587  0.926162  0.307713  1
  Al  Al18  1  0.924920  0.592829  0.307713  1
  Al  Al19  1  0.698500  0.199754  0.338360  1
  Al  Al20  1  0.031834  0.866421  0.338360  1
  Al  Al21  1  0.071999  0.239911  0.317699  1
  Al  Al22  1  0.444300  0.278879  0.297661  1
  Al  Al23  1  0.777633  0.945546  0.297661  1
  Al  Al24  1  0.110966  0.612213  0.297661  1
  Al  Al25  1  0.365167  0.533088  0.338360  1
  Al  Al26  1  0.405333  0.906577  0.317699  1
  Al  Al27  1  0.738666  0.573244  0.317699  1
  Al  Al28  1  0.865167  0.033088  0.338360  1
  Al  Al29  1  0.198500  0.699754  0.338360  1
  Al  Al30  1  0.238666  0.073244  0.317699  1
  Al  Al31  1  0.610966  0.112213  0.297661  1
  Al  Al32  1  0.944300  0.778879  0.297661  1
  Al  Al33  1  0.277633  0.445546  0.297661  1
  Al  Al34  1  0.531834  0.366421  0.338360  1
  Al  Al35  1  0.571999  0.739911  0.317699  1
  Al  Al36  1  0.905333  0.406577  0.317699  1
  Al  Al37  1  0.679047  0.013623  0.348099  1
  Al  Al38  1  0.012380  0.680290  0.348099  1
  Al  Al39  1  0.934315  0.935559  0.390011  1
  Al  Al40  1  0.306771  0.974679  0.368397  1
  Al  Al41  1  0.640105  0.641346  0.368397  1
  Al  Al42  1  0.973438  0.308013  0.368397  1
  Al  Al43  1  0.345714  0.346957  0.348099  1
  Al  Al44  1  0.267648  0.602226  0.390011  1
  Al  Al45  1  0.600982  0.268893  0.390011  1
  Al  Al46  1  0.767648  0.102226  0.390011  1
  Al  Al47  1  0.100982  0.768893  0.390011  1
  Al  Al48  1  0.140105  0.141346  0.368397  1
  Al  Al49  1  0.512380  0.180290  0.348099  1
  Al  Al50  1  0.845714  0.846957  0.348099  1
  Al  Al51  1  0.179047  0.513623  0.348099  1
  Al  Al52  1  0.434315  0.435559  0.390011  1
  Al  Al53  1  0.473438  0.808013  0.368397  1
  Al  Al54  1  0.806771  0.474679  0.368397  1
  Al  Al55  1  0.581010  0.082251  0.400315  1
  Al  Al56  1  0.914343  0.748918  0.400315  1
  Al  Al57  1  0.954291  0.122200  0.378708  1
  Al  Al58  1  0.326091  0.160665  0.358262  1
  Al  Al59  1  0.659425  0.827331  0.358262  1
  Al  Al60  1  0.992758  0.493998  0.358262  1
  Al  Al61  1  0.247677  0.415585  0.400315  1
  Al  Al62  1  0.287624  0.788867  0.378708  1
  Al  Al63  1  0.620958  0.455534  0.378708  1
  Al  Al64  1  0.747677  0.915585  0.400315  1
  Al  Al65  1  0.081010  0.582251  0.400315  1
  Al  Al66  1  0.120958  0.955534  0.378708  1
  Al  Al67  1  0.492758  0.993998  0.358262  1
  Al  Al68  1  0.826091  0.660665  0.358262  1
  Al  Al69  1  0.159425  0.327331  0.358262  1
  Al  Al70  1  0.414343  0.248918  0.400315  1
  Al  Al71  1  0.454291  0.622200  0.378708  1
  Al  Al72  1  0.787624  0.288867  0.378708  1
  Al  Al73  1  0.561319  0.895892  0.410580  1
  Al  Al74  1  0.894652  0.562559  0.410580  1
  Al  Al75  1  0.816204  0.817440  0.452616  1
  Al  Al76  1  0.189053  0.856958  0.431462  1
  Al  Al77  1  0.522387  0.523625  0.431462  1
  Al  Al78  1  0.855720  0.190291  0.431462  1
  Al  Al79  1  0.227986  0.229225  0.410580  1
  Al  Al80  1  0.149537  0.484107  0.452616  1
  Al  Al81  1  0.482871  0.150773  0.452616  1
  Al  Al82  1  0.649537  0.984107  0.452616  1
  Al  Al83  1  0.982871  0.650773  0.452616  1
  Al  Al84  1  0.022387  0.023625  0.431462  1
  Al  Al85  1  0.394652  0.062559  0.410580  1
  Al  Al86  1  0.727986  0.729225  0.410580  1
  Al  Al87  1  0.061319  0.395892  0.410580  1
  Al  Al88  1  0.316204  0.317440  0.452616  1
  Al  Al89  1  0.355720  0.690291  0.431462  1
  Al  Al90  1  0.689053  0.356958  0.431462  1
  Al  Al91  1  0.463205  0.964440  0.463003  1
  Al  Al92  1  0.796538  0.631107  0.463003  1
  Al  Al93  1  0.835968  0.003872  0.442217  1
  Al  Al94  1  0.208489  0.043061  0.420901  1
  Al  Al95  1  0.541822  0.709728  0.420901  1
  Al  Al96  1  0.875156  0.376395  0.420901  1
  Al  Al97  1  0.129872  0.297774  0.463003  1
  Al  Al98  1  0.169301  0.670539  0.442217  1
  Al  Al99  1  0.502635  0.337205  0.442217  1
  Al  Al100  1  0.629872  0.797774  0.463003  1
  Al  Al101  1  0.963205  0.464440  0.463003  1
  Al  Al102  1  0.002635  0.837205  0.442217  1
  Al  Al103  1  0.375156  0.876395  0.420901  1
  Al  Al104  1  0.708489  0.543061  0.420901  1
  Al  Al105  1  0.041822  0.209728  0.420901  1
  Al  Al106  1  0.296538  0.131107  0.463003  1
  Al  Al107  1  0.335968  0.503872  0.442217  1
  Al  Al108  1  0.669301  0.170539  0.442217  1
  Al  Al109  1  0.443671  0.778238  0.473460  1
  Al  Al110  1  0.777004  0.444905  0.473460  1
  Al  Al111  1  0.698376  0.699606  0.515456  1
  Al  Al112  1  0.071123  0.739022  0.494517  1
  Al  Al113  1  0.404457  0.405689  0.494517  1
  Al  Al114  1  0.737790  0.072355  0.494517  1
  Al  Al115  1  0.110337  0.111571  0.473460  1
  Al  Al116  1  0.031709  0.366273  0.515456  1
  Al  Al117  1  0.365043  0.032939  0.515456  1
  Al  Al118  1  0.531709  0.866273  0.515456  1
  Al  Al119  1  0.865043  0.532939  0.515456  1
  Al  Al120  1  0.904457  0.905689  0.494517  1
  Al  Al121  1  0.277004  0.944905  0.473460  1
  Al  Al122  1  0.610337  0.611571  0.473460  1
  Al  Al123  1  0.943671  0.278238  0.473460  1
  Al  Al124  1  0.198376  0.199606  0.515456  1
  Al  Al125  1  0.237790  0.572355  0.494517  1
  Al  Al126  1  0.571123  0.239022  0.494517  1
  Al  Al127  1  0.345508  0.846737  0.525989  1
  Al  Al128  1  0.678842  0.513404  0.525989  1
  Al  Al129  1  0.718056  0.885953  0.504932  1
  Al  Al130  1  0.090803  0.925369  0.483993  1
  Al  Al131  1  0.424136  0.592036  0.483993  1
  Al  Al132  1  0.757470  0.258703  0.483993  1
  Al  Al133  1  0.012175  0.180070  0.525989  1
  Al  Al134  1  0.051389  0.552620  0.504932  1
  Al  Al135  1  0.384722  0.219286  0.504932  1
  Al  Al136  1  0.512175  0.680070  0.525989  1
  Al  Al137  1  0.845508  0.346737  0.525989  1
  Al  Al138  1  0.884722  0.719286  0.504932  1
  Al  Al139  1  0.257470  0.758703  0.483993  1
  Al  Al140  1  0.590803  0.425369  0.483993  1
  Al  Al141  1  0.924136  0.092036  0.483993  1
  Al  Al142  1  0.178842  0.013404  0.525989  1
  Al  Al143  1  0.218056  0.385953  0.504932  1
  Al  Al144  1  0.551389  0.052620  0.504932  1
  Al  Al145  1  0.325974  0.660535  0.536446  1
  Al  Al146  1  0.659307  0.327202  0.536446  1
  Al  Al147  1  0.580690  0.581914  0.578548  1
  Al  Al148  1  0.953211  0.621103  0.557232  1
  Al  Al149  1  0.286544  0.287770  0.557232  1
  Al  Al150  1  0.619878  0.954436  0.557232  1
  Al  Al151  1  0.992641  0.993868  0.536446  1
  Al  Al152  1  0.914023  0.248581  0.578548  1
  Al  Al153  1  0.247357  0.915247  0.578548  1
  Al  Al154  1  0.414023  0.748581  0.578548  1
  Al  Al155  1  0.747357  0.415247  0.578548  1
  Al  Al156  1  0.786544  0.787770  0.557232  1
  Al  Al157  1  0.159307  0.827202  0.536446  1
  Al  Al158  1  0.492641  0.493868  0.536446  1
  Al  Al159  1  0.825974  0.160535  0.536446  1
  Al  Al160  1  0.080690  0.081914  0.578548  1
  Al  Al161  1  0.119878  0.454436  0.557232  1
  Al  Al162  1  0.453211  0.121103  0.557232  1
  Al  Al163  1  0.227860  0.729083  0.588870  1
  Al  Al164  1  0.561193  0.395750  0.588870  1
  Al  Al165  1  0.600126  0.768017  0.567988  1
  Al  Al166  1  0.972975  0.807535  0.546833  1
  Al  Al167  1  0.306308  0.474202  0.546833  1
  Al  Al168  1  0.639642  0.140868  0.546833  1
  Al  Al169  1  0.894527  0.062416  0.588870  1
  Al  Al170  1  0.933459  0.434684  0.567988  1
  Al  Al171  1  0.266792  0.101350  0.567988  1
  Al  Al172  1  0.394527  0.562416  0.588870  1
  Al  Al173  1  0.727860  0.229083  0.588870  1
  Al  Al174  1  0.766792  0.601350  0.567988  1
  Al  Al175  1  0.139642  0.640868  0.546833  1
  Al  Al176  1  0.472975  0.307535  0.546833  1
  Al  Al177  1  0.806308  0.974202  0.546833  1
  Al  Al178  1  0.061193  0.895750  0.588870  1
  Al  Al179  1  0.100126  0.268017  0.567988  1
  Al  Al180  1  0.433459  0.934684  0.567988  1
  Al  Al181  1  0.208169  0.542724  0.599134  1
  Al  Al182  1  0.541502  0.209390  0.599134  1
  Al  Al183  1  0.463087  0.464311  0.641187  1
  Al  Al184  1  0.834888  0.502775  0.620742  1
  Al  Al185  1  0.168221  0.169441  0.620742  1
  Al  Al186  1  0.501555  0.836108  0.620742  1
  Al  Al187  1  0.874836  0.876057  0.599134  1
  Al  Al188  1  0.796421  0.130977  0.641187  1
  Al  Al189  1  0.129754  0.797644  0.641187  1
  Al  Al190  1  0.296421  0.630977  0.641187  1
  Al  Al191  1  0.629754  0.297644  0.641187  1
  Al  Al192  1  0.668221  0.669441  0.620742  1
  Al  Al193  1  0.041502  0.709390  0.599134  1
  Al  Al194  1  0.374836  0.376057  0.599134  1
  Al  Al195  1  0.708169  0.042724  0.599134  1
  Al  Al196  1  0.963087  0.964311  0.641187  1
  Al  Al197  1  1.001555  0.336108  0.620742  1
  Al  Al198  1  0.334888  1.002775  0.620742  1
  Al  Al199  1  0.110132  0.611352  0.651350  1
  Al  Al200  1  0.443465  0.278018  0.651350  1
  Al  Al201  1  0.482408  0.650296  0.631053  1
  Al  Al202  1  0.854864  0.689416  0.609438  1
  Al  Al203  1  0.188197  0.356083  0.609438  1
  Al  Al204  1  0.521531  0.022749  0.609438  1
  Al  Al205  1  0.776799  0.944685  0.651350  1
  Al  Al206  1  0.815741  0.316963  0.631053  1
  Al  Al207  1  0.149074  0.983629  0.631053  1
  Al  Al208  1  0.276799  0.444685  0.651350  1
  Al  Al209  1  0.610132  0.111352  0.651350  1
  Al  Al210  1  0.649074  0.483629  0.631053  1
  Al  Al211  1  0.021531  0.522749  0.609438  1
  Al  Al212  1  0.354864  0.189416  0.609438  1
  Al  Al213  1  0.688197  0.856083  0.609438  1
  Al  Al214  1  0.943465  0.778018  0.651350  1
  Al  Al215  1  0.982408  0.150296  0.631053  1
  Al  Al216  1  0.315741  0.816963  0.631053  1
  Al  Al217  1  0.090679  0.425221  0.661090  1
  Al  Al218  1  0.424012  0.091888  0.661090  1
  Al  Al219  1  0.344879  0.346096  0.701789  1
  Al  Al220  1  0.717180  0.385065  0.681751  1
  Al  Al221  1  0.050513  0.051731  0.681751  1
  Al  Al222  1  0.383846  0.718398  0.681751  1
  Al  Al223  1  0.757345  0.758554  0.661090  1
  Al  Al224  1  0.678213  0.012762  0.701789  1
  Al  Al225  1  0.011546  0.679429  0.701789  1
  Al  Al226  1  0.178213  0.512762  0.701789  1
  Al  Al227  1  0.511546  0.179429  0.701789  1
  Al  Al228  1  0.550513  0.551731  0.681751  1
  Al  Al229  1  0.924012  0.591888  0.661090  1
  Al  Al230  1  0.257345  0.258554  0.661090  1
  Al  Al231  1  0.590679  0.925221  0.661090  1
  Al  Al232  1  0.844879  0.846096  0.701789  1
  Al  Al233  1  0.883846  0.218398  0.681751  1
  Al  Al234  1  0.217180  0.885065  0.681751  1
  Al  Al235  1  0.993474  0.494665  0.711012  1
  Al  Al236  1  0.326808  0.161331  0.711012  1
  Al  Al237  1  0.364259  0.532147  0.691736  1
  Al  Al238  1  0.737343  0.571892  0.672655  1
  Al  Al239  1  0.070676  0.238558  0.672655  1
  Al  Al240  1  0.404010  0.905225  0.672655  1
  Al  Al241  1  0.660141  0.827998  0.711012  1
  Al  Al242  1  0.697592  0.198813  0.691736  1
  Al  Al243  1  0.030926  0.865480  0.691736  1
  Al  Al244  1  0.160141  0.327998  0.711012  1
  Al  Al245  1  0.493474  0.994665  0.711012  1
  Al  Al246  1  0.530926  0.365480  0.691736  1
  Al  Al247  1  0.904010  0.405225  0.672655  1
  Al  Al248  1  0.237343  0.071892  0.672655  1
  Al  Al249  1  0.570676  0.738558  0.672655  1
  Al  Al250  1  0.826808  0.661331  0.711012  1
  Al  Al251  1  0.864259  0.032147  0.691736  1
  Al  Al252  1  0.197592  0.698813  0.691736  1
