# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.51756011
_cell_length_b   11.46228842
_cell_length_c   46.51617439
_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   Al162
_cell_volume   5843.03076117
_cell_formula_units_Z   162
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  0.695963  0.128943  0.292980  1
  Al  Al2  1  0.975077  0.754574  0.286525  1
  Al  Al3  1  0.984348  0.078797  0.327269  1
  Al  Al4  1  0.271909  0.068455  0.299843  1
  Al  Al5  1  0.686037  0.776968  0.311648  1
  Al  Al6  1  0.984017  0.433476  0.306915  1
  Al  Al7  1  0.373420  0.471206  0.297081  1
  Al  Al8  1  0.289422  0.717517  0.320644  1
  Al  Al9  1  0.601941  0.361821  0.314903  1
  Al  Al10  1  0.442456  0.869252  0.327641  1
  Al  Al11  1  0.749311  0.513683  0.323689  1
  Al  Al12  1  0.837462  0.929036  0.320438  1
  Al  Al13  1  0.123092  0.905680  0.293010  1
  Al  Al14  1  0.524510  0.626061  0.304928  1
  Al  Al15  1  0.843169  0.278390  0.300239  1
  Al  Al16  1  0.216837  0.327706  0.290278  1
  Al  Al17  1  0.140908  0.569028  0.314207  1
  Al  Al18  1  0.447676  0.210489  0.306173  1
  Al  Al19  1  0.599026  0.016904  0.336498  1
  Al  Al20  1  0.903392  0.658534  0.333327  1
  Al  Al21  1  0.905624  0.972269  0.376417  1
  Al  Al22  1  0.207278  0.955393  0.347093  1
  Al  Al23  1  0.597422  0.676811  0.359442  1
  Al  Al24  1  0.901760  0.320360  0.354953  1
  Al  Al25  1  0.290932  0.371501  0.343833  1
  Al  Al26  1  0.210784  0.611959  0.369981  1
  Al  Al27  1  0.516677  0.255093  0.362167  1
  Al  Al28  1  0.362661  0.762673  0.376892  1
  Al  Al29  1  0.667001  0.406580  0.371576  1
  Al  Al30  1  0.751001  0.825178  0.368019  1
  Al  Al31  1  0.056466  0.804233  0.340456  1
  Al  Al32  1  0.444119  0.523351  0.351435  1
  Al  Al33  1  0.753484  0.169197  0.346916  1
  Al  Al34  1  0.129453  0.230068  0.335823  1
  Al  Al35  1  0.057537  0.464845  0.362561  1
  Al  Al36  1  0.359710  0.108006  0.353762  1
  Al  Al37  1  0.514049  0.913610  0.384965  1
  Al  Al38  1  0.819515  0.554778  0.380619  1
  Al  Al39  1  0.823510  0.867818  0.425948  1
  Al  Al40  1  0.128926  0.851241  0.396844  1
  Al  Al41  1  0.517195  0.569742  0.408920  1
  Al  Al42  1  0.822737  0.211096  0.403606  1
  Al  Al43  1  0.209858  0.268201  0.392680  1
  Al  Al44  1  0.129789  0.507832  0.419865  1
  Al  Al45  1  0.434340  0.150433  0.412311  1
  Al  Al46  1  0.282682  0.657240  0.427561  1
  Al  Al47  1  0.587346  0.299077  0.421081  1
  Al  Al48  1  0.669815  0.720020  0.417390  1
  Al  Al49  1  0.974415  0.702482  0.389091  1
  Al  Al50  1  0.364736  0.417520  0.400784  1
  Al  Al51  1  0.668955  0.061378  0.394140  1
  Al  Al52  1  0.056233  0.120681  0.384392  1
  Al  Al53  1  0.975866  0.359844  0.411921  1
  Al  Al54  1  0.280866  1.001717  0.404184  1
  Al  Al55  1  0.434563  0.807717  0.435278  1
  Al  Al56  1  0.739513  0.448725  0.429861  1
  Al  Al57  1  0.742731  0.762223  0.475497  1
  Al  Al58  1  0.047333  0.746713  0.446430  1
  Al  Al59  1  0.436797  0.463066  0.458695  1
  Al  Al60  1  0.741628  0.104856  0.452590  1
  Al  Al61  1  0.129580  0.164118  0.442419  1
  Al  Al62  1  0.048345  0.402966  0.469425  1
  Al  Al63  1  0.353548  0.045429  0.462348  1
  Al  Al64  1  0.201678  0.552082  0.477387  1
  Al  Al65  1  0.506678  0.193918  0.470733  1
  Al  Al66  1  0.589509  0.613378  0.467007  1
  Al  Al67  1  0.893123  0.597774  0.438246  1
  Al  Al68  1  0.283271  0.313058  0.450540  1
  Al  Al69  1  0.587861  0.956590  0.443778  1
  Al  Al70  1  0.976881  0.015554  0.434303  1
  Al  Al71  1  0.895038  0.253898  0.461255  1
  Al  Al72  1  0.200759  0.896195  0.454366  1
  Al  Al73  1  0.354503  0.701668  0.485330  1
  Al  Al74  1  0.659606  0.342663  0.479286  1
  Al  Al75  1  0.662190  0.656368  0.525020  1
  Al  Al76  1  0.966200  0.641468  0.495983  1
  Al  Al77  1  0.355730  0.357564  0.508400  1
  Al  Al78  1  0.660858  0.999553  0.502111  1
  Al  Al79  1  0.049014  0.059097  0.492203  1
  Al  Al80  1  0.967391  0.297438  0.519042  1
  Al  Al81  1  0.272930  0.940042  0.512214  1
  Al  Al82  1  0.120441  0.446954  0.527055  1
  Al  Al83  1  0.425916  0.088756  0.520420  1
  Al  Al84  1  0.509154  0.507095  0.516628  1
  Al  Al85  1  0.812603  0.492045  0.487704  1
  Al  Al86  1  0.202128  0.208206  0.500296  1
  Al  Al87  1  0.507376  0.850974  0.493507  1
  Al  Al88  1  0.895983  0.910482  0.483947  1
  Al  Al89  1  0.814283  0.148208  0.510721  1
  Al  Al90  1  0.119751  0.790855  0.504130  1
  Al  Al91  1  0.273610  0.596171  0.535012  1
  Al  Al92  1  0.579099  0.237094  0.528839  1
  Al  Al93  1  0.581943  0.550521  0.574529  1
  Al  Al94  1  0.885251  0.535796  0.545602  1
  Al  Al95  1  0.274622  0.252445  0.558035  1
  Al  Al96  1  0.580058  0.893962  0.551557  1
  Al  Al97  1  0.968325  0.953860  0.541985  1
  Al  Al98  1  0.887014  0.191659  0.568897  1
  Al  Al99  1  0.192115  0.834994  0.561995  1
  Al  Al100  1  0.039472  0.341663  0.576844  1
  Al  Al101  1  0.345348  0.983411  0.570124  1
  Al  Al102  1  0.428628  0.401564  0.566156  1
  Al  Al103  1  0.732189  0.385952  0.537310  1
  Al  Al104  1  0.121324  0.102892  0.550089  1
  Al  Al105  1  0.426770  0.745218  0.543149  1
  Al  Al106  1  0.815340  0.805128  0.533588  1
  Al  Al107  1  0.733721  0.042675  0.560347  1
  Al  Al108  1  0.038758  0.685825  0.553885  1
  Al  Al109  1  0.192415  0.491347  0.584656  1
  Al  Al110  1  0.498254  0.131664  0.578414  1
  Al  Al111  1  0.502235  0.445212  0.623872  1
  Al  Al112  1  0.804342  0.429601  0.595398  1
  Al  Al113  1  0.193927  0.147423  0.607713  1
  Al  Al114  1  0.499330  0.787767  0.600931  1
  Al  Al115  1  0.887800  0.848564  0.591918  1
  Al  Al116  1  0.807300  0.085835  0.618913  1
  Al  Al117  1  0.111525  0.731454  0.611979  1
  Al  Al118  1  0.959384  0.236716  0.627118  1
  Al  Al119  1  0.265489  0.878828  0.619925  1
  Al  Al120  1  0.347908  0.297072  0.615455  1
  Al  Al121  1  0.651676  0.279573  0.586968  1
  Al  Al122  1  0.040960  0.997527  0.600174  1
  Al  Al123  1  0.345655  0.639733  0.592573  1
  Al  Al124  1  0.734710  0.699340  0.583142  1
  Al  Al125  1  0.652343  0.936764  0.609484  1
  Al  Al126  1  0.957710  0.580650  0.603506  1
  Al  Al127  1  0.112049  0.386369  0.634548  1
  Al  Al128  1  0.417704  0.026217  0.628067  1
  Al  Al129  1  0.419779  0.341491  0.671458  1
  Al  Al130  1  0.723770  0.322383  0.644991  1
  Al  Al131  1  0.113777  0.043315  0.657511  1
  Al  Al132  1  0.419410  0.680291  0.649667  1
  Al  Al133  1  0.806046  0.742347  0.641748  1
  Al  Al134  1  0.722017  0.980408  0.666383  1
  Al  Al135  1  0.032126  0.625557  0.660461  1
  Al  Al136  1  0.878703  0.130494  0.676306  1
  Al  Al137  1  0.190455  0.771435  0.668967  1
  Al  Al138  1  0.268085  0.193473  0.664123  1
  Al  Al139  1  0.570295  0.174286  0.636509  1
  Al  Al140  1  0.960545  0.892039  0.651140  1
  Al  Al141  1  0.265006  0.534906  0.641989  1
  Al  Al142  1  0.654560  0.592888  0.632904  1
  Al  Al143  1  0.569985  0.829783  0.658087  1
  Al  Al144  1  0.877525  0.474598  0.652951  1
  Al  Al145  1  0.034100  0.280806  0.683556  1
  Al  Al146  1  0.337177  0.921509  0.676678  1
  Al  Al147  1  0.345989  0.243454  0.718046  1
  Al  Al148  1  0.637360  0.219376  0.693433  1
  Al  Al149  1  0.042874  0.932906  0.705580  1
  Al  Al150  1  0.338092  0.568658  0.697498  1
  Al  Al151  1  0.721543  0.636363  0.689732  1
  Al  Al152  1  0.635983  0.872452  0.712484  1
  Al  Al153  1  0.950411  0.523728  0.707323  1
  Al  Al154  1  0.796174  0.014269  0.719329  1
  Al  Al155  1  0.104650  0.671240  0.714400  1
  Al  Al156  1  0.198214  0.092466  0.711481  1
  Al  Al157  1  0.487784  0.068295  0.684840  1
  Al  Al158  1  0.876450  0.784355  0.697768  1
  Al  Al159  1  0.182941  0.429983  0.690271  1
  Al  Al160  1  0.573245  0.486922  0.680858  1
  Al  Al161  1  0.480785  0.723692  0.704345  1
  Al  Al162  1  0.798163  0.369731  0.699725  1
