# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.67945665
_cell_length_b   12.68115193
_cell_length_c   47.75734554
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.26082952
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al216
_cell_volume   7640.41812655
_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  0.003923  0.337538  0.280832  1
  Al  Al2  1  0.337256  0.004205  0.280832  1
  Al  Al3  1  0.306256  0.306555  0.304112  1
  Al  Al4  1  0.670590  0.670871  0.280832  1
  Al  Al5  1  0.639590  0.973222  0.304112  1
  Al  Al6  1  0.610811  0.277772  0.331190  1
  Al  Al7  1  0.972923  0.639889  0.304112  1
  Al  Al8  1  0.944145  0.944438  0.331190  1
  Al  Al9  1  0.277478  0.611105  0.331190  1
  Al  Al10  1  0.139590  0.473222  0.304112  1
  Al  Al11  1  0.472923  0.139889  0.304112  1
  Al  Al12  1  0.444145  0.444438  0.331190  1
  Al  Al13  1  0.806256  0.806555  0.304112  1
  Al  Al14  1  0.777478  0.111105  0.331190  1
  Al  Al15  1  0.837256  0.504205  0.280832  1
  Al  Al16  1  0.110811  0.777772  0.331190  1
  Al  Al17  1  0.170590  0.170871  0.280832  1
  Al  Al18  1  0.503923  0.837538  0.280832  1
  Al  Al19  1  0.944145  0.444438  0.331190  1
  Al  Al20  1  0.277478  0.111105  0.331190  1
  Al  Al21  1  0.337256  0.504205  0.280832  1
  Al  Al22  1  0.610811  0.777772  0.331190  1
  Al  Al23  1  0.670590  0.170871  0.280832  1
  Al  Al24  1  0.639590  0.473222  0.304112  1
  Al  Al25  1  0.003923  0.837538  0.280832  1
  Al  Al26  1  0.972923  0.139889  0.304112  1
  Al  Al27  1  0.306256  0.806555  0.304112  1
  Al  Al28  1  0.110811  0.277772  0.331190  1
  Al  Al29  1  0.444145  0.944438  0.331190  1
  Al  Al30  1  0.503923  0.337538  0.280832  1
  Al  Al31  1  0.777478  0.611105  0.331190  1
  Al  Al32  1  0.837256  0.004205  0.280832  1
  Al  Al33  1  0.806256  0.306555  0.304112  1
  Al  Al34  1  0.170590  0.670871  0.280832  1
  Al  Al35  1  0.139590  0.973222  0.304112  1
  Al  Al36  1  0.472923  0.639889  0.304112  1
  Al  Al37  1  0.913683  0.247317  0.355814  1
  Al  Al38  1  0.247016  0.913984  0.355814  1
  Al  Al39  1  0.216749  0.217051  0.381952  1
  Al  Al40  1  0.580349  0.580650  0.355814  1
  Al  Al41  1  0.550082  0.883717  0.381952  1
  Al  Al42  1  0.519416  0.186389  0.407444  1
  Al  Al43  1  0.883416  0.550384  0.381952  1
  Al  Al44  1  0.852749  0.853055  0.407444  1
  Al  Al45  1  0.186083  0.519722  0.407444  1
  Al  Al46  1  0.050082  0.383717  0.381952  1
  Al  Al47  1  0.383416  0.050384  0.381952  1
  Al  Al48  1  0.352749  0.353055  0.407444  1
  Al  Al49  1  0.716749  0.717051  0.381952  1
  Al  Al50  1  0.686083  0.019722  0.407444  1
  Al  Al51  1  0.747016  0.413984  0.355814  1
  Al  Al52  1  0.019416  0.686389  0.407444  1
  Al  Al53  1  0.080349  0.080650  0.355814  1
  Al  Al54  1  0.413683  0.747317  0.355814  1
  Al  Al55  1  0.852749  0.353055  0.407444  1
  Al  Al56  1  0.186083  0.019722  0.407444  1
  Al  Al57  1  0.247016  0.413984  0.355814  1
  Al  Al58  1  0.519416  0.686389  0.407444  1
  Al  Al59  1  0.580349  0.080650  0.355814  1
  Al  Al60  1  0.550082  0.383717  0.381952  1
  Al  Al61  1  0.913683  0.747317  0.355814  1
  Al  Al62  1  0.883416  0.050384  0.381952  1
  Al  Al63  1  0.216749  0.717051  0.381952  1
  Al  Al64  1  0.019416  0.186389  0.407444  1
  Al  Al65  1  0.352749  0.853055  0.407444  1
  Al  Al66  1  0.413683  0.247317  0.355814  1
  Al  Al67  1  0.686083  0.519722  0.407444  1
  Al  Al68  1  0.747016  0.913984  0.355814  1
  Al  Al69  1  0.716749  0.217051  0.381952  1
  Al  Al70  1  0.080349  0.580650  0.355814  1
  Al  Al71  1  0.050082  0.883717  0.381952  1
  Al  Al72  1  0.383416  0.550384  0.381952  1
  Al  Al73  1  0.822268  0.155910  0.433256  1
  Al  Al74  1  0.155601  0.822577  0.433256  1
  Al  Al75  1  0.125054  0.125367  0.458910  1
  Al  Al76  1  0.488935  0.489243  0.433256  1
  Al  Al77  1  0.458388  0.792033  0.458910  1
  Al  Al78  1  0.427880  0.094862  0.484643  1
  Al  Al79  1  0.791721  0.458700  0.458910  1
  Al  Al80  1  0.761214  0.761529  0.484643  1
  Al  Al81  1  0.094547  0.428195  0.484643  1
  Al  Al82  1  0.958388  0.292033  0.458910  1
  Al  Al83  1  0.291721  0.958700  0.458910  1
  Al  Al84  1  0.261214  0.261529  0.484643  1
  Al  Al85  1  0.625054  0.625367  0.458910  1
  Al  Al86  1  0.594547  0.928195  0.484643  1
  Al  Al87  1  0.655601  0.322577  0.433256  1
  Al  Al88  1  0.927880  0.594862  0.484643  1
  Al  Al89  1  0.988935  0.989243  0.433256  1
  Al  Al90  1  0.322268  0.655910  0.433256  1
  Al  Al91  1  0.761214  0.261529  0.484643  1
  Al  Al92  1  0.094547  0.928195  0.484643  1
  Al  Al93  1  0.155601  0.322577  0.433256  1
  Al  Al94  1  0.427880  0.594862  0.484643  1
  Al  Al95  1  0.488935  0.989243  0.433256  1
  Al  Al96  1  0.458388  0.292033  0.458910  1
  Al  Al97  1  0.822268  0.655910  0.433256  1
  Al  Al98  1  0.791721  0.958700  0.458910  1
  Al  Al99  1  0.125054  0.625367  0.458910  1
  Al  Al100  1  0.927880  0.094862  0.484643  1
  Al  Al101  1  0.261214  0.761529  0.484643  1
  Al  Al102  1  0.322268  0.155910  0.433256  1
  Al  Al103  1  0.594547  0.428195  0.484643  1
  Al  Al104  1  0.655601  0.822577  0.433256  1
  Al  Al105  1  0.625054  0.125367  0.458910  1
  Al  Al106  1  0.988935  0.489243  0.433256  1
  Al  Al107  1  0.958388  0.792033  0.458910  1
  Al  Al108  1  0.291721  0.458700  0.458910  1
  Al  Al109  1  0.730681  0.064332  0.510325  1
  Al  Al110  1  0.064014  0.730999  0.510325  1
  Al  Al111  1  0.033506  0.033828  0.536058  1
  Al  Al112  1  0.397347  0.397666  0.510325  1
  Al  Al113  1  0.366840  0.700494  0.536058  1
  Al  Al114  1  0.336293  1.003284  0.561711  1
  Al  Al115  1  0.700173  0.367161  0.536058  1
  Al  Al116  1  0.669626  0.669951  0.561711  1
  Al  Al117  1  1.002960  0.336618  0.561711  1
  Al  Al118  1  0.866840  0.200494  0.536058  1
  Al  Al119  1  0.200173  0.867161  0.536058  1
  Al  Al120  1  0.169626  0.169951  0.561711  1
  Al  Al121  1  0.533506  0.533828  0.536058  1
  Al  Al122  1  0.502960  0.836618  0.561711  1
  Al  Al123  1  0.564014  0.230999  0.510325  1
  Al  Al124  1  0.836293  0.503284  0.561711  1
  Al  Al125  1  0.897347  0.897666  0.510325  1
  Al  Al126  1  0.230681  0.564332  0.510325  1
  Al  Al127  1  0.669626  0.169951  0.561711  1
  Al  Al128  1  1.002960  0.836618  0.561711  1
  Al  Al129  1  0.064014  0.230999  0.510325  1
  Al  Al130  1  0.336293  0.503284  0.561711  1
  Al  Al131  1  0.397347  0.897666  0.510325  1
  Al  Al132  1  0.366840  0.200494  0.536058  1
  Al  Al133  1  0.730681  0.564332  0.510325  1
  Al  Al134  1  0.700173  0.867161  0.536058  1
  Al  Al135  1  0.033506  0.533828  0.536058  1
  Al  Al136  1  0.836293  1.003284  0.561711  1
  Al  Al137  1  0.169626  0.669951  0.561711  1
  Al  Al138  1  0.230681  0.064332  0.510325  1
  Al  Al139  1  0.502960  0.336618  0.561711  1
  Al  Al140  1  0.564014  0.730999  0.510325  1
  Al  Al141  1  0.533506  0.033828  0.536058  1
  Al  Al142  1  0.897347  0.397666  0.510325  1
  Al  Al143  1  0.866840  0.700494  0.536058  1
  Al  Al144  1  0.200173  0.367161  0.536058  1
  Al  Al145  1  0.639145  0.972806  0.587524  1
  Al  Al146  1  0.972478  0.639472  0.587524  1
  Al  Al147  1  0.941812  0.942144  0.613016  1
  Al  Al148  1  0.305812  0.306139  0.587524  1
  Al  Al149  1  0.275145  0.608810  0.613016  1
  Al  Al150  1  0.244878  0.911877  0.639154  1
  Al  Al151  1  0.608479  0.275477  0.613016  1
  Al  Al152  1  0.578212  0.578544  0.639154  1
  Al  Al153  1  0.911545  0.245210  0.639154  1
  Al  Al154  1  0.775145  0.108810  0.613016  1
  Al  Al155  1  0.108479  0.775477  0.613016  1
  Al  Al156  1  0.078212  0.078544  0.639154  1
  Al  Al157  1  0.441812  0.442144  0.613016  1
  Al  Al158  1  0.411545  0.745210  0.639154  1
  Al  Al159  1  0.472478  0.139472  0.587524  1
  Al  Al160  1  0.744878  0.411877  0.639154  1
  Al  Al161  1  0.805812  0.806139  0.587524  1
  Al  Al162  1  0.139145  0.472806  0.587524  1
  Al  Al163  1  0.578212  0.078544  0.639154  1
  Al  Al164  1  0.911545  0.745210  0.639154  1
  Al  Al165  1  0.972478  0.139472  0.587524  1
  Al  Al166  1  0.244878  0.411877  0.639154  1
  Al  Al167  1  0.305812  0.806139  0.587524  1
  Al  Al168  1  0.275145  0.108810  0.613016  1
  Al  Al169  1  0.639145  0.472806  0.587524  1
  Al  Al170  1  0.608479  0.775477  0.613016  1
  Al  Al171  1  0.941812  0.442144  0.613016  1
  Al  Al172  1  0.744878  0.911877  0.639154  1
  Al  Al173  1  0.078212  0.578544  0.639154  1
  Al  Al174  1  0.139145  0.972806  0.587524  1
  Al  Al175  1  0.411545  0.245210  0.639154  1
  Al  Al176  1  0.472478  0.639472  0.587524  1
  Al  Al177  1  0.441812  0.942144  0.613016  1
  Al  Al178  1  0.805812  0.306139  0.587524  1
  Al  Al179  1  0.775145  0.608810  0.613016  1
  Al  Al180  1  0.108479  0.275477  0.613016  1
  Al  Al181  1  0.547750  0.881423  0.663778  1
  Al  Al182  1  0.881083  0.548089  0.663778  1
  Al  Al183  1  0.852305  0.852639  0.690856  1
  Al  Al184  1  0.214416  0.214756  0.663778  1
  Al  Al185  1  0.185638  0.519305  0.690856  1
  Al  Al186  1  0.154638  0.821656  0.714136  1
  Al  Al187  1  0.518971  0.185972  0.690856  1
  Al  Al188  1  0.487971  0.488323  0.714136  1
  Al  Al189  1  0.821305  0.154989  0.714136  1
  Al  Al190  1  0.685638  0.019305  0.690856  1
  Al  Al191  1  0.018971  0.685972  0.690856  1
  Al  Al192  1  0.987971  0.988323  0.714136  1
  Al  Al193  1  0.352305  0.352639  0.690856  1
  Al  Al194  1  0.321305  0.654989  0.714136  1
  Al  Al195  1  0.381083  0.048089  0.663778  1
  Al  Al196  1  0.654638  0.321656  0.714136  1
  Al  Al197  1  0.714416  0.714756  0.663778  1
  Al  Al198  1  0.047750  0.381423  0.663778  1
  Al  Al199  1  0.487971  0.988323  0.714136  1
  Al  Al200  1  0.821305  0.654989  0.714136  1
  Al  Al201  1  0.881083  0.048089  0.663778  1
  Al  Al202  1  0.154638  0.321656  0.714136  1
  Al  Al203  1  0.214416  0.714756  0.663778  1
  Al  Al204  1  0.185638  0.019305  0.690856  1
  Al  Al205  1  0.547750  0.381423  0.663778  1
  Al  Al206  1  0.518971  0.685972  0.690856  1
  Al  Al207  1  0.852305  0.352639  0.690856  1
  Al  Al208  1  0.654638  0.821656  0.714136  1
  Al  Al209  1  0.987971  0.488323  0.714136  1
  Al  Al210  1  0.047750  0.881423  0.663778  1
  Al  Al211  1  0.321305  0.154989  0.714136  1
  Al  Al212  1  0.381083  0.548089  0.663778  1
  Al  Al213  1  0.352305  0.852639  0.690856  1
  Al  Al214  1  0.714416  0.214756  0.663778  1
  Al  Al215  1  0.685638  0.519305  0.690856  1
  Al  Al216  1  0.018971  0.185972  0.690856  1
