# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.43789052
_cell_length_b   14.43744980
_cell_length_c   47.50704990
_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   9422.25073379
_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  0.765418  0.268447  0.299727  1
  Al  Al2  1  0.098427  0.933422  0.299825  1
  Al  Al3  1  0.137524  0.306602  0.283222  1
  Al  Al4  1  0.389122  0.224115  0.315748  1
  Al  Al5  1  0.726177  0.895375  0.319827  1
  Al  Al6  1  0.060382  0.561171  0.319827  1
  Al  Al7  1  0.433452  0.600412  0.299727  1
  Al  Al8  1  0.471601  0.972526  0.283222  1
  Al  Al9  1  0.686136  0.521131  0.341756  1
  Al  Al10  1  0.933452  0.100412  0.299727  1
  Al  Al11  1  0.265418  0.768447  0.299727  1
  Al  Al12  1  0.186136  0.021131  0.341756  1
  Al  Al13  1  0.560382  0.061171  0.319827  1
  Al  Al14  1  0.889122  0.724115  0.315748  1
  Al  Al15  1  0.226177  0.395375  0.319827  1
  Al  Al16  1  0.598427  0.433422  0.299825  1
  Al  Al17  1  0.637524  0.806602  0.283222  1
  Al  Al18  1  0.971601  0.472526  0.283222  1
  Al  Al19  1  0.744785  0.079780  0.308686  1
  Al  Al20  1  0.078149  0.746378  0.309241  1
  Al  Al21  1  0.122015  0.120874  0.290804  1
  Al  Al22  1  0.371099  0.043096  0.331267  1
  Al  Al23  1  0.708101  0.706094  0.331266  1
  Al  Al24  1  0.038851  0.373847  0.332830  1
  Al  Al25  1  0.411383  0.413143  0.309240  1
  Al  Al26  1  0.451292  0.786289  0.290366  1
  Al  Al27  1  0.785878  0.457013  0.290805  1
  Al  Al28  1  0.951292  0.286289  0.290366  1
  Al  Al29  1  0.285878  0.957013  0.290805  1
  Al  Al30  1  0.208101  0.206094  0.331266  1
  Al  Al31  1  0.578149  0.246378  0.309241  1
  Al  Al32  1  0.911383  0.913143  0.309240  1
  Al  Al33  1  0.244785  0.579780  0.308686  1
  Al  Al34  1  0.622015  0.620874  0.290804  1
  Al  Al35  1  0.538851  0.873847  0.332830  1
  Al  Al36  1  0.871099  0.543096  0.331267  1
  Al  Al37  1  0.648241  0.149904  0.361358  1
  Al  Al38  1  0.980129  0.815122  0.360499  1
  Al  Al39  1  0.019592  0.188192  0.341577  1
  Al  Al40  1  0.275389  0.110383  0.383251  1
  Al  Al41  1  0.609571  0.776356  0.382895  1
  Al  Al42  1  0.941362  0.444565  0.382895  1
  Al  Al43  1  0.314910  0.483235  0.361358  1
  Al  Al44  1  0.353198  0.854587  0.341577  1
  Al  Al45  1  0.568581  0.403575  0.403004  1
  Al  Al46  1  0.814910  0.983235  0.361358  1
  Al  Al47  1  0.148241  0.649904  0.361358  1
  Al  Al48  1  0.068581  0.903575  0.403004  1
  Al  Al49  1  0.441362  0.944565  0.382895  1
  Al  Al50  1  0.775389  0.610383  0.383251  1
  Al  Al51  1  0.109571  0.276356  0.382895  1
  Al  Al52  1  0.480129  0.315122  0.360499  1
  Al  Al53  1  0.519592  0.688192  0.341577  1
  Al  Al54  1  0.853198  0.354587  0.341577  1
  Al  Al55  1  0.628811  0.963804  0.371899  1
  Al  Al56  1  0.961657  0.631258  0.371316  1
  Al  Al57  1  1.000237  1.001815  0.351125  1
  Al  Al58  1  0.255219  0.923528  0.393166  1
  Al  Al59  1  0.588534  0.590212  0.393166  1
  Al  Al60  1  0.922004  0.256998  0.393151  1
  Al  Al61  1  0.296265  0.296650  0.371316  1
  Al  Al62  1  0.333471  0.668465  0.350947  1
  Al  Al63  1  0.666821  0.335231  0.351125  1
  Al  Al64  1  0.833471  0.168465  0.350947  1
  Al  Al65  1  0.166821  0.835231  0.351125  1
  Al  Al66  1  0.088534  0.090212  0.393166  1
  Al  Al67  1  0.461657  0.131258  0.371316  1
  Al  Al68  1  0.796265  0.796650  0.371316  1
  Al  Al69  1  0.128811  0.463804  0.371899  1
  Al  Al70  1  0.500237  0.501815  0.351125  1
  Al  Al71  1  0.422004  0.756998  0.393151  1
  Al  Al72  1  0.755219  0.423528  0.393166  1
  Al  Al73  1  0.529949  0.032037  0.424110  1
  Al  Al74  1  0.863541  0.698534  0.424335  1
  Al  Al75  1  0.902390  0.070751  0.403248  1
  Al  Al76  1  0.157123  0.992116  0.445260  1
  Al  Al77  1  0.490587  0.658944  0.445337  1
  Al  Al78  1  0.823951  0.325580  0.445337  1
  Al  Al79  1  0.197045  0.364942  0.424110  1
  Al  Al80  1  0.235757  0.737384  0.403248  1
  Al  Al81  1  0.451485  0.286478  0.466220  1
  Al  Al82  1  0.697045  0.864942  0.424110  1
  Al  Al83  1  0.029949  0.532037  0.424110  1
  Al  Al84  1  0.951485  0.786478  0.466220  1
  Al  Al85  1  0.323951  0.825580  0.445337  1
  Al  Al86  1  0.657123  0.492116  0.445260  1
  Al  Al87  1  0.990587  0.158944  0.445337  1
  Al  Al88  1  0.363541  0.198534  0.424335  1
  Al  Al89  1  0.402390  0.570751  0.403248  1
  Al  Al90  1  0.735757  0.237384  0.403248  1
  Al  Al91  1  0.510393  0.845387  0.434856  1
  Al  Al92  1  0.843687  0.511937  0.435081  1
  Al  Al93  1  0.883015  0.884532  0.413615  1
  Al  Al94  1  0.137613  0.806020  0.455622  1
  Al  Al95  1  0.471027  0.472605  0.455622  1
  Al  Al96  1  0.804308  0.139301  0.455651  1
  Al  Al97  1  0.176944  0.178680  0.435081  1
  Al  Al98  1  0.216269  0.551262  0.413672  1
  Al  Al99  1  0.549539  0.218008  0.413615  1
  Al  Al100  1  0.716269  0.051262  0.413672  1
  Al  Al101  1  0.049539  0.718008  0.413615  1
  Al  Al102  1  0.971027  0.972605  0.455622  1
  Al  Al103  1  0.343687  0.011937  0.435081  1
  Al  Al104  1  0.676944  0.678680  0.435081  1
  Al  Al105  1  0.010393  0.345387  0.434856  1
  Al  Al106  1  0.383015  0.384532  0.413615  1
  Al  Al107  1  0.304308  0.639301  0.455651  1
  Al  Al108  1  0.637613  0.306020  0.455622  1
  Al  Al109  1  0.412305  0.913827  0.487227  1
  Al  Al110  1  0.745537  0.580530  0.487251  1
  Al  Al111  1  0.784807  0.953060  0.466113  1
  Al  Al112  1  0.039566  0.874559  0.508070  1
  Al  Al113  1  0.373004  0.541167  0.507991  1
  Al  Al114  1  0.706174  0.207996  0.507991  1
  Al  Al115  1  0.078835  0.247297  0.487227  1
  Al  Al116  1  0.118067  0.619800  0.466113  1
  Al  Al117  1  0.333745  0.168737  0.529139  1
  Al  Al118  1  0.578835  0.747297  0.487227  1
  Al  Al119  1  0.912305  0.413827  0.487227  1
  Al  Al120  1  0.833745  0.668737  0.529139  1
  Al  Al121  1  0.206174  0.707996  0.507991  1
  Al  Al122  1  0.539566  0.374559  0.508070  1
  Al  Al123  1  0.873004  0.041167  0.507991  1
  Al  Al124  1  0.245537  0.080530  0.487251  1
  Al  Al125  1  0.284807  0.453060  0.466113  1
  Al  Al126  1  0.618067  0.119800  0.466113  1
  Al  Al127  1  0.392574  0.727566  0.497596  1
  Al  Al128  1  0.725900  0.394232  0.497579  1
  Al  Al129  1  0.765207  0.766918  0.476717  1
  Al  Al130  1  0.019970  0.688266  0.518638  1
  Al  Al131  1  0.353274  0.354962  0.518638  1
  Al  Al132  1  0.686576  0.021568  0.518497  1
  Al  Al133  1  0.059240  0.060892  0.497579  1
  Al  Al134  1  0.098543  0.433535  0.476553  1
  Al  Al135  1  0.431925  0.100199  0.476717  1
  Al  Al136  1  0.598543  0.933535  0.476553  1
  Al  Al137  1  0.931925  0.600199  0.476717  1
  Al  Al138  1  0.853274  0.854962  0.518638  1
  Al  Al139  1  0.225900  0.894232  0.497579  1
  Al  Al140  1  0.559240  0.560892  0.497579  1
  Al  Al141  1  0.892574  0.227566  0.497596  1
  Al  Al142  1  0.265207  0.266918  0.476717  1
  Al  Al143  1  0.186576  0.521568  0.518497  1
  Al  Al144  1  0.519970  0.188266  0.518638  1
  Al  Al145  1  0.294606  0.796295  0.549845  1
  Al  Al146  1  0.627825  0.462816  0.549791  1
  Al  Al147  1  0.666996  0.835446  0.529088  1
  Al  Al148  1  0.921716  0.756707  0.571136  1
  Al  Al149  1  0.254835  0.423505  0.571055  1
  Al  Al150  1  0.588514  0.089827  0.571055  1
  Al  Al151  1  0.961303  0.129597  0.549845  1
  Al  Al152  1  1.000453  0.501988  0.529088  1
  Al  Al153  1  0.216034  0.051026  0.591867  1
  Al  Al154  1  0.461303  0.629597  0.549845  1
  Al  Al155  1  0.794606  0.296295  0.549845  1
  Al  Al156  1  0.716034  0.551026  0.591867  1
  Al  Al157  1  0.088514  0.589827  0.571055  1
  Al  Al158  1  0.421716  0.256707  0.571136  1
  Al  Al159  1  0.754835  0.923505  0.571055  1
  Al  Al160  1  0.127825  0.962816  0.549791  1
  Al  Al161  1  0.166996  0.335446  0.529088  1
  Al  Al162  1  0.500453  1.001988  0.529088  1
  Al  Al163  1  0.274792  0.609783  0.560104  1
  Al  Al164  1  0.608073  0.276326  0.560419  1
  Al  Al165  1  0.647483  0.649194  0.539559  1
  Al  Al166  1  0.902328  0.570480  0.581558  1
  Al  Al167  1  0.235489  0.237319  0.581558  1
  Al  Al168  1  0.569025  0.904016  0.581722  1
  Al  Al169  1  0.941335  0.943065  0.560419  1
  Al  Al170  1  0.980878  0.315870  0.539615  1
  Al  Al171  1  0.314202  0.982475  0.539559  1
  Al  Al172  1  0.480878  0.815870  0.539615  1
  Al  Al173  1  0.814202  0.482475  0.539559  1
  Al  Al174  1  0.735489  0.737319  0.581558  1
  Al  Al175  1  0.108073  0.776326  0.560419  1
  Al  Al176  1  0.441335  0.443065  0.560419  1
  Al  Al177  1  0.774792  0.109783  0.560104  1
  Al  Al178  1  0.147483  0.149194  0.539559  1
  Al  Al179  1  0.069025  0.404016  0.581722  1
  Al  Al180  1  0.402328  0.070480  0.581558  1
  Al  Al181  1  0.177248  0.676805  0.612448  1
  Al  Al182  1  0.509462  0.344454  0.612638  1
  Al  Al183  1  0.549776  0.718072  0.592048  1
  Al  Al184  1  0.803564  0.638555  0.633660  1
  Al  Al185  1  0.138089  0.306416  0.634311  1
  Al  Al186  1  0.471425  0.973080  0.634311  1
  Al  Al187  1  0.841814  0.012239  0.612448  1
  Al  Al188  1  0.883080  0.384768  0.592048  1
  Al  Al189  1  0.098813  0.933802  0.653194  1
  Al  Al190  1  0.341814  0.512239  0.612448  1
  Al  Al191  1  0.677248  0.176805  0.612448  1
  Al  Al192  1  0.598813  0.433802  0.653194  1
  Al  Al193  1  0.971425  0.473080  0.634311  1
  Al  Al194  1  0.303564  0.138555  0.633660  1
  Al  Al195  1  0.638089  0.806416  0.634311  1
  Al  Al196  1  0.009462  0.844454  0.612638  1
  Al  Al197  1  0.049776  0.218072  0.592048  1
  Al  Al198  1  0.383080  0.884768  0.592048  1
  Al  Al199  1  0.156430  0.491422  0.624127  1
  Al  Al200  1  0.489973  0.157560  0.623476  1
  Al  Al201  1  0.529725  0.531376  0.601855  1
  Al  Al202  1  0.785032  0.453241  0.643992  1
  Al  Al203  1  0.118250  0.120023  0.643992  1
  Al  Al204  1  0.451673  0.786663  0.643846  1
  Al  Al205  1  0.822569  0.824964  0.623476  1
  Al  Al206  1  0.863177  0.198167  0.601841  1
  Al  Al207  1  0.196386  0.864715  0.601855  1
  Al  Al208  1  0.363177  0.698167  0.601841  1
  Al  Al209  1  0.696386  0.364715  0.601855  1
  Al  Al210  1  0.618250  0.620023  0.643992  1
  Al  Al211  1  0.989973  0.657560  0.623476  1
  Al  Al212  1  0.322569  0.324964  0.623476  1
  Al  Al213  1  0.656430  0.991422  0.624127  1
  Al  Al214  1  0.029725  0.031376  0.601855  1
  Al  Al215  1  0.951673  0.286663  0.643846  1
  Al  Al216  1  0.285032  0.953241  0.643992  1
  Al  Al217  1  0.060148  0.563820  0.677518  1
  Al  Al218  1  0.391666  0.226657  0.674896  1
  Al  Al219  1  0.432274  0.600744  0.653042  1
  Al  Al220  1  0.684963  0.519952  0.695318  1
  Al  Al221  1  0.019143  0.188355  0.695195  1
  Al  Al222  1  0.353365  0.854132  0.695195  1
  Al  Al223  1  0.728829  0.895138  0.677518  1
  Al  Al224  1  0.765755  0.267263  0.653042  1
  Al  Al225  1  0.981696  0.816678  0.710578  1
  Al  Al226  1  0.228829  0.395138  0.677518  1
  Al  Al227  1  0.560148  0.063820  0.677518  1
  Al  Al228  1  0.481696  0.316678  0.710578  1
  Al  Al229  1  0.853365  0.354132  0.695195  1
  Al  Al230  1  0.184963  0.019952  0.695318  1
  Al  Al231  1  0.519143  0.688355  0.695195  1
  Al  Al232  1  0.891666  0.726657  0.674896  1
  Al  Al233  1  0.932274  0.100744  0.653042  1
  Al  Al234  1  0.265755  0.767263  0.653042  1
  Al  Al235  1  0.039834  0.374825  0.685433  1
  Al  Al236  1  0.372982  0.041820  0.685896  1
  Al  Al237  1  0.410213  0.416460  0.663284  1
  Al  Al238  1  0.667155  0.332671  0.703795  1
  Al  Al239  1  0.997686  1.002142  0.703795  1
  Al  Al240  1  0.331092  0.666078  0.703505  1
  Al  Al241  1  0.706830  0.707972  0.685896  1
  Al  Al242  1  0.744667  0.079658  0.666180  1
  Al  Al243  1  0.081470  0.745203  0.663283  1
  Al  Al244  1  0.244667  0.579658  0.666180  1
  Al  Al245  1  0.581470  0.245203  0.663283  1
  Al  Al246  1  0.497686  0.502142  0.703795  1
  Al  Al247  1  0.872982  0.541820  0.685896  1
  Al  Al248  1  0.206830  0.207972  0.685896  1
  Al  Al249  1  0.539834  0.874825  0.685433  1
  Al  Al250  1  0.910213  0.916460  0.663284  1
  Al  Al251  1  0.831092  0.166078  0.703505  1
  Al  Al252  1  0.167155  0.832671  0.703795  1
