# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.49044385
_cell_length_b   14.49125683
_cell_length_c   47.38864885
_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   9468.13477422
_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  0.893235  0.227223  0.318859  1
  Al  Al2  1  0.228255  0.896067  0.320692  1
  Al  Al3  1  0.267943  0.269138  0.299281  1
  Al  Al4  1  0.522088  0.189808  0.341495  1
  Al  Al5  1  0.973584  0.977104  0.280596  1
  Al  Al6  1  0.188424  0.523396  0.341456  1
  Al  Al7  1  0.561504  0.562787  0.320855  1
  Al  Al8  1  0.600289  0.935547  0.299285  1
  Al  Al9  1  0.934575  0.601728  0.299286  1
  Al  Al10  1  0.688972  0.023006  0.341450  1
  Al  Al11  1  0.142460  0.808640  0.280521  1
  Al  Al12  1  0.061642  0.062604  0.320683  1
  Al  Al13  1  0.434321  0.101472  0.299313  1
  Al  Al14  1  0.767159  0.768856  0.299317  1
  Al  Al15  1  0.100322  0.434692  0.299346  1
  Al  Al16  1  0.475256  0.475388  0.281005  1
  Al  Al17  1  0.392768  0.727083  0.318573  1
  Al  Al18  1  0.725792  0.394452  0.318821  1
  Al  Al19  1  0.874318  0.043269  0.331431  1
  Al  Al20  1  0.209283  0.708567  0.331257  1
  Al  Al21  1  0.246504  0.081058  0.308896  1
  Al  Al22  1  0.622934  0.123835  0.289663  1
  Al  Al23  1  0.954092  0.788251  0.289654  1
  Al  Al24  1  0.287210  0.457417  0.289805  1
  Al  Al25  1  0.542346  0.375001  0.331605  1
  Al  Al26  1  0.580076  0.747844  0.309151  1
  Al  Al27  1  0.913527  0.414852  0.309405  1
  Al  Al28  1  0.708777  0.209716  0.330246  1
  Al  Al29  1  0.041544  0.875788  0.332008  1
  Al  Al30  1  0.080344  0.247712  0.309164  1
  Al  Al31  1  0.455074  0.288565  0.289975  1
  Al  Al32  1  0.787824  0.955908  0.289846  1
  Al  Al33  1  0.122434  0.622280  0.289685  1
  Al  Al34  1  0.373432  0.544213  0.331400  1
  Al  Al35  1  0.413303  0.914522  0.309186  1
  Al  Al36  1  0.746706  0.581378  0.309118  1
  Al  Al37  1  0.776966  0.112692  0.382793  1
  Al  Al38  1  0.111327  0.778195  0.382884  1
  Al  Al39  1  0.150352  0.151456  0.361742  1
  Al  Al40  1  0.404819  0.072589  0.403440  1
  Al  Al41  1  0.855515  0.855848  0.341578  1
  Al  Al42  1  0.071132  0.405626  0.403367  1
  Al  Al43  1  0.444346  0.445457  0.382616  1
  Al  Al44  1  0.482719  0.817189  0.361273  1
  Al  Al45  1  0.815956  0.483814  0.361317  1
  Al  Al46  1  0.571184  0.905694  0.403334  1
  Al  Al47  1  0.021704  0.689791  0.341530  1
  Al  Al48  1  0.943682  0.945853  0.382910  1
  Al  Al49  1  0.317048  0.984840  0.361738  1
  Al  Al50  1  0.650234  0.651425  0.361762  1
  Al  Al51  1  0.982709  0.317200  0.361326  1
  Al  Al52  1  0.354867  0.356535  0.341669  1
  Al  Al53  1  0.277440  0.611866  0.383242  1
  Al  Al54  1  0.611532  0.278122  0.382828  1
  Al  Al55  1  0.757493  0.925513  0.393199  1
  Al  Al56  1  0.090801  0.591939  0.393240  1
  Al  Al57  1  0.130718  0.965197  0.372396  1
  Al  Al58  1  0.502610  1.003526  0.351253  1
  Al  Al59  1  0.835636  0.669883  0.351274  1
  Al  Al60  1  0.168877  0.336967  0.351281  1
  Al  Al61  1  0.424443  0.258785  0.393202  1
  Al  Al62  1  0.463772  0.632172  0.372174  1
  Al  Al63  1  0.797341  0.298560  0.371842  1
  Al  Al64  1  0.591001  0.092048  0.393138  1
  Al  Al65  1  0.924243  0.758664  0.393291  1
  Al  Al66  1  0.963657  0.132352  0.372178  1
  Al  Al67  1  0.335788  0.170196  0.351186  1
  Al  Al68  1  0.668905  0.836957  0.351256  1
  Al  Al69  1  1.002297  0.503443  0.351344  1
  Al  Al70  1  0.257527  0.425433  0.393241  1
  Al  Al71  1  0.297857  0.798198  0.372155  1
  Al  Al72  1  0.631050  0.464843  0.372195  1
  Al  Al73  1  0.659506  0.994057  0.445271  1
  Al  Al74  1  0.992835  0.660660  0.445317  1
  Al  Al75  1  0.032224  0.033600  0.424395  1
  Al  Al76  1  0.287085  0.954862  0.466129  1
  Al  Al77  1  0.738018  0.739222  0.403451  1
  Al  Al78  1  0.953682  0.288210  0.466080  1
  Al  Al79  1  0.326303  0.327362  0.445313  1
  Al  Al80  1  0.365725  0.700154  0.424456  1
  Al  Al81  1  0.699081  0.366706  0.424313  1
  Al  Al82  1  0.453727  0.788228  0.466124  1
  Al  Al83  1  0.904459  0.572254  0.403363  1
  Al  Al84  1  0.826203  0.827447  0.445320  1
  Al  Al85  1  0.199083  0.866733  0.424402  1
  Al  Al86  1  0.532330  0.533421  0.424308  1
  Al  Al87  1  0.865522  0.200261  0.424318  1
  Al  Al88  1  0.238127  0.239242  0.403450  1
  Al  Al89  1  0.159541  0.493977  0.445312  1
  Al  Al90  1  0.492957  0.160742  0.445292  1
  Al  Al91  1  0.639926  0.807814  0.455646  1
  Al  Al92  1  0.973258  0.474383  0.455625  1
  Al  Al93  1  0.012596  0.847148  0.434892  1
  Al  Al94  1  0.385310  0.886327  0.413832  1
  Al  Al95  1  0.718572  0.552931  0.413818  1
  Al  Al96  1  0.051797  0.219775  0.413827  1
  Al  Al97  1  0.306671  0.141124  0.455680  1
  Al  Al98  1  0.346138  0.513556  0.434937  1
  Al  Al99  1  0.679247  0.180426  0.434915  1
  Al  Al100  1  0.473315  0.974452  0.455651  1
  Al  Al101  1  0.806614  0.641088  0.455645  1
  Al  Al102  1  0.845830  0.013885  0.434890  1
  Al  Al103  1  0.218603  0.053071  0.413917  1
  Al  Al104  1  0.551820  0.719750  0.413826  1
  Al  Al105  1  0.885120  0.386272  0.413716  1
  Al  Al106  1  0.139948  0.307776  0.455657  1
  Al  Al107  1  0.179181  0.680428  0.435014  1
  Al  Al108  1  0.512671  0.347124  0.434816  1
  Al  Al109  1  0.541817  0.876406  0.507871  1
  Al  Al110  1  0.875243  0.542984  0.507840  1
  Al  Al111  1  0.914481  0.915669  0.487075  1
  Al  Al112  1  0.169284  0.837168  0.528876  1
  Al  Al113  1  0.620375  0.621526  0.466075  1
  Al  Al114  1  0.835981  0.170420  0.528823  1
  Al  Al115  1  0.208552  0.209690  0.507875  1
  Al  Al116  1  0.247845  0.582259  0.487098  1
  Al  Al117  1  0.581129  0.248994  0.487055  1
  Al  Al118  1  0.335975  0.670463  0.528866  1
  Al  Al119  1  0.787067  0.454821  0.466065  1
  Al  Al120  1  0.708506  0.709730  0.507843  1
  Al  Al121  1  0.081107  0.749005  0.487101  1
  Al  Al122  1  0.414534  0.415583  0.487070  1
  Al  Al123  1  0.747798  0.082299  0.487067  1
  Al  Al124  1  0.120370  0.121569  0.466118  1
  Al  Al125  1  0.041869  0.376321  0.507866  1
  Al  Al126  1  0.375222  0.042995  0.507886  1
  Al  Al127  1  0.522196  0.690086  0.518332  1
  Al  Al128  1  0.855576  0.356702  0.518329  1
  Al  Al129  1  0.894836  0.729352  0.497472  1
  Al  Al130  1  0.267456  0.768618  0.476652  1
  Al  Al131  1  0.600794  0.435243  0.476555  1
  Al  Al132  1  0.934088  0.101969  0.476596  1
  Al  Al133  1  0.188903  0.023383  0.518356  1
  Al  Al134  1  0.228201  0.395960  0.497477  1
  Al  Al135  1  0.561490  0.062674  0.497463  1
  Al  Al136  1  0.355557  0.856746  0.518386  1
  Al  Al137  1  0.688894  0.523371  0.518290  1
  Al  Al138  1  0.728149  0.896029  0.497464  1
  Al  Al139  1  0.100774  0.935287  0.476612  1
  Al  Al140  1  0.434154  0.601903  0.476610  1
  Al  Al141  1  0.767447  0.268606  0.476585  1
  Al  Al142  1  0.022263  0.190020  0.518346  1
  Al  Al143  1  0.061515  0.562637  0.497470  1
  Al  Al144  1  0.394860  0.229315  0.497478  1
  Al  Al145  1  0.424021  0.758568  0.570633  1
  Al  Al146  1  0.757268  0.425256  0.570539  1
  Al  Al147  1  0.796809  0.798012  0.549630  1
  Al  Al148  1  0.051892  0.719735  0.591578  1
  Al  Al149  1  0.502623  0.503761  0.528818  1
  Al  Al150  1  0.718224  0.052747  0.591491  1
  Al  Al151  1  0.090829  0.091728  0.570623  1
  Al  Al152  1  0.130148  0.464542  0.549621  1
  Al  Al153  1  0.463394  0.131247  0.549650  1
  Al  Al154  1  0.218333  0.552767  0.591491  1
  Al  Al155  1  0.669266  0.337127  0.528813  1
  Al  Al156  1  0.590625  0.591835  0.570486  1
  Al  Al157  1  0.963515  0.631329  0.549625  1
  Al  Al158  1  0.296844  0.297932  0.549670  1
  Al  Al159  1  0.630048  0.964627  0.549629  1
  Al  Al160  1  1.002669  1.003779  0.528861  1
  Al  Al161  1  0.924127  0.258389  0.570546  1
  Al  Al162  1  0.257269  0.925283  0.570628  1
  Al  Al163  1  0.404531  0.572239  0.581115  1
  Al  Al164  1  0.737748  0.238918  0.581024  1
  Al  Al165  1  0.777169  0.611561  0.559928  1
  Al  Al166  1  0.149737  0.650901  0.539296  1
  Al  Al167  1  0.483035  0.317537  0.539290  1
  Al  Al168  1  0.816402  0.984213  0.539285  1
  Al  Al169  1  0.071231  0.905717  0.581226  1
  Al  Al170  1  0.110520  0.278104  0.560051  1
  Al  Al171  1  0.443679  0.944865  0.560126  1
  Al  Al172  1  0.237778  0.739058  0.581123  1
  Al  Al173  1  0.571041  0.405662  0.581110  1
  Al  Al174  1  0.610212  0.778433  0.560004  1
  Al  Al175  1  0.983093  0.817606  0.539316  1
  Al  Al176  1  0.316425  0.484175  0.539295  1
  Al  Al177  1  0.649679  0.150866  0.539262  1
  Al  Al178  1  0.904553  0.072214  0.581114  1
  Al  Al179  1  0.943755  0.444841  0.560049  1
  Al  Al180  1  0.277104  0.111563  0.560026  1
  Al  Al181  1  0.306116  0.640564  0.633180  1
  Al  Al182  1  0.639302  0.307149  0.633203  1
  Al  Al183  1  0.678911  0.680123  0.611699  1
  Al  Al184  1  0.934647  0.602198  0.653411  1
  Al  Al185  1  0.385167  0.386296  0.591607  1
  Al  Al186  1  0.601484  0.935454  0.653273  1
  Al  Al187  1  0.973642  0.974789  0.633616  1
  Al  Al188  1  0.012669  0.346136  0.612031  1
  Al  Al189  1  0.344819  0.013867  0.612114  1
  Al  Al190  1  0.100836  0.436141  0.653364  1
  Al  Al191  1  0.551531  0.219400  0.591501  1
  Al  Al192  1  0.473631  0.474800  0.633668  1
  Al  Al193  1  0.845024  0.513795  0.612058  1
  Al  Al194  1  0.179385  0.179297  0.612148  1
  Al  Al195  1  0.512004  0.846532  0.612326  1
  Al  Al196  1  0.885218  0.886363  0.591574  1
  Al  Al197  1  0.805999  0.140533  0.633199  1
  Al  Al198  1  0.140394  0.808176  0.633624  1
  Al  Al199  1  0.287445  0.455032  0.643686  1
  Al  Al200  1  0.620563  0.121794  0.643756  1
  Al  Al201  1  0.658493  0.493791  0.622786  1
  Al  Al202  1  0.032108  0.533326  0.601650  1
  Al  Al203  1  0.365350  0.199941  0.601804  1
  Al  Al204  1  0.698823  0.866556  0.601700  1
  Al  Al205  1  0.954054  0.788546  0.643598  1
  Al  Al206  1  0.992694  0.159637  0.622763  1
  Al  Al207  1  0.325300  0.827146  0.622747  1
  Al  Al208  1  0.120715  0.622107  0.643667  1
  Al  Al209  1  0.453741  0.288463  0.643688  1
  Al  Al210  1  0.492579  0.659817  0.622767  1
  Al  Al211  1  0.865550  0.700050  0.601701  1
  Al  Al212  1  0.198857  0.366476  0.601742  1
  Al  Al213  1  0.531907  0.033204  0.601739  1
  Al  Al214  1  0.787474  0.955022  0.643661  1
  Al  Al215  1  0.825633  0.326792  0.622545  1
  Al  Al216  1  0.159010  0.993429  0.623099  1
  Al  Al217  1  0.189191  0.523133  0.695625  1
  Al  Al218  1  0.522030  0.190517  0.695628  1
  Al  Al219  1  0.563582  0.564906  0.676368  1
  Al  Al220  1  0.813891  0.483350  0.714421  1
  Al  Al221  1  0.267379  0.268983  0.653491  1
  Al  Al222  1  0.481094  0.816601  0.713936  1
  Al  Al223  1  0.856029  0.857297  0.695596  1
  Al  Al224  1  0.894709  0.229385  0.674258  1
  Al  Al225  1  0.230559  0.897537  0.676121  1
  Al  Al226  1  0.982766  0.314885  0.714345  1
  Al  Al227  1  0.434263  0.102181  0.653446  1
  Al  Al228  1  0.356062  0.356442  0.695657  1
  Al  Al229  1  0.728096  0.395922  0.674250  1
  Al  Al230  1  0.063115  0.064766  0.676082  1
  Al  Al231  1  0.394846  0.729202  0.674086  1
  Al  Al232  1  0.767926  0.768593  0.653486  1
  Al  Al233  1  0.688408  0.022851  0.695661  1
  Al  Al234  1  0.021775  0.690261  0.695655  1
  Al  Al235  1  0.168527  0.336081  0.705095  1
  Al  Al236  1  0.501277  1.003424  0.704966  1
  Al  Al237  1  0.543047  0.377467  0.685755  1
  Al  Al238  1  0.914807  0.416201  0.662933  1
  Al  Al239  1  0.247573  0.082273  0.664696  1
  Al  Al240  1  0.582919  0.747776  0.663541  1
  Al  Al241  1  0.833917  0.669710  0.705256  1
  Al  Al242  1  0.876006  0.044277  0.685778  1
  Al  Al243  1  0.209644  0.710611  0.685823  1
  Al  Al244  1  1.002259  0.503738  0.705287  1
  Al  Al245  1  0.333416  0.168154  0.705278  1
  Al  Al246  1  0.376275  0.544145  0.685790  1
  Al  Al247  1  0.747068  0.583422  0.663684  1
  Al  Al248  1  0.082033  0.248720  0.663510  1
  Al  Al249  1  0.414005  0.916988  0.663336  1
  Al  Al250  1  0.669141  0.834572  0.705137  1
  Al  Al251  1  0.709847  0.210931  0.686045  1
  Al  Al252  1  0.042824  0.877137  0.685537  1
