# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.46861888
_cell_length_b   14.46598960
_cell_length_c   46.83417190
_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   9326.96687364
_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  0.948622  0.283701  0.295862  1
  Al  Al2  1  0.282523  0.950473  0.296330  1
  Al  Al3  1  0.204702  0.205154  0.335821  1
  Al  Al4  1  0.577576  0.245480  0.316120  1
  Al  Al5  1  0.911292  0.912028  0.316122  1
  Al  Al6  1  0.244846  0.579403  0.316119  1
  Al  Al7  1  0.617039  0.616776  0.296193  1
  Al  Al8  1  0.538674  0.870878  0.336243  1
  Al  Al9  1  0.871029  0.537713  0.336707  1
  Al  Al10  1  0.744572  0.078484  0.316121  1
  Al  Al11  1  0.078495  0.745751  0.316119  1
  Al  Al12  1  0.115844  0.117956  0.296193  1
  Al  Al13  1  0.369967  0.039587  0.336246  1
  Al  Al14  1  0.704242  0.705616  0.335824  1
  Al  Al15  1  0.036794  0.371946  0.336708  1
  Al  Al16  1  0.411122  0.412199  0.316122  1
  Al  Al17  1  0.449539  0.783442  0.296329  1
  Al  Al18  1  0.782783  0.449541  0.295862  1
  Al  Al19  1  0.931249  0.098124  0.305916  1
  Al  Al20  1  0.264970  0.765882  0.305860  1
  Al  Al21  1  0.184432  0.019190  0.346342  1
  Al  Al22  1  0.557383  0.058293  0.325579  1
  Al  Al23  1  0.891556  0.724215  0.325305  1
  Al  Al24  1  0.223306  0.392465  0.325305  1
  Al  Al25  1  0.597217  0.432162  0.305915  1
  Al  Al26  1  0.518280  0.685342  0.346341  1
  Al  Al27  1  0.965880  0.466823  0.287009  1
  Al  Al28  1  0.763496  0.264405  0.305969  1
  Al  Al29  1  0.097428  0.931842  0.305933  1
  Al  Al30  1  0.128156  0.304828  0.287452  1
  Al  Al31  1  0.390750  0.225130  0.325492  1
  Al  Al32  1  0.724224  0.891658  0.325493  1
  Al  Al33  1  0.056917  0.557820  0.324887  1
  Al  Al34  1  0.430935  0.598336  0.305933  1
  Al  Al35  1  0.465148  0.966088  0.288244  1
  Al  Al36  1  0.803886  0.629100  0.287452  1
  Al  Al37  1  0.832060  0.165970  0.356341  1
  Al  Al38  1  0.165883  0.833154  0.356277  1
  Al  Al39  1  0.086835  0.087858  0.398301  1
  Al  Al40  1  0.459896  0.127576  0.376700  1
  Al  Al41  1  0.793433  0.794040  0.376635  1
  Al  Al42  1  0.126656  0.461074  0.376712  1
  Al  Al43  1  0.498778  0.499593  0.356310  1
  Al  Al44  1  0.420311  0.754713  0.398267  1
  Al  Al45  1  0.753384  0.421142  0.398332  1
  Al  Al46  1  0.626668  0.960803  0.376700  1
  Al  Al47  1  0.960167  0.627563  0.376712  1
  Al  Al48  1  0.998689  0.999683  0.356311  1
  Al  Al49  1  0.253804  0.921220  0.398267  1
  Al  Al50  1  0.586949  0.587744  0.398301  1
  Al  Al51  1  0.920233  0.254292  0.398332  1
  Al  Al52  1  0.293132  0.294340  0.376634  1
  Al  Al53  1  0.332250  0.666787  0.356277  1
  Al  Al54  1  0.665065  0.332965  0.356341  1
  Al  Al55  1  0.812358  0.979767  0.366456  1
  Al  Al56  1  0.145949  0.646854  0.366492  1
  Al  Al57  1  0.067236  0.901365  0.408597  1
  Al  Al58  1  0.440430  0.941338  0.387406  1
  Al  Al59  1  0.773012  0.608327  0.387713  1
  Al  Al60  1  0.107417  0.273922  0.387712  1
  Al  Al61  1  0.478861  0.313263  0.366455  1
  Al  Al62  1  0.400458  0.568142  0.408597  1
  Al  Al63  1  0.851418  0.352328  0.346091  1
  Al  Al64  1  0.645847  0.146752  0.366524  1
  Al  Al65  1  0.979394  0.813571  0.366519  1
  Al  Al66  1  0.018544  0.186223  0.346019  1
  Al  Al67  1  0.273433  0.107901  0.387794  1
  Al  Al68  1  0.606989  0.774344  0.387794  1
  Al  Al69  1  0.940038  0.440950  0.388189  1
  Al  Al70  1  0.312665  0.480300  0.366518  1
  Al  Al71  1  0.352506  0.853416  0.345985  1
  Al  Al72  1  0.685314  0.519454  0.346019  1
  Al  Al73  1  0.714212  0.048390  0.418931  1
  Al  Al74  1  0.047641  0.715186  0.418967  1
  Al  Al75  1  0.969055  0.969872  0.461055  1
  Al  Al76  1  0.341893  0.009299  0.440067  1
  Al  Al77  1  0.675048  0.676032  0.440181  1
  Al  Al78  1  0.008568  0.342485  0.440219  1
  Al  Al79  1  0.380808  0.381824  0.418933  1
  Al  Al80  1  0.302388  0.636637  0.461057  1
  Al  Al81  1  0.635644  0.303251  0.461060  1
  Al  Al82  1  0.508393  0.842798  0.440068  1
  Al  Al83  1  0.841579  0.509474  0.440220  1
  Al  Al84  1  0.880918  0.881715  0.418933  1
  Al  Al85  1  0.135732  0.803293  0.461058  1
  Al  Al86  1  0.468967  0.469960  0.461054  1
  Al  Al87  1  0.802347  0.136549  0.461061  1
  Al  Al88  1  0.175126  0.175955  0.440181  1
  Al  Al89  1  0.214280  0.548547  0.418967  1
  Al  Al90  1  0.547483  0.215119  0.418931  1
  Al  Al91  1  0.694838  0.862300  0.429396  1
  Al  Al92  1  0.028185  0.529090  0.429488  1
  Al  Al93  1  0.949481  0.783689  0.471513  1
  Al  Al94  1  0.322059  0.822965  0.450638  1
  Al  Al95  1  0.655277  0.489582  0.450671  1
  Al  Al96  1  0.988676  0.156182  0.450671  1
  Al  Al97  1  0.361394  0.195744  0.429396  1
  Al  Al98  1  0.282785  0.450385  0.471513  1
  Al  Al99  1  0.733717  0.234624  0.408633  1
  Al  Al100  1  0.528063  0.028970  0.429357  1
  Al  Al101  1  0.861465  0.695640  0.429411  1
  Al  Al102  1  0.900394  0.067840  0.408607  1
  Al  Al103  1  0.155415  0.989598  0.450631  1
  Al  Al104  1  0.488692  0.656320  0.450631  1
  Al  Al105  1  0.822001  0.322906  0.450682  1
  Al  Al106  1  0.194734  0.362370  0.429411  1
  Al  Al107  1  0.233848  0.734754  0.408602  1
  Al  Al108  1  0.566933  0.401301  0.408607  1
  Al  Al109  1  0.596597  0.930828  0.481981  1
  Al  Al110  1  0.929923  0.597501  0.482031  1
  Al  Al111  1  0.851359  0.852244  0.524060  1
  Al  Al112  1  0.223974  0.891534  0.503012  1
  Al  Al113  1  0.557238  0.558205  0.503023  1
  Al  Al114  1  0.890589  0.224816  0.503044  1
  Al  Al115  1  0.263255  0.264177  0.482010  1
  Al  Al116  1  0.184666  0.518927  0.524065  1
  Al  Al117  1  0.518005  0.185585  0.524046  1
  Al  Al118  1  0.390632  0.724877  0.503012  1
  Al  Al119  1  0.723913  0.391492  0.503044  1
  Al  Al120  1  0.763273  0.764158  0.482010  1
  Al  Al121  1  0.018026  0.685567  0.524065  1
  Al  Al122  1  0.351342  0.352261  0.524060  1
  Al  Al123  1  0.684683  0.018907  0.524046  1
  Al  Al124  1  0.057303  0.058140  0.503023  1
  Al  Al125  1  0.096598  0.430825  0.482031  1
  Al  Al126  1  0.429924  0.097501  0.481981  1
  Al  Al127  1  0.576932  0.744588  0.492549  1
  Al  Al128  1  0.910283  0.411185  0.492589  1
  Al  Al129  1  0.831798  0.666023  0.534549  1
  Al  Al130  1  0.204301  0.705202  0.513512  1
  Al  Al131  1  0.537538  0.371885  0.513520  1
  Al  Al132  1  0.870984  0.038440  0.513520  1
  Al  Al133  1  0.243685  0.077835  0.492549  1
  Al  Al134  1  0.165122  0.332699  0.534549  1
  Al  Al135  1  0.616103  0.117008  0.471487  1
  Al  Al136  1  0.410318  0.911221  0.492534  1
  Al  Al137  1  0.743576  0.577873  0.492600  1
  Al  Al138  1  0.782805  0.950343  0.471501  1
  Al  Al139  1  0.037639  0.871801  0.513538  1
  Al  Al140  1  0.370899  0.538541  0.513538  1
  Al  Al141  1  0.704249  0.205151  0.513522  1
  Al  Al142  1  0.076970  0.244479  0.492600  1
  Al  Al143  1  0.116165  0.617068  0.471527  1
  Al  Al144  1  0.449439  0.283709  0.471501  1
  Al  Al145  1  0.478911  0.813162  0.544978  1
  Al  Al146  1  0.812180  0.479738  0.545013  1
  Al  Al147  1  0.733719  0.734567  0.587061  1
  Al  Al148  1  0.106303  0.773493  0.566023  1
  Al  Al149  1  0.439316  0.440439  0.566049  1
  Al  Al150  1  0.772916  0.106882  0.565978  1
  Al  Al151  1  0.145557  0.146407  0.544992  1
  Al  Al152  1  0.066990  0.401267  0.587080  1
  Al  Al153  1  0.400437  0.068030  0.587070  1
  Al  Al154  1  0.272595  0.607202  0.566023  1
  Al  Al155  1  0.605982  0.273816  0.565979  1
  Al  Al156  1  0.645507  0.646457  0.544992  1
  Al  Al157  1  0.900369  0.567888  0.587080  1
  Al  Al158  1  0.233668  0.234618  0.587061  1
  Al  Al159  1  0.567131  0.901336  0.587070  1
  Al  Al160  1  0.939540  0.940216  0.566049  1
  Al  Al161  1  0.978838  0.313080  0.545013  1
  Al  Al162  1  0.312261  0.979811  0.544978  1
  Al  Al163  1  0.459173  0.626777  0.555383  1
  Al  Al164  1  0.792464  0.293363  0.555429  1
  Al  Al165  1  0.714062  0.548324  0.597417  1
  Al  Al166  1  0.086558  0.587457  0.576681  1
  Al  Al167  1  0.419880  0.254126  0.576653  1
  Al  Al168  1  0.753227  0.920780  0.576653  1
  Al  Al169  1  0.125877  0.960072  0.555383  1
  Al  Al170  1  0.047426  0.214960  0.597418  1
  Al  Al171  1  0.498492  0.999393  0.534524  1
  Al  Al172  1  0.292591  0.793491  0.555368  1
  Al  Al173  1  0.625817  0.460098  0.555394  1
  Al  Al174  1  0.665164  0.832722  0.534538  1
  Al  Al175  1  0.919860  0.754040  0.576627  1
  Al  Al176  1  0.253141  0.420759  0.576627  1
  Al  Al177  1  0.586506  0.087406  0.576631  1
  Al  Al178  1  0.959199  0.126716  0.555394  1
  Al  Al179  1  0.998467  0.499367  0.534563  1
  Al  Al180  1  0.331822  0.166065  0.534538  1
  Al  Al181  1  0.360859  0.695272  0.607640  1
  Al  Al182  1  0.694058  0.361895  0.607787  1
  Al  Al183  1  0.615942  0.616403  0.649726  1
  Al  Al184  1  0.988095  0.655659  0.629219  1
  Al  Al185  1  0.321279  0.322310  0.629206  1
  Al  Al186  1  0.654796  0.988888  0.629330  1
  Al  Al187  1  0.027508  0.028447  0.607721  1
  Al  Al188  1  0.949080  0.283031  0.649764  1
  Al  Al189  1  0.282613  0.950143  0.649758  1
  Al  Al190  1  0.154762  0.488994  0.629218  1
  Al  Al191  1  0.487989  0.155694  0.629330  1
  Al  Al192  1  0.527552  0.528404  0.607720  1
  Al  Al193  1  0.782132  0.449980  0.649763  1
  Al  Al194  1  0.115504  0.116841  0.649726  1
  Al  Al195  1  0.449243  0.783513  0.649757  1
  Al  Al196  1  0.821411  0.822176  0.629205  1
  Al  Al197  1  0.861000  0.194954  0.607787  1
  Al  Al198  1  0.194377  0.861754  0.607640  1
  Al  Al199  1  0.340083  0.509428  0.618482  1
  Al  Al200  1  0.674385  0.175279  0.618250  1
  Al  Al201  1  0.595330  0.429864  0.660049  1
  Al  Al202  1  0.968434  0.469333  0.639399  1
  Al  Al203  1  0.301919  0.136466  0.639462  1
  Al  Al204  1  0.635565  0.802819  0.639462  1
  Al  Al205  1  0.008533  0.840978  0.618481  1
  Al  Al206  1  0.928970  0.096223  0.660049  1
  Al  Al207  1  0.380922  0.881820  0.597430  1
  Al  Al208  1  0.174175  0.675071  0.618897  1
  Al  Al209  1  0.507285  0.341994  0.618657  1
  Al  Al210  1  0.547417  0.715025  0.597412  1
  Al  Al211  1  0.802314  0.636155  0.639466  1
  Al  Al212  1  0.135255  0.303214  0.639467  1
  Al  Al213  1  0.469093  0.969993  0.639542  1
  Al  Al214  1  0.841097  0.008182  0.618657  1
  Al  Al215  1  0.880626  0.381523  0.597436  1
  Al  Al216  1  0.214127  0.048315  0.597412  1
  Al  Al217  1  0.243196  0.578339  0.670577  1
  Al  Al218  1  0.577411  0.244009  0.669940  1
  Al  Al219  1  0.498248  0.500797  0.709540  1
  Al  Al220  1  0.869596  0.537370  0.689864  1
  Al  Al221  1  0.203045  0.204303  0.689865  1
  Al  Al222  1  0.537137  0.871265  0.689862  1
  Al  Al223  1  0.912267  0.909440  0.669647  1
  Al  Al224  1  0.832057  0.165602  0.709767  1
  Al  Al225  1  0.167894  0.834747  0.708849  1
  Al  Al226  1  0.036472  0.370492  0.689865  1
  Al  Al227  1  0.370365  0.038036  0.689862  1
  Al  Al228  1  0.408548  0.413161  0.669650  1
  Al  Al229  1  0.664720  0.332925  0.709766  1
  Al  Al230  1  0.999914  0.999113  0.709539  1
  Al  Al231  1  0.333879  0.668763  0.708849  1
  Al  Al232  1  0.703406  0.703944  0.689865  1
  Al  Al233  1  0.743117  0.078305  0.669943  1
  Al  Al234  1  0.077442  0.744092  0.670577  1
  Al  Al235  1  0.223772  0.390325  0.680053  1
  Al  Al236  1  0.557336  0.058235  0.680519  1
  Al  Al237  1  0.480259  0.319842  0.717748  1
  Al  Al238  1  0.850391  0.351286  0.700124  1
  Al  Al239  1  0.184437  0.018505  0.700022  1
  Al  Al240  1  0.517613  0.685334  0.700022  1
  Al  Al241  1  0.889428  0.724672  0.680054  1
  Al  Al242  1  0.818978  0.981121  0.717748  1
  Al  Al243  1  0.263473  0.764363  0.659291  1
  Al  Al244  1  0.055783  0.556678  0.679562  1
  Al  Al245  1  0.390427  0.225083  0.680412  1
  Al  Al246  1  0.429992  0.597877  0.659410  1
  Al  Al247  1  0.683110  0.517385  0.700158  1
  Al  Al248  1  0.016493  0.184000  0.700159  1
  Al  Al249  1  0.351221  0.852115  0.700002  1
  Al  Al250  1  0.724186  0.891323  0.680412  1
  Al  Al251  1  0.763207  0.264100  0.659729  1
  Al  Al252  1  0.096985  0.930882  0.659410  1
