# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.59539128
_cell_length_b   14.59351754
_cell_length_c   47.68661192
_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   9664.39244998
_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  0.758625  0.260019  0.305436  1
  Al  Al2  1  0.091958  0.926686  0.305436  1
  Al  Al3  1  0.130881  0.298968  0.287795  1
  Al  Al4  1  0.386120  0.220841  0.325017  1
  Al  Al5  1  0.719453  0.887508  0.325017  1
  Al  Al6  1  0.052787  0.554175  0.325017  1
  Al  Al7  1  0.425292  0.593352  0.305436  1
  Al  Al8  1  0.464214  0.965634  0.287795  1
  Al  Al9  1  0.797547  0.632301  0.287795  1
  Al  Al10  1  0.925292  0.093352  0.305436  1
  Al  Al11  1  0.258625  0.760019  0.305436  1
  Al  Al12  1  0.297547  0.132301  0.287795  1
  Al  Al13  1  0.552787  0.054175  0.325017  1
  Al  Al14  1  0.886120  0.720841  0.325017  1
  Al  Al15  1  0.219453  0.387508  0.325017  1
  Al  Al16  1  0.591958  0.426686  0.305436  1
  Al  Al17  1  0.630881  0.798968  0.287795  1
  Al  Al18  1  0.964214  0.465634  0.287795  1
  Al  Al19  1  0.738257  0.072983  0.314998  1
  Al  Al20  1  0.071591  0.739650  0.314998  1
  Al  Al21  1  0.111844  0.113245  0.295512  1
  Al  Al22  1  0.365797  0.033862  0.337598  1
  Al  Al23  1  0.699130  0.700529  0.337598  1
  Al  Al24  1  0.032463  0.367196  0.337598  1
  Al  Al25  1  0.404924  0.406316  0.314998  1
  Al  Al26  1  0.445177  0.779912  0.295512  1
  Al  Al27  1  0.778510  0.446578  0.295512  1
  Al  Al28  1  0.945177  0.279912  0.295512  1
  Al  Al29  1  0.278510  0.946578  0.295512  1
  Al  Al30  1  0.199130  0.200529  0.337598  1
  Al  Al31  1  0.571591  0.239650  0.314998  1
  Al  Al32  1  0.904924  0.906316  0.314998  1
  Al  Al33  1  0.238257  0.572983  0.314998  1
  Al  Al34  1  0.611844  0.613245  0.295512  1
  Al  Al35  1  0.532463  0.867196  0.337598  1
  Al  Al36  1  0.865797  0.533862  0.337598  1
  Al  Al37  1  0.641085  0.142469  0.367051  1
  Al  Al38  1  0.974418  0.809136  0.367051  1
  Al  Al39  1  0.013060  0.181118  0.346778  1
  Al  Al40  1  0.268303  0.103021  0.388843  1
  Al  Al41  1  0.601636  0.769688  0.388843  1
  Al  Al42  1  0.934970  0.436355  0.388843  1
  Al  Al43  1  0.307752  0.475802  0.367051  1
  Al  Al44  1  0.346393  0.847785  0.346778  1
  Al  Al45  1  0.679726  0.514451  0.346778  1
  Al  Al46  1  0.807752  0.975802  0.367051  1
  Al  Al47  1  0.141085  0.642469  0.367051  1
  Al  Al48  1  0.179726  0.014451  0.346778  1
  Al  Al49  1  0.434970  0.936355  0.388843  1
  Al  Al50  1  0.768303  0.603021  0.388843  1
  Al  Al51  1  0.101636  0.269688  0.388843  1
  Al  Al52  1  0.474418  0.309136  0.367051  1
  Al  Al53  1  0.513060  0.681118  0.346778  1
  Al  Al54  1  0.846393  0.347785  0.346778  1
  Al  Al55  1  0.621773  0.956489  0.377505  1
  Al  Al56  1  0.955106  0.623155  0.377505  1
  Al  Al57  1  0.993437  0.994824  0.356776  1
  Al  Al58  1  0.248282  0.916331  0.398821  1
  Al  Al59  1  0.581616  0.582997  0.398821  1
  Al  Al60  1  0.914949  0.249664  0.398821  1
  Al  Al61  1  0.288440  0.289822  0.377505  1
  Al  Al62  1  0.326771  0.661491  0.356776  1
  Al  Al63  1  0.660104  0.328158  0.356776  1
  Al  Al64  1  0.826771  0.161491  0.356776  1
  Al  Al65  1  0.160104  0.828158  0.356776  1
  Al  Al66  1  0.081616  0.082997  0.398821  1
  Al  Al67  1  0.455106  0.123155  0.377505  1
  Al  Al68  1  0.788440  0.789822  0.377505  1
  Al  Al69  1  0.121773  0.456489  0.377505  1
  Al  Al70  1  0.493437  0.494824  0.356776  1
  Al  Al71  1  0.414949  0.749664  0.398821  1
  Al  Al72  1  0.748282  0.416331  0.398821  1
  Al  Al73  1  0.523048  0.024422  0.430130  1
  Al  Al74  1  0.856381  0.691088  0.430130  1
  Al  Al75  1  0.895337  0.063382  0.409039  1
  Al  Al76  1  0.150066  0.984771  0.451105  1
  Al  Al77  1  0.483399  0.651437  0.451105  1
  Al  Al78  1  0.816733  0.318104  0.451105  1
  Al  Al79  1  0.189714  0.357755  0.430130  1
  Al  Al80  1  0.228670  0.730049  0.409039  1
  Al  Al81  1  0.562004  0.396715  0.409039  1
  Al  Al82  1  0.689714  0.857755  0.430130  1
  Al  Al83  1  0.023048  0.524422  0.430130  1
  Al  Al84  1  0.062004  0.896715  0.409039  1
  Al  Al85  1  0.316733  0.818104  0.451105  1
  Al  Al86  1  0.650066  0.484771  0.451105  1
  Al  Al87  1  0.983399  0.151437  0.451105  1
  Al  Al88  1  0.356381  0.191088  0.430130  1
  Al  Al89  1  0.395337  0.563382  0.409039  1
  Al  Al90  1  0.728670  0.230049  0.409039  1
  Al  Al91  1  0.503184  0.837891  0.440889  1
  Al  Al92  1  0.836517  0.504558  0.440889  1
  Al  Al93  1  0.875841  0.877216  0.419466  1
  Al  Al94  1  0.130403  0.798438  0.461466  1
  Al  Al95  1  0.463736  0.465105  0.461466  1
  Al  Al96  1  0.797069  0.131772  0.461466  1
  Al  Al97  1  0.169851  0.171224  0.440889  1
  Al  Al98  1  0.209174  0.543883  0.419466  1
  Al  Al99  1  0.542507  0.210550  0.419466  1
  Al  Al100  1  0.709174  0.043883  0.419466  1
  Al  Al101  1  0.042507  0.710550  0.419466  1
  Al  Al102  1  0.963736  0.965105  0.461466  1
  Al  Al103  1  0.336517  0.004558  0.440889  1
  Al  Al104  1  0.669851  0.671224  0.440889  1
  Al  Al105  1  0.003184  0.337891  0.440889  1
  Al  Al106  1  0.375841  0.377216  0.419466  1
  Al  Al107  1  0.297069  0.631772  0.461466  1
  Al  Al108  1  0.630403  0.298438  0.461466  1
  Al  Al109  1  0.404891  0.906254  0.493089  1
  Al  Al110  1  0.738224  0.572921  0.493089  1
  Al  Al111  1  0.777524  0.945558  0.471988  1
  Al  Al112  1  0.032074  0.866767  0.513874  1
  Al  Al113  1  0.365407  0.533433  0.513874  1
  Al  Al114  1  0.698740  0.200100  0.513874  1
  Al  Al115  1  0.071557  0.239587  0.493089  1
  Al  Al116  1  0.110858  0.612225  0.471988  1
  Al  Al117  1  0.444191  0.278891  0.471988  1
  Al  Al118  1  0.571557  0.739587  0.493089  1
  Al  Al119  1  0.904891  0.406254  0.493089  1
  Al  Al120  1  0.944191  0.778891  0.471988  1
  Al  Al121  1  0.198740  0.700100  0.513874  1
  Al  Al122  1  0.532074  0.366767  0.513874  1
  Al  Al123  1  0.865407  0.033433  0.513874  1
  Al  Al124  1  0.238224  0.072921  0.493089  1
  Al  Al125  1  0.277524  0.445558  0.471988  1
  Al  Al126  1  0.610858  0.112225  0.471988  1
  Al  Al127  1  0.385134  0.719828  0.503363  1
  Al  Al128  1  0.718467  0.386495  0.503363  1
  Al  Al129  1  0.757951  0.759316  0.482578  1
  Al  Al130  1  0.012500  0.680524  0.524465  1
  Al  Al131  1  0.345833  0.347191  0.524465  1
  Al  Al132  1  0.679167  0.013858  0.524465  1
  Al  Al133  1  0.051800  0.053161  0.503363  1
  Al  Al134  1  0.091284  0.425982  0.482578  1
  Al  Al135  1  0.424617  0.092649  0.482578  1
  Al  Al136  1  0.591284  0.925982  0.482578  1
  Al  Al137  1  0.924617  0.592649  0.482578  1
  Al  Al138  1  0.845833  0.847191  0.524465  1
  Al  Al139  1  0.218467  0.886495  0.503363  1
  Al  Al140  1  0.551800  0.553161  0.503363  1
  Al  Al141  1  0.885134  0.219828  0.503363  1
  Al  Al142  1  0.257951  0.259316  0.482578  1
  Al  Al143  1  0.179167  0.513858  0.524465  1
  Al  Al144  1  0.512500  0.180524  0.524465  1
  Al  Al145  1  0.286840  0.788191  0.555563  1
  Al  Al146  1  0.620174  0.454858  0.555563  1
  Al  Al147  1  0.659622  0.827644  0.534987  1
  Al  Al148  1  0.914184  0.748866  0.576987  1
  Al  Al149  1  0.247517  0.415532  0.576987  1
  Al  Al150  1  0.580850  0.082199  0.576987  1
  Al  Al151  1  0.953507  0.121525  0.555563  1
  Al  Al152  1  0.992955  0.494311  0.534987  1
  Al  Al153  1  0.326288  0.160977  0.534987  1
  Al  Al154  1  0.453507  0.621525  0.555563  1
  Al  Al155  1  0.786840  0.288191  0.555563  1
  Al  Al156  1  0.826288  0.660977  0.534987  1
  Al  Al157  1  0.080850  0.582199  0.576987  1
  Al  Al158  1  0.414184  0.248866  0.576987  1
  Al  Al159  1  0.747517  0.915532  0.576987  1
  Al  Al160  1  0.120174  0.954858  0.555563  1
  Al  Al161  1  0.159622  0.327644  0.534987  1
  Al  Al162  1  0.492955  0.994311  0.534987  1
  Al  Al163  1  0.266977  0.601660  0.566322  1
  Al  Al164  1  0.600310  0.268327  0.566322  1
  Al  Al165  1  0.639958  0.641312  0.545348  1
  Al  Al166  1  0.894687  0.562700  0.587413  1
  Al  Al167  1  0.228021  0.229367  0.587413  1
  Al  Al168  1  0.561354  0.896033  0.587413  1
  Al  Al169  1  0.933643  0.934994  0.566322  1
  Al  Al170  1  0.973292  0.307978  0.545348  1
  Al  Al171  1  0.306625  0.974645  0.545348  1
  Al  Al172  1  0.473292  0.807978  0.545348  1
  Al  Al173  1  0.806625  0.474645  0.545348  1
  Al  Al174  1  0.728021  0.729367  0.587413  1
  Al  Al175  1  0.100310  0.768327  0.566322  1
  Al  Al176  1  0.433643  0.434994  0.566322  1
  Al  Al177  1  0.766977  0.101660  0.566322  1
  Al  Al178  1  0.139958  0.141312  0.545348  1
  Al  Al179  1  0.061354  0.396033  0.587413  1
  Al  Al180  1  0.394687  0.062700  0.587413  1
  Al  Al181  1  0.168251  0.669594  0.618947  1
  Al  Al182  1  0.501585  0.336260  0.618947  1
  Al  Al183  1  0.541742  0.709752  0.597631  1
  Al  Al184  1  0.796587  0.631258  0.639677  1
  Al  Al185  1  0.129920  0.297925  0.639677  1
  Al  Al186  1  0.463254  0.964591  0.639677  1
  Al  Al187  1  0.834918  1.002927  0.618947  1
  Al  Al188  1  0.875075  0.376418  0.597631  1
  Al  Al189  1  0.208409  0.043085  0.597631  1
  Al  Al190  1  0.334918  0.502927  0.618947  1
  Al  Al191  1  0.668251  0.169594  0.618947  1
  Al  Al192  1  0.708409  0.543085  0.597631  1
  Al  Al193  1  0.963254  0.464591  0.639677  1
  Al  Al194  1  0.296587  0.131258  0.639677  1
  Al  Al195  1  0.629920  0.797925  0.639677  1
  Al  Al196  1  1.001585  0.836260  0.618947  1
  Al  Al197  1  0.041742  0.209752  0.597631  1
  Al  Al198  1  0.375075  0.876418  0.597631  1
  Al  Al199  1  0.148939  0.483613  0.629401  1
  Al  Al200  1  0.482273  0.150280  0.629401  1
  Al  Al201  1  0.521721  0.523061  0.607609  1
  Al  Al202  1  0.776965  0.444964  0.649674  1
  Al  Al203  1  0.110298  0.111631  0.649674  1
  Al  Al204  1  0.443631  0.778298  0.649674  1
  Al  Al205  1  0.815606  0.816947  0.629401  1
  Al  Al206  1  0.855055  0.189728  0.607609  1
  Al  Al207  1  0.188388  0.856394  0.607609  1
  Al  Al208  1  0.355055  0.689728  0.607609  1
  Al  Al209  1  0.688388  0.356394  0.607609  1
  Al  Al210  1  0.610298  0.611631  0.649674  1
  Al  Al211  1  0.982273  0.650280  0.629401  1
  Al  Al212  1  0.315606  0.316947  0.629401  1
  Al  Al213  1  0.648939  0.983613  0.629401  1
  Al  Al214  1  0.021721  0.023061  0.607609  1
  Al  Al215  1  0.943631  0.278298  0.649674  1
  Al  Al216  1  0.276965  0.944964  0.649674  1
  Al  Al217  1  0.051767  0.553099  0.681454  1
  Al  Al218  1  0.385100  0.219766  0.681454  1
  Al  Al219  1  0.424228  0.592220  0.658854  1
  Al  Al220  1  0.678181  0.512837  0.700941  1
  Al  Al221  1  0.011514  0.179504  0.700941  1
  Al  Al222  1  0.344847  0.846170  0.700941  1
  Al  Al223  1  0.718434  0.886433  0.681454  1
  Al  Al224  1  0.757561  0.258886  0.658854  1
  Al  Al225  1  0.090894  0.925553  0.658854  1
  Al  Al226  1  0.218434  0.386433  0.681454  1
  Al  Al227  1  0.551767  0.053099  0.681454  1
  Al  Al228  1  0.590894  0.425553  0.658854  1
  Al  Al229  1  0.844847  0.346170  0.700941  1
  Al  Al230  1  0.178181  0.012837  0.700941  1
  Al  Al231  1  0.511514  0.679504  0.700941  1
  Al  Al232  1  0.885100  0.719766  0.681454  1
  Al  Al233  1  0.924228  0.092220  0.658854  1
  Al  Al234  1  0.257561  0.758886  0.658854  1
  Al  Al235  1  0.031399  0.366063  0.691016  1
  Al  Al236  1  0.364733  0.032730  0.691016  1
  Al  Al237  1  0.403904  0.405241  0.671436  1
  Al  Al238  1  0.659144  0.327115  0.708658  1
  Al  Al239  1  0.992477  0.993781  0.708658  1
  Al  Al240  1  0.325810  0.660448  0.708658  1
  Al  Al241  1  0.698066  0.699396  0.691016  1
  Al  Al242  1  0.737238  0.071907  0.671436  1
  Al  Al243  1  0.070571  0.738574  0.671436  1
  Al  Al244  1  0.237238  0.571907  0.671436  1
  Al  Al245  1  0.570571  0.238574  0.671436  1
  Al  Al246  1  0.492477  0.493781  0.708658  1
  Al  Al247  1  0.864733  0.532730  0.691016  1
  Al  Al248  1  0.198066  0.199396  0.691016  1
  Al  Al249  1  0.531399  0.866063  0.691016  1
  Al  Al250  1  0.903904  0.905241  0.671436  1
  Al  Al251  1  0.825810  0.160448  0.708658  1
  Al  Al252  1  0.159144  0.827115  0.708658  1
