# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.71691103
_cell_length_b   12.71941444
_cell_length_c   47.87196948
_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   7704.55648351
_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  0.169040  0.335921  0.280005  1
  Al  Al2  1  0.502374  1.002588  0.280005  1
  Al  Al3  1  0.471900  0.305471  0.304779  1
  Al  Al4  1  0.835707  0.669254  0.280005  1
  Al  Al5  1  0.805233  0.972137  0.304779  1
  Al  Al6  1  0.776267  0.276498  0.331133  1
  Al  Al7  1  0.138566  0.638804  0.304779  1
  Al  Al8  1  0.109600  0.943165  0.331133  1
  Al  Al9  1  0.442933  0.609832  0.331133  1
  Al  Al10  1  1.002374  0.502588  0.280005  1
  Al  Al11  1  0.335707  0.169254  0.280005  1
  Al  Al12  1  0.305233  0.472137  0.304779  1
  Al  Al13  1  0.669040  0.835921  0.280005  1
  Al  Al14  1  0.638566  0.138804  0.304779  1
  Al  Al15  1  0.609600  0.443165  0.331133  1
  Al  Al16  1  0.971900  0.805471  0.304779  1
  Al  Al17  1  0.942933  0.109832  0.331133  1
  Al  Al18  1  0.276267  0.776498  0.331133  1
  Al  Al19  1  0.109600  0.443165  0.331133  1
  Al  Al20  1  0.442933  0.109832  0.331133  1
  Al  Al21  1  0.502374  0.502588  0.280005  1
  Al  Al22  1  0.776267  0.776498  0.331133  1
  Al  Al23  1  0.835707  0.169254  0.280005  1
  Al  Al24  1  0.805233  0.472137  0.304779  1
  Al  Al25  1  0.169040  0.835921  0.280005  1
  Al  Al26  1  0.138566  0.138804  0.304779  1
  Al  Al27  1  0.471900  0.805471  0.304779  1
  Al  Al28  1  0.971900  0.305471  0.304779  1
  Al  Al29  1  0.305233  0.972137  0.304779  1
  Al  Al30  1  0.276267  0.276498  0.331133  1
  Al  Al31  1  0.638566  0.638804  0.304779  1
  Al  Al32  1  0.609600  0.943165  0.331133  1
  Al  Al33  1  0.669040  0.335921  0.280005  1
  Al  Al34  1  0.942933  0.609832  0.331133  1
  Al  Al35  1  1.002374  1.002588  0.280005  1
  Al  Al36  1  0.335707  0.669254  0.280005  1
  Al  Al37  1  0.079389  0.246292  0.355937  1
  Al  Al38  1  0.412722  0.912959  0.355937  1
  Al  Al39  1  0.382557  0.216128  0.381916  1
  Al  Al40  1  0.746056  0.579626  0.355937  1
  Al  Al41  1  0.715891  0.882794  0.381916  1
  Al  Al42  1  0.685351  0.185591  0.407426  1
  Al  Al43  1  0.049224  0.549461  0.381916  1
  Al  Al44  1  0.018684  0.852257  0.407426  1
  Al  Al45  1  0.352018  0.518924  0.407426  1
  Al  Al46  1  0.912722  0.412959  0.355937  1
  Al  Al47  1  0.246056  0.079626  0.355937  1
  Al  Al48  1  0.215891  0.382794  0.381916  1
  Al  Al49  1  0.579389  0.746292  0.355937  1
  Al  Al50  1  0.549224  0.049461  0.381916  1
  Al  Al51  1  0.518684  0.352257  0.407426  1
  Al  Al52  1  0.882557  0.716128  0.381916  1
  Al  Al53  1  0.852018  0.018924  0.407426  1
  Al  Al54  1  0.185351  0.685591  0.407426  1
  Al  Al55  1  0.018684  0.352257  0.407426  1
  Al  Al56  1  0.352018  0.018924  0.407426  1
  Al  Al57  1  0.412722  0.412959  0.355937  1
  Al  Al58  1  0.685351  0.685591  0.407426  1
  Al  Al59  1  0.746056  0.079626  0.355937  1
  Al  Al60  1  0.715891  0.382794  0.381916  1
  Al  Al61  1  0.079389  0.746292  0.355937  1
  Al  Al62  1  0.049224  0.049461  0.381916  1
  Al  Al63  1  0.382557  0.716128  0.381916  1
  Al  Al64  1  0.882557  0.216128  0.381916  1
  Al  Al65  1  0.215891  0.882794  0.381916  1
  Al  Al66  1  0.185351  0.185591  0.407426  1
  Al  Al67  1  0.549224  0.549461  0.381916  1
  Al  Al68  1  0.518684  0.852257  0.407426  1
  Al  Al69  1  0.579389  0.246292  0.355937  1
  Al  Al70  1  0.852018  0.518924  0.407426  1
  Al  Al71  1  0.912722  0.912959  0.355937  1
  Al  Al72  1  0.246056  0.579626  0.355937  1
  Al  Al73  1  0.988311  0.155219  0.433206  1
  Al  Al74  1  0.321645  0.821886  0.433206  1
  Al  Al75  1  0.291219  0.124796  0.458856  1
  Al  Al76  1  0.654978  0.488553  0.433206  1
  Al  Al77  1  0.624553  0.791463  0.458856  1
  Al  Al78  1  0.594167  0.094412  0.484570  1
  Al  Al79  1  0.957886  0.458129  0.458856  1
  Al  Al80  1  0.927501  0.761079  0.484570  1
  Al  Al81  1  0.260834  0.427746  0.484570  1
  Al  Al82  1  0.821645  0.321886  0.433206  1
  Al  Al83  1  0.154978  0.988553  0.433206  1
  Al  Al84  1  0.124553  0.291463  0.458856  1
  Al  Al85  1  0.488311  0.655219  0.433206  1
  Al  Al86  1  0.457886  0.958129  0.458856  1
  Al  Al87  1  0.427501  0.261079  0.484570  1
  Al  Al88  1  0.791219  0.624796  0.458856  1
  Al  Al89  1  0.760834  0.927746  0.484570  1
  Al  Al90  1  0.094167  0.594412  0.484570  1
  Al  Al91  1  0.927501  0.261079  0.484570  1
  Al  Al92  1  0.260834  0.927746  0.484570  1
  Al  Al93  1  0.321645  0.321886  0.433206  1
  Al  Al94  1  0.594167  0.594412  0.484570  1
  Al  Al95  1  0.654978  0.988553  0.433206  1
  Al  Al96  1  0.624553  0.291463  0.458856  1
  Al  Al97  1  0.988311  0.655219  0.433206  1
  Al  Al98  1  0.957886  0.958129  0.458856  1
  Al  Al99  1  0.291219  0.624796  0.458856  1
  Al  Al100  1  0.791219  0.124796  0.458856  1
  Al  Al101  1  0.124553  0.791463  0.458856  1
  Al  Al102  1  0.094167  0.094412  0.484570  1
  Al  Al103  1  0.457886  0.458129  0.458856  1
  Al  Al104  1  0.427501  0.761079  0.484570  1
  Al  Al105  1  0.488311  0.155219  0.433206  1
  Al  Al106  1  0.760834  0.427746  0.484570  1
  Al  Al107  1  0.821645  0.821886  0.433206  1
  Al  Al108  1  0.154978  0.488553  0.433206  1
  Al  Al109  1  0.897093  0.064006  0.510244  1
  Al  Al110  1  0.230426  0.730673  0.510244  1
  Al  Al111  1  0.200041  0.033623  0.535959  1
  Al  Al112  1  0.563759  0.397340  0.510244  1
  Al  Al113  1  0.533374  0.700289  0.535959  1
  Al  Al114  1  0.502949  1.003199  0.561609  1
  Al  Al115  1  0.866707  0.366956  0.535959  1
  Al  Al116  1  0.836282  0.669866  0.561609  1
  Al  Al117  1  0.169615  0.336533  0.561609  1
  Al  Al118  1  0.730426  0.230673  0.510244  1
  Al  Al119  1  0.063759  0.897340  0.510244  1
  Al  Al120  1  0.033374  0.200289  0.535959  1
  Al  Al121  1  0.397093  0.564006  0.510244  1
  Al  Al122  1  0.366707  0.866956  0.535959  1
  Al  Al123  1  0.336282  0.169866  0.561609  1
  Al  Al124  1  0.700041  0.533623  0.535959  1
  Al  Al125  1  0.669615  0.836533  0.561609  1
  Al  Al126  1  1.002949  0.503199  0.561609  1
  Al  Al127  1  0.836282  0.169866  0.561609  1
  Al  Al128  1  0.169615  0.836533  0.561609  1
  Al  Al129  1  0.230426  0.230673  0.510244  1
  Al  Al130  1  0.502949  0.503199  0.561609  1
  Al  Al131  1  0.563759  0.897340  0.510244  1
  Al  Al132  1  0.533374  0.200289  0.535959  1
  Al  Al133  1  0.897093  0.564006  0.510244  1
  Al  Al134  1  0.866707  0.866956  0.535959  1
  Al  Al135  1  0.200041  0.533623  0.535959  1
  Al  Al136  1  0.700041  0.033623  0.535959  1
  Al  Al137  1  0.033374  0.700289  0.535959  1
  Al  Al138  1  1.002949  1.003199  0.561609  1
  Al  Al139  1  0.366707  0.366956  0.535959  1
  Al  Al140  1  0.336282  0.669866  0.561609  1
  Al  Al141  1  0.397093  0.064006  0.510244  1
  Al  Al142  1  0.669615  0.336533  0.561609  1
  Al  Al143  1  0.730426  0.730673  0.510244  1
  Al  Al144  1  0.063759  0.397340  0.510244  1
  Al  Al145  1  0.805909  0.972828  0.587388  1
  Al  Al146  1  0.139242  0.639495  0.587388  1
  Al  Al147  1  0.108703  0.942291  0.612898  1
  Al  Al148  1  0.472576  0.306161  0.587388  1
  Al  Al149  1  0.442036  0.608958  0.612898  1
  Al  Al150  1  0.411871  0.912126  0.638877  1
  Al  Al151  1  0.775369  0.275624  0.612898  1
  Al  Al152  1  0.745204  0.578793  0.638877  1
  Al  Al153  1  0.078538  0.245460  0.638877  1
  Al  Al154  1  0.639242  0.139495  0.587388  1
  Al  Al155  1  0.972576  0.806161  0.587388  1
  Al  Al156  1  0.942036  0.108958  0.612898  1
  Al  Al157  1  0.305909  0.472828  0.587388  1
  Al  Al158  1  0.275369  0.775624  0.612898  1
  Al  Al159  1  0.245204  0.078793  0.638877  1
  Al  Al160  1  0.608703  0.442291  0.612898  1
  Al  Al161  1  0.578538  0.745460  0.638877  1
  Al  Al162  1  0.911871  0.412126  0.638877  1
  Al  Al163  1  0.745204  0.078793  0.638877  1
  Al  Al164  1  0.078538  0.745460  0.638877  1
  Al  Al165  1  0.139242  0.139495  0.587388  1
  Al  Al166  1  0.411871  0.412126  0.638877  1
  Al  Al167  1  0.472576  0.806161  0.587388  1
  Al  Al168  1  0.442036  0.108958  0.612898  1
  Al  Al169  1  0.805909  0.472828  0.587388  1
  Al  Al170  1  0.775369  0.775624  0.612898  1
  Al  Al171  1  0.108703  0.442291  0.612898  1
  Al  Al172  1  0.608703  0.942291  0.612898  1
  Al  Al173  1  0.942036  0.608958  0.612898  1
  Al  Al174  1  0.911871  0.912126  0.638877  1
  Al  Al175  1  0.275369  0.275624  0.612898  1
  Al  Al176  1  0.245204  0.578793  0.638877  1
  Al  Al177  1  0.305909  0.972828  0.587388  1
  Al  Al178  1  0.578538  0.245460  0.638877  1
  Al  Al179  1  0.639242  0.639495  0.587388  1
  Al  Al180  1  0.972576  0.306161  0.587388  1
  Al  Al181  1  0.714993  0.881920  0.663681  1
  Al  Al182  1  0.048327  0.548587  0.663681  1
  Al  Al183  1  0.019360  0.852948  0.690036  1
  Al  Al184  1  0.381660  0.215254  0.663681  1
  Al  Al185  1  0.352694  0.519615  0.690036  1
  Al  Al186  1  0.322220  0.822498  0.714810  1
  Al  Al187  1  0.686027  0.186281  0.690036  1
  Al  Al188  1  0.655553  0.489165  0.714810  1
  Al  Al189  1  0.988886  0.155831  0.714810  1
  Al  Al190  1  0.548327  0.048587  0.663681  1
  Al  Al191  1  0.881660  0.715254  0.663681  1
  Al  Al192  1  0.852694  0.019615  0.690036  1
  Al  Al193  1  0.214993  0.381920  0.663681  1
  Al  Al194  1  0.186027  0.686281  0.690036  1
  Al  Al195  1  0.155553  0.989165  0.714810  1
  Al  Al196  1  0.519360  0.352948  0.690036  1
  Al  Al197  1  0.488886  0.655831  0.714810  1
  Al  Al198  1  0.822220  0.322498  0.714810  1
  Al  Al199  1  0.655553  0.989165  0.714810  1
  Al  Al200  1  0.988886  0.655831  0.714810  1
  Al  Al201  1  0.048327  0.048587  0.663681  1
  Al  Al202  1  0.322220  0.322498  0.714810  1
  Al  Al203  1  0.381660  0.715254  0.663681  1
  Al  Al204  1  0.352694  0.019615  0.690036  1
  Al  Al205  1  0.714993  0.381920  0.663681  1
  Al  Al206  1  0.686027  0.686281  0.690036  1
  Al  Al207  1  0.019360  0.352948  0.690036  1
  Al  Al208  1  0.519360  0.852948  0.690036  1
  Al  Al209  1  0.852694  0.519615  0.690036  1
  Al  Al210  1  0.822220  0.822498  0.714810  1
  Al  Al211  1  0.186027  0.186281  0.690036  1
  Al  Al212  1  0.155553  0.489165  0.714810  1
  Al  Al213  1  0.214993  0.881920  0.663681  1
  Al  Al214  1  0.488886  0.155831  0.714810  1
  Al  Al215  1  0.548327  0.548587  0.663681  1
  Al  Al216  1  0.881660  0.215254  0.663681  1
