# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.09557050
_cell_length_b   10.07673236
_cell_length_c   46.95039661
_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   4752.33943575
_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  0.016343  0.352725  0.322944  1
  Al  Al2  1  0.369090  0.036219  0.334026  1
  Al  Al3  1  0.435176  0.434769  0.289805  1
  Al  Al4  1  0.700554  0.704806  0.334134  1
  Al  Al5  1  0.763507  0.099630  0.291609  1
  Al  Al6  1  0.733592  0.387037  0.307090  1
  Al  Al7  1  0.098515  0.771637  0.289717  1
  Al  Al8  1  0.050651  0.069702  0.306834  1
  Al  Al9  1  0.381976  0.718304  0.308177  1
  Al  Al10  1  0.843298  0.178772  0.342614  1
  Al  Al11  1  0.286254  0.956066  0.283744  1
  Al  Al12  1  0.257378  0.237982  0.299216  1
  Al  Al13  1  0.619756  0.622473  0.283852  1
  Al  Al14  1  0.572142  0.907951  0.299843  1
  Al  Al15  1  0.546655  0.211848  0.319092  1
  Al  Al16  1  0.901831  0.593935  0.299238  1
  Al  Al17  1  0.876001  0.882715  0.319144  1
  Al  Al18  1  0.196835  0.533173  0.315803  1
  Al  Al19  1  0.931102  0.266009  0.394642  1
  Al  Al20  1  0.265235  0.944956  0.392188  1
  Al  Al21  1  0.336254  0.336428  0.350100  1
  Al  Al22  1  0.609151  0.600941  0.392260  1
  Al  Al23  1  0.658791  0.994493  0.351646  1
  Al  Al24  1  0.634468  0.303730  0.372557  1
  Al  Al25  1  1.000552  0.672311  0.350178  1
  Al  Al26  1  0.968208  0.970069  0.372667  1
  Al  Al27  1  0.289439  0.625697  0.367806  1
  Al  Al28  1  0.746473  0.081866  0.403837  1
  Al  Al29  1  0.179268  0.860484  0.339965  1
  Al  Al30  1  0.141670  0.159827  0.359426  1
  Al  Al31  1  0.524160  0.515525  0.340056  1
  Al  Al32  1  0.471600  0.807332  0.360586  1
  Al  Al33  1  0.451815  0.127297  0.384670  1
  Al  Al34  1  0.824275  0.477491  0.359672  1
  Al  Al35  1  0.791778  0.787353  0.384803  1
  Al  Al36  1  0.107784  0.443544  0.377626  1
  Al  Al37  1  0.832471  0.167423  0.455883  1
  Al  Al38  1  0.177632  0.839224  0.455896  1
  Al  Al39  1  0.229942  0.245078  0.413325  1
  Al  Al40  1  0.503955  0.512573  0.455700  1
  Al  Al41  1  0.561627  0.897210  0.412037  1
  Al  Al42  1  0.536495  0.213115  0.436087  1
  Al  Al43  1  0.909958  0.565417  0.413539  1
  Al  Al44  1  0.877787  0.871733  0.436230  1
  Al  Al45  1  0.196688  0.531988  0.432522  1
  Al  Al46  1  0.648606  0.984056  0.463790  1
  Al  Al47  1  0.089403  0.754475  0.402991  1
  Al  Al48  1  0.055956  0.056177  0.425773  1
  Al  Al49  1  0.418729  0.424929  0.402845  1
  Al  Al50  1  0.379101  0.714848  0.420902  1
  Al  Al51  1  0.354001  0.027719  0.444360  1
  Al  Al52  1  0.721141  0.390939  0.425625  1
  Al  Al53  1  0.692183  0.689374  0.444383  1
  Al  Al54  1  0.016986  0.351569  0.447331  1
  Al  Al55  1  0.735380  0.070460  0.515631  1
  Al  Al56  1  0.080961  0.743123  0.520337  1
  Al  Al57  1  0.145078  0.140555  0.478356  1
  Al  Al58  1  0.408536  0.415114  0.520187  1
  Al  Al59  1  0.467064  0.802441  0.474363  1
  Al  Al60  1  0.442326  0.110356  0.496773  1
  Al  Al61  1  0.805816  0.479783  0.478172  1
  Al  Al62  1  0.775071  0.777332  0.496730  1
  Al  Al63  1  0.103572  0.437746  0.499706  1
  Al  Al64  1  0.554225  0.889166  0.528223  1
  Al  Al65  1  0.995178  0.654709  0.467049  1
  Al  Al66  1  0.963872  0.956595  0.488020  1
  Al  Al67  1  0.319652  0.329885  0.466861  1
  Al  Al68  1  0.284885  0.619565  0.486657  1
  Al  Al69  1  0.265358  0.924586  0.509233  1
  Al  Al70  1  0.621768  0.298824  0.487869  1
  Al  Al71  1  0.589632  0.599861  0.508994  1
  Al  Al72  1  0.918814  0.253548  0.507409  1
  Al  Al73  1  0.641898  0.976303  0.582115  1
  Al  Al74  1  0.975864  0.656115  0.582950  1
  Al  Al75  1  0.049375  0.043200  0.539946  1
  Al  Al76  1  0.322118  0.309866  0.583232  1
  Al  Al77  1  0.371301  0.705505  0.540456  1
  Al  Al78  1  0.352556  0.012411  0.562852  1
  Al  Al79  1  0.708704  0.384152  0.539814  1
  Al  Al80  1  0.677879  0.686536  0.562585  1
  Al  Al81  1  0.004261  0.338817  0.558765  1
  Al  Al82  1  0.458263  0.791945  0.593378  1
  Al  Al83  1  0.891305  0.567861  0.530523  1
  Al  Al84  1  0.858962  0.865437  0.549018  1
  Al  Al85  1  0.233447  0.225660  0.530763  1
  Al  Al86  1  0.188966  0.522702  0.552036  1
  Al  Al87  1  0.165923  0.832529  0.573437  1
  Al  Al88  1  0.530923  0.193851  0.549124  1
  Al  Al89  1  0.498342  0.499686  0.573321  1
  Al  Al90  1  0.822276  0.157128  0.567723  1
  Al  Al91  1  0.541791  0.874936  0.646425  1
  Al  Al92  1  0.885409  0.552033  0.644322  1
  Al  Al93  1  0.941294  0.953524  0.601334  1
  Al  Al94  1  0.217883  0.219098  0.644359  1
  Al  Al95  1  0.275125  0.608517  0.603830  1
  Al  Al96  1  0.254633  0.920805  0.626338  1
  Al  Al97  1  0.619375  0.275835  0.601497  1
  Al  Al98  1  0.586925  0.587934  0.626275  1
  Al  Al99  1  0.908597  0.242920  0.620779  1
  Al  Al100  1  0.359303  0.692505  0.655868  1
  Al  Al101  1  0.795692  0.467972  0.592115  1
  Al  Al102  1  0.766349  0.774186  0.616724  1
  Al  Al103  1  0.133549  0.129861  0.592187  1
  Al  Al104  1  0.089503  0.423702  0.609749  1
  Al  Al105  1  0.063191  0.745327  0.635202  1
  Al  Al106  1  0.440779  0.100427  0.617013  1
  Al  Al107  1  0.411485  0.396787  0.635539  1
  Al  Al108  1  0.726751  0.060532  0.636622  1
  Al  Al109  1  0.445638  0.778825  0.705582  1
  Al  Al110  1  0.783138  0.443079  0.703744  1
  Al  Al111  1  0.862745  0.858744  0.670718  1
  Al  Al112  1  0.110033  0.116456  0.703530  1
  Al  Al113  1  0.176897  0.511090  0.660025  1
  Al  Al114  1  0.151809  0.833806  0.687467  1
  Al  Al115  1  0.526020  0.196300  0.670994  1
  Al  Al116  1  0.500515  0.485354  0.687750  1
  Al  Al117  1  0.818608  0.151782  0.687989  1
  Al  Al118  1  0.260076  0.593727  0.710635  1
  Al  Al119  1  0.706375  0.363318  0.653054  1
  Al  Al120  1  0.681450  0.675155  0.678841  1
  Al  Al121  1  0.029245  0.039914  0.652877  1
  Al  Al122  1  0.998775  0.332677  0.674658  1
  Al  Al123  1  0.979656  0.622507  0.695989  1
  Al  Al124  1  0.342309  0.014927  0.678834  1
  Al  Al125  1  0.289226  0.313438  0.695918  1
  Al  Al126  1  0.630590  0.963260  0.696543  1
