# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.88271263
_cell_length_b   9.08914678
_cell_length_c   44.72664598
_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   Al126
_cell_volume   4806.43021214
_cell_formula_units_Z   126
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  0.827299  0.415324  0.367760  1
  Al  Al2  1  0.160633  0.081991  0.367760  1
  Al  Al3  1  0.197487  0.479182  0.326206  1
  Al  Al4  1  0.493966  0.748658  0.367760  1
  Al  Al5  1  0.530820  0.145848  0.326206  1
  Al  Al6  1  0.510727  0.442680  0.347103  1
  Al  Al7  1  0.864154  0.812515  0.326206  1
  Al  Al8  1  0.844060  0.109346  0.347103  1
  Al  Al9  1  0.177394  0.776013  0.347103  1
  Al  Al10  1  0.712772  0.331272  0.317516  1
  Al  Al11  1  0.046106  0.997938  0.317516  1
  Al  Al12  1  0.014812  0.299072  0.335607  1
  Al  Al13  1  0.379439  0.664605  0.317516  1
  Al  Al14  1  0.348146  0.965739  0.335607  1
  Al  Al15  1  0.334204  0.261999  0.356335  1
  Al  Al16  1  0.681479  0.632405  0.335607  1
  Al  Al17  1  0.667538  0.928666  0.356335  1
  Al  Al18  1  0.000871  0.595333  0.356335  1
  Al  Al19  1  0.777772  0.318133  0.427363  1
  Al  Al20  1  0.111105  0.984800  0.427363  1
  Al  Al21  1  0.143219  0.380586  0.386767  1
  Al  Al22  1  0.444438  0.651466  0.427363  1
  Al  Al23  1  0.476552  1.047253  0.386767  1
  Al  Al24  1  0.460701  0.348533  0.406975  1
  Al  Al25  1  0.809886  0.713920  0.386767  1
  Al  Al26  1  0.794034  1.015200  0.406975  1
  Al  Al27  1  0.127368  0.681867  0.406975  1
  Al  Al28  1  0.653010  0.229275  0.377490  1
  Al  Al29  1  -0.013656  0.895941  0.377490  1
  Al  Al30  1  -0.031636  0.198323  0.397151  1
  Al  Al31  1  0.319677  0.562608  0.377490  1
  Al  Al32  1  0.301698  0.864989  0.397151  1
  Al  Al33  1  0.286599  0.167696  0.417282  1
  Al  Al34  1  0.635031  0.531656  0.397151  1
  Al  Al35  1  0.619932  0.834363  0.417282  1
  Al  Al36  1  -0.046734  0.501029  0.417282  1
  Al  Al37  1  0.727526  0.223766  0.487998  1
  Al  Al38  1  0.060860  0.890432  0.487998  1
  Al  Al39  1  0.094237  0.286489  0.447515  1
  Al  Al40  1  0.394193  0.557099  0.487998  1
  Al  Al41  1  0.427571  0.953155  0.447515  1
  Al  Al42  1  0.410984  0.255274  0.467808  1
  Al  Al43  1  0.760904  0.619822  0.447515  1
  Al  Al44  1  0.744317  0.921940  0.467808  1
  Al  Al45  1  0.077650  0.588607  0.467808  1
  Al  Al46  1  0.602348  0.135343  0.437399  1
  Al  Al47  1  -0.064318  0.802010  0.437399  1
  Al  Al48  1  0.919202  0.104093  0.457637  1
  Al  Al49  1  0.269015  0.468676  0.437399  1
  Al  Al50  1  0.252536  0.770759  0.457637  1
  Al  Al51  1  0.235942  0.072833  0.477891  1
  Al  Al52  1  0.585869  0.437426  0.457637  1
  Al  Al53  1  0.569276  0.739499  0.477891  1
  Al  Al54  1  0.902609  0.406166  0.477891  1
  Al  Al55  1  0.677640  0.129698  0.548736  1
  Al  Al56  1  0.010973  0.796365  0.548736  1
  Al  Al57  1  0.044266  0.192412  0.508265  1
  Al  Al58  1  0.344306  0.463032  0.548736  1
  Al  Al59  1  0.377599  0.859079  0.508265  1
  Al  Al60  1  0.360901  0.161006  0.528502  1
  Al  Al61  1  0.710933  0.525746  0.508265  1
  Al  Al62  1  0.694234  0.827673  0.528502  1
  Al  Al63  1  0.027568  0.494340  0.528502  1
  Al  Al64  1  0.552547  1.041398  0.498156  1
  Al  Al65  1  0.885880  0.708065  0.498156  1
  Al  Al66  1  0.869286  1.010090  0.518390  1
  Al  Al67  1  0.219214  0.374731  0.498156  1
  Al  Al68  1  0.202619  0.676757  0.518390  1
  Al  Al69  1  0.185921  0.978684  0.538627  1
  Al  Al70  1  0.535952  0.343423  0.518390  1
  Al  Al71  1  0.519254  0.645351  0.538627  1
  Al  Al72  1  0.852587  0.312018  0.538627  1
  Al  Al73  1  0.627838  1.035753  0.609493  1
  Al  Al74  1  -0.038828  0.702420  0.609493  1
  Al  Al75  1  -0.005756  0.098264  0.569001  1
  Al  Al76  1  0.294505  0.369087  0.609493  1
  Al  Al77  1  0.327577  0.764930  0.569001  1
  Al  Al78  1  0.310984  0.067004  0.589255  1
  Al  Al79  1  0.660911  0.431597  0.569001  1
  Al  Al80  1  0.644318  0.733670  0.589255  1
  Al  Al81  1  -0.022349  0.400337  0.589255  1
  Al  Al82  1  0.502660  0.947331  0.558895  1
  Al  Al83  1  0.835994  0.613998  0.558895  1
  Al  Al84  1  0.819203  0.915823  0.579084  1
  Al  Al85  1  0.169327  0.280664  0.558895  1
  Al  Al86  1  0.152536  0.582489  0.579084  1
  Al  Al87  1  0.135949  0.884608  0.599377  1
  Al  Al88  1  0.485869  0.249156  0.579084  1
  Al  Al89  1  0.469283  0.551274  0.599377  1
  Al  Al90  1  0.802616  0.217941  0.599377  1
  Al  Al91  1  0.577176  0.941822  0.669402  1
  Al  Al92  1  0.910510  0.608488  0.669402  1
  Al  Al93  1  -0.056412  1.003400  0.629610  1
  Al  Al94  1  0.243843  0.275155  0.669402  1
  Al  Al95  1  0.276921  0.670067  0.629610  1
  Al  Al96  1  0.261822  0.972774  0.649741  1
  Al  Al97  1  0.610254  0.336734  0.629610  1
  Al  Al98  1  0.595156  0.639440  0.649741  1
  Al  Al99  1  -0.071511  0.306107  0.649741  1
  Al  Al100  1  0.452415  0.852963  0.619529  1
  Al  Al101  1  0.785748  0.519630  0.619529  1
  Al  Al102  1  0.769485  0.822563  0.639917  1
  Al  Al103  1  0.119081  0.186297  0.619529  1
  Al  Al104  1  0.102819  0.489230  0.639917  1
  Al  Al105  1  0.086968  0.790510  0.660126  1
  Al  Al106  1  0.436152  0.155896  0.639917  1
  Al  Al107  1  0.420301  0.457177  0.660126  1
  Al  Al108  1  0.753634  0.123844  0.660126  1
  Al  Al109  1  0.517414  0.839825  0.729376  1
  Al  Al110  1  0.850748  0.506491  0.729376  1
  Al  Al111  1  0.895982  0.909097  0.690557  1
  Al  Al112  1  0.184081  0.173158  0.729376  1
  Al  Al113  1  0.229316  0.575764  0.690557  1
  Al  Al114  1  0.215374  0.872024  0.711285  1
  Al  Al115  1  0.562649  0.242430  0.690557  1
  Al  Al116  1  0.548708  0.538691  0.711285  1
  Al  Al117  1  0.882041  0.205358  0.711285  1
  Al  Al118  1  0.402887  0.755772  0.679132  1
  Al  Al119  1  0.736221  0.422439  0.679132  1
  Al  Al120  1  0.719460  0.728417  0.699789  1
  Al  Al121  1  0.069554  0.089105  0.679132  1
  Al  Al122  1  0.052793  0.395083  0.699789  1
  Al  Al123  1  0.032699  0.691915  0.720686  1
  Al  Al124  1  0.386126  1.061750  0.699789  1
  Al  Al125  1  0.366033  0.358581  0.720686  1
  Al  Al126  1  0.699366  1.025248  0.720686  1
