# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.65488123
_cell_length_b   12.65313765
_cell_length_c   48.00395043
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.26082953
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al216
_cell_volume   7648.05288004
_cell_formula_units_Z   216
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  0.924640  0.259861  0.345454  1
  Al  Al2  1  0.259171  0.925332  0.345453  1
  Al  Al3  1  0.320451  0.321153  0.294074  1
  Al  Al4  1  0.682111  0.682820  0.273451  1
  Al  Al5  1  0.651025  0.983297  0.293085  1
  Al  Al6  1  0.619585  0.290913  0.320501  1
  Al  Al7  1  0.982604  0.651718  0.293084  1
  Al  Al8  1  0.959318  0.960023  0.321421  1
  Al  Al9  1  0.290217  0.620286  0.320497  1
  Al  Al10  1  0.150301  0.481476  0.293160  1
  Al  Al11  1  0.480785  0.151006  0.293161  1
  Al  Al12  1  0.452128  0.452823  0.316570  1
  Al  Al13  1  0.817249  0.817940  0.292583  1
  Al  Al14  1  0.790435  0.122687  0.322564  1
  Al  Al15  1  0.845025  0.519330  0.274855  1
  Al  Al16  1  0.121984  0.791138  0.322564  1
  Al  Al17  1  0.181924  0.182640  0.276741  1
  Al  Al18  1  0.518621  0.845735  0.274855  1
  Al  Al19  1  0.958696  0.454412  0.319918  1
  Al  Al20  1  0.293001  0.120283  0.320984  1
  Al  Al21  1  0.258759  0.426421  0.345607  1
  Al  Al22  1  0.622472  0.787301  0.322456  1
  Al  Al23  1  0.681894  0.182166  0.275632  1
  Al  Al24  1  0.645829  0.478870  0.292046  1
  Al  Al25  1  0.016744  0.849243  0.273443  1
  Al  Al26  1  0.983364  0.157979  0.292434  1
  Al  Al27  1  0.318861  0.824153  0.292553  1
  Al  Al28  1  0.119584  0.293698  0.320988  1
  Al  Al29  1  0.453716  0.959397  0.319920  1
  Al  Al30  1  0.425726  0.259451  0.345607  1
  Al  Al31  1  0.786600  0.623174  0.322457  1
  Al  Al32  1  0.848532  0.017456  0.273444  1
  Al  Al33  1  0.823451  0.319553  0.292553  1
  Al  Al34  1  0.181454  0.682605  0.275632  1
  Al  Al35  1  0.157278  0.984055  0.292434  1
  Al  Al36  1  0.478175  0.646526  0.292046  1
  Al  Al37  1  0.833957  0.168609  0.423123  1
  Al  Al38  1  0.167923  0.834643  0.423122  1
  Al  Al39  1  0.228569  0.229258  0.370943  1
  Al  Al40  1  0.589838  0.590528  0.344732  1
  Al  Al41  1  0.560721  0.896620  0.371517  1
  Al  Al42  1  0.531517  0.198847  0.397211  1
  Al  Al43  1  0.895929  0.561414  0.371515  1
  Al  Al44  1  0.864599  0.865286  0.397212  1
  Al  Al45  1  0.198159  0.532205  0.397211  1
  Al  Al46  1  0.062247  0.396440  0.372199  1
  Al  Al47  1  0.395747  0.062939  0.372199  1
  Al  Al48  1  0.364486  0.365175  0.397021  1
  Al  Al49  1  0.728594  0.729286  0.372529  1
  Al  Al50  1  0.697909  0.031759  0.397150  1
  Al  Al51  1  0.757883  0.425810  0.344951  1
  Al  Al52  1  0.031072  0.698596  0.397149  1
  Al  Al53  1  0.092700  0.093388  0.345273  1
  Al  Al54  1  0.425119  0.758574  0.344950  1
  Al  Al55  1  0.864294  0.365385  0.397074  1
  Al  Al56  1  0.198197  0.032360  0.397169  1
  Al  Al57  1  0.167943  0.334671  0.423069  1
  Al  Al58  1  0.530913  0.698305  0.397020  1
  Al  Al59  1  0.592498  0.091854  0.345409  1
  Al  Al60  1  0.560392  0.396861  0.371203  1
  Al  Al61  1  0.924539  0.759973  0.345039  1
  Al  Al62  1  0.895767  0.062871  0.372285  1
  Al  Al63  1  0.229928  0.727934  0.371642  1
  Al  Al64  1  0.031673  0.198884  0.397169  1
  Al  Al65  1  0.364697  0.864981  0.397074  1
  Al  Al66  1  0.333985  0.168629  0.423069  1
  Al  Al67  1  0.697619  0.531600  0.397021  1
  Al  Al68  1  0.759281  0.925229  0.345039  1
  Al  Al69  1  0.727244  0.230618  0.371644  1
  Al  Al70  1  0.091163  0.593189  0.345408  1
  Al  Al71  1  0.062179  0.896459  0.372285  1
  Al  Al72  1  0.396170  0.561083  0.371201  1
  Al  Al73  1  0.742759  0.076924  0.500341  1
  Al  Al74  1  0.076246  0.743438  0.500341  1
  Al  Al75  1  0.137165  0.137848  0.448809  1
  Al  Al76  1  0.500783  0.501470  0.423071  1
  Al  Al77  1  0.470307  0.804271  0.448735  1
  Al  Al78  1  0.439817  0.107426  0.474595  1
  Al  Al79  1  0.803588  0.470991  0.448735  1
  Al  Al80  1  0.773249  0.773930  0.474565  1
  Al  Al81  1  0.106746  0.440498  0.474594  1
  Al  Al82  1  0.970362  0.304413  0.448751  1
  Al  Al83  1  0.303730  0.971045  0.448750  1
  Al  Al84  1  0.273338  0.274019  0.474643  1
  Al  Al85  1  0.636973  0.637656  0.448716  1
  Al  Al86  1  0.606558  0.940718  0.474667  1
  Al  Al87  1  0.667165  0.335213  0.422990  1
  Al  Al88  1  0.940037  0.607240  0.474667  1
  Al  Al89  1  1.001127  1.001813  0.423382  1
  Al  Al90  1  0.334527  0.667851  0.422989  1
  Al  Al91  1  0.773190  0.274034  0.474573  1
  Al  Al92  1  0.106781  0.940552  0.474639  1
  Al  Al93  1  0.076157  0.243509  0.500339  1
  Al  Al94  1  0.439914  0.607224  0.474571  1
  Al  Al95  1  0.500958  1.001583  0.423243  1
  Al  Al96  1  0.470321  0.304436  0.448743  1
  Al  Al97  1  0.834495  0.667829  0.423179  1
  Al  Al98  1  0.803672  0.971102  0.448806  1
  Al  Al99  1  0.137137  0.637741  0.448787  1
  Al  Al100  1  0.939872  0.107461  0.474640  1
  Al  Al101  1  0.273353  0.773871  0.474573  1
  Al  Al102  1  0.242831  0.076835  0.500339  1
  Al  Al103  1  0.606543  0.440595  0.474571  1
  Al  Al104  1  0.667143  0.835180  0.423179  1
  Al  Al105  1  0.637058  0.137820  0.448787  1
  Al  Al106  1  1.000897  0.501645  0.423243  1
  Al  Al107  1  0.970419  0.804355  0.448806  1
  Al  Al108  1  0.303752  0.471004  0.448742  1
  Al  Al109  1  0.650864  0.986028  0.577497  1
  Al  Al110  1  0.985357  0.651535  0.577497  1
  Al  Al111  1  0.045721  0.046396  0.526079  1
  Al  Al112  1  0.409445  0.410123  0.500346  1
  Al  Al113  1  0.378847  0.713007  0.526065  1
  Al  Al114  1  0.348476  0.015927  0.551854  1
  Al  Al115  1  0.712332  0.379523  0.526064  1
  Al  Al116  1  0.681873  0.682546  0.551760  1
  Al  Al117  1  0.015254  0.349150  0.551853  1
  Al  Al118  1  0.879057  0.213063  0.526179  1
  Al  Al119  1  0.212387  0.879733  0.526180  1
  Al  Al120  1  0.181966  0.182638  0.551894  1
  Al  Al121  1  0.545594  0.546270  0.526080  1
  Al  Al122  1  0.515094  0.849180  0.551748  1
  Al  Al123  1  0.576009  0.243516  0.500327  1
  Al  Al124  1  0.848507  0.515767  0.551748  1
  Al  Al125  1  0.909465  0.910143  0.500321  1
  Al  Al126  1  0.242838  0.576688  0.500327  1
  Al  Al127  1  0.681746  0.182700  0.551871  1
  Al  Al128  1  0.015309  0.849248  0.551826  1
  Al  Al129  1  0.985358  0.151783  0.577723  1
  Al  Al130  1  0.348464  0.515636  0.551909  1
  Al  Al131  1  0.409392  0.910167  0.500303  1
  Al  Al132  1  0.378881  0.213185  0.526204  1
  Al  Al133  1  0.742748  0.576769  0.500272  1
  Al  Al134  1  0.712319  0.879763  0.526093  1
  Al  Al135  1  0.045973  0.546105  0.526132  1
  Al  Al136  1  0.848574  0.015982  0.551826  1
  Al  Al137  1  0.182027  0.682420  0.551871  1
  Al  Al138  1  0.151113  0.986029  0.577724  1
  Al  Al139  1  0.514962  0.349138  0.551909  1
  Al  Al140  1  0.576090  0.743426  0.500272  1
  Al  Al141  1  0.545429  0.046648  0.526132  1
  Al  Al142  1  0.909490  0.410070  0.500302  1
  Al  Al143  1  0.879087  0.712995  0.526093  1
  Al  Al144  1  0.212509  0.379556  0.526203  1
  Al  Al145  1  0.560470  0.894048  0.654703  1
  Al  Al146  1  0.893382  0.561135  0.654703  1
  Al  Al147  1  0.954734  0.955402  0.603365  1
  Al  Al148  1  0.318177  0.318848  0.578131  1
  Al  Al149  1  0.287619  0.621191  0.603437  1
  Al  Al150  1  0.255427  0.926133  0.629066  1
  Al  Al151  1  0.620524  0.288287  0.603437  1
  Al  Al152  1  0.589743  0.590408  0.628120  1
  Al  Al153  1  0.925467  0.256094  0.629064  1
  Al  Al154  1  0.787622  0.121798  0.603312  1
  Al  Al155  1  0.121130  0.788290  0.603313  1
  Al  Al156  1  0.091167  0.091835  0.630614  1
  Al  Al157  1  0.453451  0.454119  0.603471  1
  Al  Al158  1  0.423479  0.757918  0.629395  1
  Al  Al159  1  0.484085  0.152862  0.577840  1
  Al  Al160  1  0.757249  0.424148  0.629394  1
  Al  Al161  1  0.818233  0.818905  0.577564  1
  Al  Al162  1  0.152190  0.484756  0.577840  1
  Al  Al163  1  0.588663  0.093063  0.629228  1
  Al  Al164  1  0.925608  0.756304  0.628599  1
  Al  Al165  1  0.894441  0.061649  0.655023  1
  Al  Al166  1  0.258317  0.424159  0.630787  1
  Al  Al167  1  0.317976  0.818818  0.577738  1
  Al  Al168  1  0.287483  0.121781  0.603366  1
  Al  Al169  1  0.651464  0.484867  0.577452  1
  Al  Al170  1  0.620828  0.788324  0.603189  1
  Al  Al171  1  0.953942  0.454955  0.603189  1
  Al  Al172  1  0.755637  0.926275  0.628600  1
  Al  Al173  1  0.092396  0.589330  0.629227  1
  Al  Al174  1  0.060984  0.895104  0.655024  1
  Al  Al175  1  0.423491  0.258987  0.630787  1
  Al  Al176  1  0.484196  0.652135  0.577453  1
  Al  Al177  1  0.454287  0.954609  0.603189  1
  Al  Al178  1  0.818147  0.318648  0.577737  1
  Al  Al179  1  0.787655  0.621496  0.603189  1
  Al  Al180  1  0.121115  0.288149  0.603366  1
  Al  Al181  1  0.467667  0.808380  0.722789  1
  Al  Al182  1  0.807737  0.468306  0.722790  1
  Al  Al183  1  0.863645  0.864300  0.676915  1
  Al  Al184  1  0.226385  0.227043  0.654303  1
  Al  Al185  1  0.199460  0.532710  0.683634  1
  Al  Al186  1  0.169107  0.831492  0.706139  1
  Al  Al187  1  0.532045  0.200124  0.683632  1
  Al  Al188  1  0.505385  0.506037  0.704987  1
  Al  Al189  1  0.830845  0.169771  0.706140  1
  Al  Al190  1  0.692513  0.032313  0.680026  1
  Al  Al191  1  0.031655  0.693169  0.680023  1
  Al  Al192  1  1.003820  1.004478  0.706955  1
  Al  Al193  1  0.367075  0.367739  0.684514  1
  Al  Al194  1  0.332435  0.667192  0.705597  1
  Al  Al195  1  0.393991  0.061432  0.654150  1
  Al  Al196  1  0.666538  0.333084  0.705598  1
  Al  Al197  1  0.727519  0.728182  0.654590  1
  Al  Al198  1  0.060772  0.394651  0.654151  1
  Al  Al199  1  0.500360  1.004396  0.705809  1
  Al  Al200  1  0.827603  0.668504  0.707205  1
  Al  Al201  1  0.804555  0.967332  0.724270  1
  Al  Al202  1  0.166032  0.333645  0.703509  1
  Al  Al203  1  0.226157  0.727310  0.654588  1
  Al  Al204  1  0.199295  0.031382  0.684067  1
  Al  Al205  1  0.559861  0.393302  0.654585  1
  Al  Al206  1  0.532382  0.693994  0.679246  1
  Al  Al207  1  0.868209  0.359815  0.678743  1
  Al  Al208  1  0.667842  0.828255  0.707205  1
  Al  Al209  1  1.003735  0.501007  0.705809  1
  Al  Al210  1  0.966688  0.805201  0.724270  1
  Al  Al211  1  0.332995  0.166682  0.703509  1
  Al  Al212  1  0.392639  0.560521  0.654585  1
  Al  Al213  1  0.359154  0.868870  0.678748  1
  Al  Al214  1  0.726648  0.226818  0.654588  1
  Al  Al215  1  0.693335  0.533041  0.679250  1
  Al  Al216  1  0.030719  0.199960  0.684067  1
