# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.65628132
_cell_length_b   12.63999014
_cell_length_c   47.47257225
_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   3308.1279874
_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  0.910370  0.897937  0.310042  1
  Al  Al2  1  0.065244  0.209721  0.327877  1
  Al  Al3  1  0.759375  0.586790  0.288545  1
  Al  Al4  1  0.603822  0.776859  0.272340  1
  Al  Al5  1  0.755606  0.075852  0.288241  1
  Al  Al6  1  0.913467  0.395445  0.305660  1
  Al  Al7  1  0.105582  0.780683  0.272514  1
  Al  Al8  1  0.249286  0.061041  0.288054  1
  Al  Al9  1  0.423672  0.405084  0.308467  1
  Al  Al10  1  0.416886  0.895504  0.310388  1
  Al  Al11  1  0.158479  0.259310  0.275027  1
  Al  Al12  1  0.256705  0.586413  0.288275  1
  Al  Al13  1  0.386962  0.845373  0.366108  1
  Al  Al14  1  0.545475  0.163617  0.384060  1
  Al  Al15  1  0.226321  0.528866  0.345228  1
  Al  Al16  1  0.070951  0.712830  0.327523  1
  Al  Al17  1  0.229993  0.031254  0.346449  1
  Al  Al18  1  0.386980  0.345543  0.364622  1
  Al  Al19  1  0.570363  0.711180  0.327644  1
  Al  Al20  1  0.728369  0.032385  0.346452  1
  Al  Al21  1  0.884559  0.345048  0.363775  1
  Al  Al22  1  0.886705  0.845987  0.365864  1
  Al  Al23  1  0.558589  0.213420  0.322904  1
  Al  Al24  1  0.733366  0.530890  0.345955  1
  Al  Al25  1  0.859890  0.792232  0.424928  1
  Al  Al26  1  0.017888  0.108263  0.444748  1
  Al  Al27  1  0.702008  0.475642  0.404595  1
  Al  Al28  1  0.543598  0.659823  0.385295  1
  Al  Al29  1  0.702476  0.977646  0.405116  1
  Al  Al30  1  0.859710  0.292568  0.424380  1
  Al  Al31  1  0.045085  0.660719  0.385467  1
  Al  Al32  1  0.202867  0.977710  0.405112  1
  Al  Al33  1  0.360230  0.292443  0.424561  1
  Al  Al34  1  0.360238  0.792219  0.425079  1
  Al  Al35  1  0.044678  0.162376  0.385496  1
  Al  Al36  1  0.200963  0.475156  0.404282  1
  Al  Al37  1  0.333340  0.738896  0.484290  1
  Al  Al38  1  0.491434  0.055215  0.503950  1
  Al  Al39  1  0.175409  0.423236  0.464254  1
  Al  Al40  1  0.017587  0.607099  0.444568  1
  Al  Al41  1  0.175713  0.923763  0.464509  1
  Al  Al42  1  0.333539  0.239299  0.484185  1
  Al  Al43  1  0.517189  0.606970  0.444504  1
  Al  Al44  1  0.675774  0.923797  0.464529  1
  Al  Al45  1  0.833404  0.239352  0.484126  1
  Al  Al46  1  0.833255  0.738883  0.484200  1
  Al  Al47  1  0.518130  0.108608  0.444297  1
  Al  Al48  1  0.675505  0.423338  0.464382  1
  Al  Al49  1  0.806893  0.686127  0.543613  1
  Al  Al50  1  0.964789  1.001910  0.563691  1
  Al  Al51  1  0.649017  0.370368  0.523921  1
  Al  Al52  1  0.491047  0.554577  0.504072  1
  Al  Al53  1  0.649180  0.870585  0.523873  1
  Al  Al54  1  0.806967  0.186406  0.543739  1
  Al  Al55  1  0.991203  0.554585  0.504091  1
  Al  Al56  1  0.149079  0.870579  0.523864  1
  Al  Al57  1  0.307090  0.186396  0.543758  1
  Al  Al58  1  0.306926  0.686170  0.543717  1
  Al  Al59  1  0.991380  0.055090  0.504179  1
  Al  Al60  1  0.148991  0.370349  0.523841  1
  Al  Al61  1  0.279965  0.632263  0.603058  1
  Al  Al62  1  0.438716  0.949768  0.622657  1
  Al  Al63  1  0.122472  0.317293  0.583523  1
  Al  Al64  1  0.964568  0.501307  0.563567  1
  Al  Al65  1  0.122478  0.817630  0.583391  1
  Al  Al66  1  0.280290  0.133202  0.603291  1
  Al  Al67  1  0.464399  0.501306  0.563561  1
  Al  Al68  1  0.622819  0.817630  0.583394  1
  Al  Al69  1  0.780573  0.133204  0.603285  1
  Al  Al70  1  0.779907  0.632155  0.602848  1
  Al  Al71  1  0.464889  1.002117  0.563387  1
  Al  Al72  1  0.622528  0.317388  0.583658  1
  Al  Al73  1  0.753407  0.579156  0.660763  1
  Al  Al74  1  0.911371  0.895073  0.681514  1
  Al  Al75  1  0.595295  0.262929  0.643038  1
  Al  Al76  1  0.436662  0.447182  0.623321  1
  Al  Al77  1  0.595937  0.763682  0.642334  1
  Al  Al78  1  0.754964  0.081709  0.662246  1
  Al  Al79  1  0.938183  0.447183  0.623323  1
  Al  Al80  1  0.095407  0.763682  0.642334  1
  Al  Al81  1  0.254405  0.081710  0.662247  1
  Al  Al82  1  0.254623  0.581584  0.661564  1
  Al  Al83  1  0.938302  0.948938  0.623611  1
  Al  Al84  1  0.095371  0.263090  0.642883  1
  Al  Al85  1  0.228986  0.530296  0.717268  1
  Al  Al86  1  0.383019  0.838415  0.733430  1
  Al  Al87  1  0.072129  0.216627  0.700930  1
  Al  Al88  1  0.911658  0.396025  0.680860  1
  Al  Al89  1  0.064030  0.712661  0.699117  1
  Al  Al90  1  0.223677  0.024527  0.717680  1
  Al  Al91  1  0.412025  0.396023  0.680860  1
  Al  Al92  1  0.576278  0.712661  0.699116  1
  Al  Al93  1  0.728492  0.024513  0.717681  1
  Al  Al94  1  0.728168  0.528667  0.717104  1
  Al  Al95  1  0.412504  0.897352  0.678987  1
  Al  Al96  1  0.570483  0.213323  0.701227  1
