# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.49120677
_cell_length_b   14.49410320
_cell_length_c   47.39914381
_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   9472.59048737
_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  0.889840  0.223655  0.320483  1
  Al  Al2  1  0.224794  0.892738  0.322190  1
  Al  Al3  1  0.264402  0.264792  0.300937  1
  Al  Al4  1  0.518586  0.186582  0.343104  1
  Al  Al5  1  0.968554  0.975555  0.282234  1
  Al  Al6  1  0.306315  0.638447  0.281681  1
  Al  Al7  1  0.558315  0.559177  0.322363  1
  Al  Al8  1  0.596784  0.931972  0.300961  1
  Al  Al9  1  0.930557  0.598289  0.300897  1
  Al  Al10  1  0.685559  0.019611  0.343103  1
  Al  Al11  1  0.137476  0.807282  0.281681  1
  Al  Al12  1  0.058136  0.059351  0.322360  1
  Al  Al13  1  0.430952  0.097809  0.300961  1
  Al  Al14  1  0.763769  0.765420  0.300937  1
  Al  Al15  1  0.097270  0.431579  0.300897  1
  Al  Al16  1  0.474600  0.469526  0.282238  1
  Al  Al17  1  0.391702  0.725831  0.322191  1
  Al  Al18  1  0.722607  0.390879  0.320480  1
  Al  Al19  1  0.870806  0.039823  0.333171  1
  Al  Al20  1  0.205107  0.706125  0.333206  1
  Al  Al21  1  0.243058  0.077514  0.310599  1
  Al  Al22  1  0.619401  0.120395  0.291322  1
  Al  Al23  1  0.951082  0.784963  0.291109  1
  Al  Al24  1  0.283965  0.452088  0.291109  1
  Al  Al25  1  0.538792  0.371833  0.333178  1
  Al  Al26  1  0.576484  0.744088  0.310599  1
  Al  Al27  1  0.910305  0.411338  0.311042  1
  Al  Al28  1  0.705299  0.206332  0.331885  1
  Al  Al29  1  0.038565  0.872297  0.333433  1
  Al  Al30  1  0.076852  0.244396  0.310810  1
  Al  Al31  1  0.451391  0.285161  0.291536  1
  Al  Al32  1  0.784154  0.952380  0.291534  1
  Al  Al33  1  0.117820  0.618823  0.290919  1
  Al  Al34  1  0.371278  0.539586  0.333435  1
  Al  Al35  1  0.409687  0.910718  0.310637  1
  Al  Al36  1  0.743365  0.577882  0.310810  1
  Al  Al37  1  0.773625  0.109312  0.384444  1
  Al  Al38  1  0.107440  0.775168  0.384719  1
  Al  Al39  1  0.146998  0.148115  0.363399  1
  Al  Al40  1  0.401538  0.069249  0.405095  1
  Al  Al41  1  0.852509  0.852266  0.343148  1
  Al  Al42  1  0.185153  0.520002  0.342923  1
  Al  Al43  1  0.441415  0.441428  0.384511  1
  Al  Al44  1  0.480478  0.814798  0.363381  1
  Al  Al45  1  0.812741  0.480385  0.362963  1
  Al  Al46  1  0.568210  0.902577  0.405095  1
  Al  Al47  1  0.018979  0.686176  0.342923  1
  Al  Al48  1  0.940392  0.942453  0.384509  1
  Al  Al49  1  0.313761  0.981515  0.363381  1
  Al  Al50  1  0.647080  0.648036  0.363400  1
  Al  Al51  1  0.979349  0.313779  0.362963  1
  Al  Al52  1  0.351240  0.353532  0.343149  1
  Al  Al53  1  0.274132  0.608475  0.384720  1
  Al  Al54  1  0.608278  0.274657  0.384446  1
  Al  Al55  1  0.754327  0.922106  0.394809  1
  Al  Al56  1  0.087485  0.588521  0.394834  1
  Al  Al57  1  0.127295  0.961972  0.374026  1
  Al  Al58  1  0.499247  1.000279  0.352861  1
  Al  Al59  1  0.832528  0.666493  0.352905  1
  Al  Al60  1  0.165461  0.333558  0.352905  1
  Al  Al61  1  0.421069  0.255362  0.394809  1
  Al  Al62  1  0.460934  0.628334  0.374028  1
  Al  Al63  1  0.794064  0.295105  0.373483  1
  Al  Al64  1  0.587697  0.088732  0.394766  1
  Al  Al65  1  0.920988  0.755196  0.394861  1
  Al  Al66  1  0.960291  0.129007  0.373838  1
  Al  Al67  1  0.332458  0.166876  0.352847  1
  Al  Al68  1  0.665845  0.833490  0.352847  1
  Al  Al69  1  0.998989  0.500020  0.352948  1
  Al  Al70  1  0.254159  0.422023  0.394861  1
  Al  Al71  1  0.294160  0.795199  0.373998  1
  Al  Al72  1  0.627970  0.461329  0.373840  1
  Al  Al73  1  0.656301  0.990724  0.446926  1
  Al  Al74  1  0.989559  0.657291  0.446928  1
  Al  Al75  1  0.028896  0.030243  0.426035  1
  Al  Al76  1  0.283808  0.951514  0.467804  1
  Al  Al77  1  0.734834  0.735842  0.405090  1
  Al  Al78  1  0.067819  0.402246  0.404987  1
  Al  Al79  1  0.323021  0.323978  0.446939  1
  Al  Al80  1  0.362434  0.696746  0.426118  1
  Al  Al81  1  0.695838  0.363275  0.425958  1
  Al  Al82  1  0.450467  0.784855  0.467804  1
  Al  Al83  1  0.901207  0.568857  0.404987  1
  Al  Al84  1  0.822935  0.824065  0.446939  1
  Al  Al85  1  0.195704  0.863477  0.426118  1
  Al  Al86  1  0.529201  0.529939  0.426036  1
  Al  Al87  1  0.862233  0.196880  0.425957  1
  Al  Al88  1  0.234802  0.235872  0.405090  1
  Al  Al89  1  0.156247  0.490603  0.446928  1
  Al  Al90  1  0.489681  0.157344  0.446926  1
  Al  Al91  1  0.636705  0.804443  0.457321  1
  Al  Al92  1  0.969979  0.471024  0.457242  1
  Al  Al93  1  0.009180  0.843833  0.436572  1
  Al  Al94  1  0.382019  0.883061  0.415575  1
  Al  Al95  1  0.715368  0.549539  0.415468  1
  Al  Al96  1  0.048497  0.216409  0.415468  1
  Al  Al97  1  0.303397  0.137750  0.457321  1
  Al  Al98  1  0.342790  0.510223  0.436573  1
  Al  Al99  1  0.675983  0.177023  0.436549  1
  Al  Al100  1  0.470058  0.971104  0.457329  1
  Al  Al101  1  0.803358  0.637721  0.457279  1
  Al  Al102  1  0.842545  0.010510  0.436515  1
  Al  Al103  1  0.215301  0.049734  0.415568  1
  Al  Al104  1  0.548693  0.716343  0.415569  1
  Al  Al105  1  0.881843  0.382884  0.415351  1
  Al  Al106  1  0.136676  0.304402  0.457279  1
  Al  Al107  1  0.175945  0.676988  0.436637  1
  Al  Al108  1  0.509468  0.343587  0.436516  1
  Al  Al109  1  0.538536  0.873020  0.509541  1
  Al  Al110  1  0.871915  0.539662  0.509455  1
  Al  Al111  1  0.911174  0.912306  0.488701  1
  Al  Al112  1  0.166072  0.833793  0.530517  1
  Al  Al113  1  0.617145  0.618148  0.467751  1
  Al  Al114  1  0.950409  0.284842  0.467697  1
  Al  Al115  1  0.205326  0.206258  0.509495  1
  Al  Al116  1  0.244580  0.578899  0.488724  1
  Al  Al117  1  0.577871  0.245576  0.488690  1
  Al  Al118  1  0.332739  0.667126  0.530517  1
  Al  Al119  1  0.783796  0.451456  0.467697  1
  Al  Al120  1  0.705206  0.706378  0.509495  1
  Al  Al121  1  0.077850  0.745629  0.488724  1
  Al  Al122  1  0.411256  0.412223  0.488701  1
  Al  Al123  1  0.744528  0.078919  0.488690  1
  Al  Al124  1  0.117101  0.118191  0.467751  1
  Al  Al125  1  0.038611  0.372966  0.509455  1
  Al  Al126  1  0.371968  0.039588  0.509541  1
  Al  Al127  1  0.518917  0.686738  0.520001  1
  Al  Al128  1  0.852291  0.353343  0.519917  1
  Al  Al129  1  0.891539  0.725999  0.499082  1
  Al  Al130  1  0.264192  0.765241  0.478304  1
  Al  Al131  1  0.597545  0.431855  0.478214  1
  Al  Al132  1  0.930807  0.098593  0.478214  1
  Al  Al133  1  0.185685  0.019970  0.520001  1
  Al  Al134  1  0.224948  0.392589  0.499082  1
  Al  Al135  1  0.558221  0.059272  0.499100  1
  Al  Al136  1  0.352310  0.853363  0.520055  1
  Al  Al137  1  0.685584  0.520054  0.519935  1
  Al  Al138  1  0.724860  0.892654  0.499097  1
  Al  Al139  1  0.097489  0.931930  0.478265  1
  Al  Al140  1  0.430882  0.598537  0.478266  1
  Al  Al141  1  0.764176  0.265223  0.478206  1
  Al  Al142  1  0.019002  0.186636  0.519935  1
  Al  Al143  1  0.058241  0.559291  0.499070  1
  Al  Al144  1  0.391604  0.225910  0.499097  1
  Al  Al145  1  0.420774  0.755225  0.572324  1
  Al  Al146  1  0.753955  0.421901  0.572092  1
  Al  Al147  1  0.793443  0.794676  0.551239  1
  Al  Al148  1  0.048620  0.716414  0.593105  1
  Al  Al149  1  0.499346  0.500447  0.530461  1
  Al  Al150  1  0.832697  0.167037  0.530415  1
  Al  Al151  1  0.087573  0.088326  0.572180  1
  Al  Al152  1  0.126950  0.461243  0.551187  1
  Al  Al153  1  0.460147  0.127779  0.551266  1
  Al  Al154  1  0.215352  0.549682  0.593106  1
  Al  Al155  1  0.665984  0.333750  0.530415  1
  Al  Al156  1  0.587268  0.588631  0.572180  1
  Al  Al157  1  0.960186  0.628007  0.551187  1
  Al  Al158  1  0.293618  0.294500  0.551239  1
  Al  Al159  1  0.626722  0.961205  0.551266  1
  Al  Al160  1  0.999394  1.000400  0.530461  1
  Al  Al161  1  0.920844  0.255013  0.572093  1
  Al  Al162  1  0.254167  0.921832  0.572324  1
  Al  Al163  1  0.401298  0.569029  0.582788  1
  Al  Al164  1  0.734453  0.235512  0.582588  1
  Al  Al165  1  0.773650  0.608349  0.561590  1
  Al  Al166  1  0.146520  0.647576  0.540903  1
  Al  Al167  1  0.479778  0.314144  0.540886  1
  Al  Al168  1  0.813089  0.980833  0.540886  1
  Al  Al169  1  0.067970  0.902357  0.582788  1
  Al  Al170  1  0.107291  0.274708  0.561591  1
  Al  Al171  1  0.440385  0.941443  0.561819  1
  Al  Al172  1  0.234669  0.735729  0.582793  1
  Al  Al173  1  0.567771  0.402302  0.582677  1
  Al  Al174  1  0.606890  0.775042  0.561696  1
  Al  Al175  1  0.979802  0.814253  0.540905  1
  Al  Al176  1  0.313197  0.480858  0.540905  1
  Al  Al177  1  0.646395  0.147450  0.540866  1
  Al  Al178  1  0.901243  0.068831  0.582677  1
  Al  Al179  1  0.940458  0.441515  0.561584  1
  Al  Al180  1  0.273983  0.107948  0.561697  1
  Al  Al181  1  0.303781  0.638140  0.635095  1
  Al  Al182  1  0.636044  0.303721  0.634735  1
  Al  Al183  1  0.674824  0.677237  0.613614  1
  Al  Al184  1  0.931786  0.598704  0.654797  1
  Al  Al185  1  0.381937  0.382916  0.593141  1
  Al  Al186  1  0.714875  0.049311  0.593074  1
  Al  Al187  1  0.970318  0.971456  0.635144  1
  Al  Al188  1  0.009416  0.342791  0.613509  1
  Al  Al189  1  0.342029  0.009674  0.614046  1
  Al  Al190  1  0.097626  0.432863  0.654798  1
  Al  Al191  1  0.548248  0.215937  0.593074  1
  Al  Al192  1  0.470392  0.471384  0.635144  1
  Al  Al193  1  0.841729  0.510478  0.613507  1
  Al  Al194  1  0.176171  0.175889  0.613617  1
  Al  Al195  1  0.508611  0.843093  0.614046  1
  Al  Al196  1  0.881853  0.882999  0.593140  1
  Al  Al197  1  0.802658  0.137109  0.634736  1
  Al  Al198  1  0.137074  0.804846  0.635095  1
  Al  Al199  1  0.284175  0.451879  0.645105  1
  Al  Al200  1  0.617190  0.118260  0.645305  1
  Al  Al201  1  0.655214  0.490461  0.624278  1
  Al  Al202  1  0.028934  0.529998  0.603118  1
  Al  Al203  1  0.362074  0.196406  0.603333  1
  Al  Al204  1  0.695341  0.863140  0.603333  1
  Al  Al205  1  0.950808  0.785246  0.645105  1
  Al  Al206  1  0.989400  0.156277  0.624280  1
  Al  Al207  1  0.322427  0.823489  0.624567  1
  Al  Al208  1  0.117671  0.618741  0.645080  1
  Al  Al209  1  0.450510  0.285103  0.645206  1
  Al  Al210  1  0.489011  0.656836  0.624587  1
  Al  Al211  1  0.862128  0.696690  0.603215  1
  Al  Al212  1  0.195625  0.363192  0.603216  1
  Al  Al213  1  0.528569  0.029634  0.603379  1
  Al  Al214  1  0.784033  0.951582  0.645206  1
  Al  Al215  1  0.822349  0.323410  0.624060  1
  Al  Al216  1  0.155775  0.990072  0.624587  1
  Al  Al217  1  0.185887  0.519744  0.697082  1
  Al  Al218  1  0.518695  0.186473  0.697137  1
  Al  Al219  1  0.560479  0.560816  0.677586  1
  Al  Al220  1  0.810560  0.480425  0.715817  1
  Al  Al221  1  0.263934  0.266027  0.654891  1
  Al  Al222  1  0.597977  0.931847  0.654874  1
  Al  Al223  1  0.852115  0.853907  0.697094  1
  Al  Al224  1  0.891397  0.226002  0.675757  1
  Al  Al225  1  0.226509  0.894353  0.677338  1
  Al  Al226  1  0.979289  0.311707  0.715820  1
  Al  Al227  1  0.430769  0.099055  0.654874  1
  Al  Al228  1  0.352828  0.353200  0.697094  1
  Al  Al229  1  0.724938  0.392459  0.675755  1
  Al  Al230  1  0.059750  0.061536  0.677584  1
  Al  Al231  1  0.393288  0.727575  0.677338  1
  Al  Al232  1  0.764950  0.765014  0.654890  1
  Al  Al233  1  0.685390  0.019777  0.697137  1
  Al  Al234  1  0.018658  0.686968  0.697082  1
  Al  Al235  1  0.165040  0.332973  0.706534  1
  Al  Al236  1  0.497765  0.998878  0.706427  1
  Al  Al237  1  0.539808  0.373823  0.687283  1
  Al  Al238  1  0.911673  0.412752  0.664384  1
  Al  Al239  1  0.243885  0.079601  0.666013  1
  Al  Al240  1  0.578535  0.744950  0.666012  1
  Al  Al241  1  0.831856  0.666139  0.706532  1
  Al  Al242  1  0.872752  0.040878  0.687283  1
  Al  Al243  1  0.205939  0.707011  0.687093  1
  Al  Al244  1  0.999180  0.500286  0.706718  1
  Al  Al245  1  0.329875  0.165979  0.706569  1
  Al  Al246  1  0.372764  0.540343  0.687061  1
  Al  Al247  1  0.744495  0.579664  0.664970  1
  Al  Al248  1  0.078590  0.245565  0.664978  1
  Al  Al249  1  0.411321  0.912385  0.665869  1
  Al  Al250  1  0.664866  0.830986  0.706569  1
  Al  Al251  1  0.706516  0.207587  0.687552  1
  Al  Al252  1  0.039270  0.873832  0.687062  1
