# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.65556275
_cell_length_b   12.58771312
_cell_length_c   50.23133849
_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   3485.45287738
_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  0.956397  0.906288  0.284642  1
  Al  Al2  1  0.110277  0.213935  0.300512  1
  Al  Al3  1  0.269912  0.533354  0.321046  1
  Al  Al4  1  0.110277  0.713935  0.300512  1
  Al  Al5  1  0.269912  0.033354  0.321046  1
  Al  Al6  1  0.956397  0.406288  0.284642  1
  Al  Al7  1  0.610277  0.713935  0.300512  1
  Al  Al8  1  0.769912  0.033354  0.321046  1
  Al  Al9  1  0.456397  0.406288  0.284642  1
  Al  Al10  1  0.456397  0.906288  0.284642  1
  Al  Al11  1  0.610277  0.213935  0.300512  1
  Al  Al12  1  0.769912  0.533354  0.321046  1
  Al  Al13  1  0.426289  0.846166  0.338612  1
  Al  Al14  1  0.585667  0.164875  0.357283  1
  Al  Al15  1  0.743035  0.479646  0.375660  1
  Al  Al16  1  0.585667  0.664875  0.357283  1
  Al  Al17  1  0.743035  0.979646  0.375660  1
  Al  Al18  1  0.426289  0.346166  0.338612  1
  Al  Al19  1  0.085667  0.664875  0.357283  1
  Al  Al20  1  0.243035  0.979646  0.375660  1
  Al  Al21  1  0.926289  0.346166  0.338612  1
  Al  Al22  1  0.926289  0.846166  0.338612  1
  Al  Al23  1  0.085667  0.164875  0.357283  1
  Al  Al24  1  0.243035  0.479646  0.375660  1
  Al  Al25  1  0.901074  0.795708  0.394387  1
  Al  Al26  1  0.058804  0.111180  0.412810  1
  Al  Al27  1  0.216738  0.427047  0.431403  1
  Al  Al28  1  0.058804  0.611180  0.412810  1
  Al  Al29  1  0.216738  0.927047  0.431403  1
  Al  Al30  1  0.901074  0.295708  0.394387  1
  Al  Al31  1  0.558804  0.611180  0.412810  1
  Al  Al32  1  0.716738  0.927047  0.431403  1
  Al  Al33  1  0.401074  0.295708  0.394387  1
  Al  Al34  1  0.401074  0.795708  0.394387  1
  Al  Al35  1  0.558804  0.111180  0.412810  1
  Al  Al36  1  0.716738  0.427047  0.431403  1
  Al  Al37  1  0.374523  0.742622  0.449952  1
  Al  Al38  1  0.532387  0.058354  0.468495  1
  Al  Al39  1  0.690226  0.374035  0.487042  1
  Al  Al40  1  0.532387  0.558354  0.468495  1
  Al  Al41  1  0.690226  0.874035  0.487042  1
  Al  Al42  1  0.374523  0.242622  0.449952  1
  Al  Al43  1  0.032387  0.558354  0.468495  1
  Al  Al44  1  0.190226  0.874035  0.487042  1
  Al  Al45  1  0.874523  0.242622  0.449952  1
  Al  Al46  1  0.874523  0.742622  0.449952  1
  Al  Al47  1  0.032387  0.058354  0.468495  1
  Al  Al48  1  0.190226  0.374035  0.487042  1
  Al  Al49  1  0.848065  0.689716  0.505597  1
  Al  Al50  1  1.005904  1.005397  0.524144  1
  Al  Al51  1  0.163768  0.321129  0.542687  1
  Al  Al52  1  1.005904  0.505397  0.524144  1
  Al  Al53  1  0.163768  0.821129  0.542687  1
  Al  Al54  1  0.848065  0.189716  0.505597  1
  Al  Al55  1  0.505904  0.505397  0.524144  1
  Al  Al56  1  0.663768  0.821129  0.542687  1
  Al  Al57  1  0.348065  0.189716  0.505597  1
  Al  Al58  1  0.348065  0.689716  0.505597  1
  Al  Al59  1  0.505904  1.005397  0.524144  1
  Al  Al60  1  0.663768  0.321129  0.542687  1
  Al  Al61  1  0.321553  0.636703  0.561236  1
  Al  Al62  1  0.479486  0.952571  0.579829  1
  Al  Al63  1  0.637217  0.268043  0.598252  1
  Al  Al64  1  0.479486  0.452571  0.579829  1
  Al  Al65  1  0.637217  0.768043  0.598252  1
  Al  Al66  1  0.321553  0.136703  0.561236  1
  Al  Al67  1  0.979486  0.452571  0.579829  1
  Al  Al68  1  0.137217  0.768043  0.598252  1
  Al  Al69  1  0.821553  0.136703  0.561236  1
  Al  Al70  1  0.821553  0.636703  0.561236  1
  Al  Al71  1  0.979486  0.952571  0.579829  1
  Al  Al72  1  0.137217  0.268043  0.598252  1
  Al  Al73  1  0.795256  0.584105  0.616979  1
  Al  Al74  1  0.952624  0.898875  0.635356  1
  Al  Al75  1  0.112002  0.217585  0.654027  1
  Al  Al76  1  0.952624  0.398875  0.635356  1
  Al  Al77  1  0.112002  0.717585  0.654027  1
  Al  Al78  1  0.795256  0.084105  0.616979  1
  Al  Al79  1  0.452624  0.398875  0.635356  1
  Al  Al80  1  0.612002  0.717585  0.654027  1
  Al  Al81  1  0.295256  0.084105  0.616979  1
  Al  Al82  1  0.295256  0.584105  0.616979  1
  Al  Al83  1  0.452624  0.898875  0.635356  1
  Al  Al84  1  0.612002  0.217585  0.654027  1
  Al  Al85  1  0.268379  0.530397  0.671593  1
  Al  Al86  1  0.428014  0.849816  0.692127  1
  Al  Al87  1  0.581894  0.157462  0.707997  1
  Al  Al88  1  0.428014  0.349816  0.692127  1
  Al  Al89  1  0.581894  0.657462  0.707997  1
  Al  Al90  1  0.268379  0.030397  0.671593  1
  Al  Al91  1  0.928014  0.349816  0.692127  1
  Al  Al92  1  0.081894  0.657462  0.707997  1
  Al  Al93  1  0.768379  0.030397  0.671593  1
  Al  Al94  1  0.768379  0.530397  0.671593  1
  Al  Al95  1  0.928014  0.849816  0.692127  1
  Al  Al96  1  0.081894  0.157462  0.707997  1
