# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.67316620
_cell_length_b   12.67168366
_cell_length_c   47.67340409
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al96
_cell_volume   3340.39477119
_cell_formula_units_Z   96
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  0.642315  0.775046  0.264942  1
  Al  Al2  1  0.796331  0.083206  0.282768  1
  Al  Al3  1  0.954477  0.399306  0.298767  1
  Al  Al4  1  0.956632  0.903716  0.301514  1
  Al  Al5  1  0.113784  0.218096  0.319122  1
  Al  Al6  1  0.799059  0.588482  0.281129  1
  Al  Al7  1  0.456632  0.903716  0.301514  1
  Al  Al8  1  0.613784  0.218096  0.319122  1
  Al  Al9  1  0.299059  0.588482  0.281129  1
  Al  Al10  1  0.142315  0.775046  0.264942  1
  Al  Al11  1  0.296331  0.083206  0.282768  1
  Al  Al12  1  0.454477  0.399306  0.298767  1
  Al  Al13  1  0.112878  0.716245  0.320924  1
  Al  Al14  1  0.272119  0.034719  0.340445  1
  Al  Al15  1  0.429187  0.348887  0.358493  1
  Al  Al16  1  0.429309  0.849095  0.359536  1
  Al  Al17  1  0.587799  0.166107  0.378752  1
  Al  Al18  1  0.270141  0.530747  0.338724  1
  Al  Al19  1  0.929309  0.849095  0.359536  1
  Al  Al20  1  0.087799  0.166107  0.378752  1
  Al  Al21  1  0.770141  0.530747  0.338724  1
  Al  Al22  1  0.612878  0.716245  0.320924  1
  Al  Al23  1  0.772119  0.034719  0.340445  1
  Al  Al24  1  0.929187  0.348887  0.358493  1
  Al  Al25  1  0.586283  0.663005  0.378858  1
  Al  Al26  1  0.745104  0.980663  0.398860  1
  Al  Al27  1  0.902690  0.295884  0.418128  1
  Al  Al28  1  0.902413  0.795324  0.418235  1
  Al  Al29  1  0.060591  0.111653  0.437951  1
  Al  Al30  1  0.744360  0.479216  0.398202  1
  Al  Al31  1  0.402413  0.795324  0.418235  1
  Al  Al32  1  0.560591  0.111653  0.437951  1
  Al  Al33  1  0.244360  0.479216  0.398202  1
  Al  Al34  1  0.086283  0.663005  0.378858  1
  Al  Al35  1  0.245104  0.980663  0.398860  1
  Al  Al36  1  0.402690  0.295884  0.418128  1
  Al  Al37  1  0.060122  0.610746  0.437816  1
  Al  Al38  1  0.218125  0.926791  0.457652  1
  Al  Al39  1  0.375994  0.242486  0.477281  1
  Al  Al40  1  0.375873  0.742232  0.477232  1
  Al  Al41  1  0.533758  0.058066  0.496979  1
  Al  Al42  1  0.218079  0.426724  0.457502  1
  Al  Al43  1  0.875873  0.742232  0.477232  1
  Al  Al44  1  0.033758  0.058066  0.496979  1
  Al  Al45  1  0.718079  0.426724  0.457502  1
  Al  Al46  1  0.560122  0.610746  0.437816  1
  Al  Al47  1  0.718125  0.926791  0.457652  1
  Al  Al48  1  0.875994  0.242486  0.477281  1
  Al  Al49  1  0.533691  0.557818  0.496915  1
  Al  Al50  1  0.691576  0.873652  0.516661  1
  Al  Al51  1  0.849370  0.189160  0.536391  1
  Al  Al52  1  0.849324  0.689093  0.536242  1
  Al  Al53  1  1.007328  1.005138  0.556077  1
  Al  Al54  1  0.691455  0.373398  0.516612  1
  Al  Al55  1  0.349324  0.689093  0.536242  1
  Al  Al56  1  0.507328  1.005138  0.556077  1
  Al  Al57  1  0.191455  0.373398  0.516612  1
  Al  Al58  1  0.033691  0.557818  0.496915  1
  Al  Al59  1  0.191576  0.873652  0.516661  1
  Al  Al60  1  0.349370  0.189160  0.536391  1
  Al  Al61  1  1.006858  0.504231  0.555942  1
  Al  Al62  1  0.165036  0.820560  0.575658  1
  Al  Al63  1  0.323089  0.136668  0.595691  1
  Al  Al64  1  0.322345  0.635220  0.595033  1
  Al  Al65  1  0.481167  0.952879  0.615035  1
  Al  Al66  1  0.164759  0.320000  0.575765  1
  Al  Al67  1  0.822345  0.635220  0.595033  1
  Al  Al68  1  0.981167  0.952879  0.615035  1
  Al  Al69  1  0.664759  0.320000  0.575765  1
  Al  Al70  1  0.506858  0.504231  0.555942  1
  Al  Al71  1  0.665036  0.820560  0.575658  1
  Al  Al72  1  0.823089  0.136668  0.595691  1
  Al  Al73  1  0.479650  0.449776  0.615141  1
  Al  Al74  1  0.638141  0.766788  0.634357  1
  Al  Al75  1  0.797308  0.085136  0.655169  1
  Al  Al76  1  0.795330  0.581164  0.653448  1
  Al  Al77  1  0.954571  0.899639  0.672969  1
  Al  Al78  1  0.638263  0.266996  0.635400  1
  Al  Al79  1  0.295330  0.581164  0.653448  1
  Al  Al80  1  0.454571  0.899639  0.672969  1
  Al  Al81  1  0.138263  0.266996  0.635400  1
  Al  Al82  1  0.979650  0.449776  0.615141  1
  Al  Al83  1  0.138141  0.766788  0.634357  1
  Al  Al84  1  0.297308  0.085136  0.655169  1
  Al  Al85  1  0.953665  0.397788  0.674772  1
  Al  Al86  1  0.110817  0.712168  0.692380  1
  Al  Al87  1  0.268390  0.027402  0.712764  1
  Al  Al88  1  0.271118  0.532678  0.711125  1
  Al  Al89  1  0.425134  0.840838  0.728951  1
  Al  Al90  1  0.112972  0.216577  0.695126  1
  Al  Al91  1  0.771118  0.532678  0.711125  1
  Al  Al92  1  0.925134  0.840838  0.728951  1
  Al  Al93  1  0.612972  0.216577  0.695126  1
  Al  Al94  1  0.453665  0.397788  0.674772  1
  Al  Al95  1  0.610817  0.712168  0.692380  1
  Al  Al96  1  0.768390  0.027402  0.712764  1
