# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68659678
_cell_length_b   12.70133540
_cell_length_c   47.66897745
_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   3355.82617945
_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  0.872974  0.738664  0.290223  1
  Al  Al2  1  0.032243  0.057235  0.311096  1
  Al  Al3  1  0.717889  0.428529  0.272440  1
  Al  Al4  1  0.717889  0.928529  0.272440  1
  Al  Al5  1  0.872974  0.238664  0.290223  1
  Al  Al6  1  0.032243  0.557235  0.311096  1
  Al  Al7  1  0.217889  0.928529  0.272440  1
  Al  Al8  1  0.372974  0.238664  0.290223  1
  Al  Al9  1  0.532243  0.557235  0.311096  1
  Al  Al10  1  0.372974  0.738664  0.290223  1
  Al  Al11  1  0.532243  0.057235  0.311096  1
  Al  Al12  1  0.217889  0.428529  0.272440  1
  Al  Al13  1  0.348081  0.688922  0.349898  1
  Al  Al14  1  0.505764  0.004300  0.369215  1
  Al  Al15  1  0.189006  0.370775  0.330452  1
  Al  Al16  1  0.189006  0.870775  0.330452  1
  Al  Al17  1  0.348081  0.188922  0.349898  1
  Al  Al18  1  0.505764  0.504300  0.369215  1
  Al  Al19  1  0.689006  0.870775  0.330452  1
  Al  Al20  1  0.848081  0.188922  0.349898  1
  Al  Al21  1  0.005764  0.504300  0.369215  1
  Al  Al22  1  0.848081  0.688922  0.349898  1
  Al  Al23  1  0.005764  0.004300  0.369215  1
  Al  Al24  1  0.689006  0.370775  0.330452  1
  Al  Al25  1  0.821459  0.635696  0.408627  1
  Al  Al26  1  0.979463  0.951709  0.428275  1
  Al  Al27  1  0.663715  0.320203  0.389143  1
  Al  Al28  1  0.663715  0.820203  0.389143  1
  Al  Al29  1  0.821459  0.135696  0.408627  1
  Al  Al30  1  0.979463  0.451709  0.428275  1
  Al  Al31  1  0.163715  0.820203  0.389143  1
  Al  Al32  1  0.321459  0.135696  0.408627  1
  Al  Al33  1  0.479463  0.451709  0.428275  1
  Al  Al34  1  0.321459  0.635696  0.408627  1
  Al  Al35  1  0.479463  0.951709  0.428275  1
  Al  Al36  1  0.163715  0.320203  0.389143  1
  Al  Al37  1  0.295176  0.583144  0.467570  1
  Al  Al38  1  0.453064  0.898925  0.487202  1
  Al  Al39  1  0.137281  0.267351  0.447947  1
  Al  Al40  1  0.137281  0.767351  0.447947  1
  Al  Al41  1  0.295176  0.083144  0.467570  1
  Al  Al42  1  0.453064  0.398925  0.487202  1
  Al  Al43  1  0.637281  0.767351  0.447947  1
  Al  Al44  1  0.795176  0.083144  0.467570  1
  Al  Al45  1  0.953064  0.398925  0.487202  1
  Al  Al46  1  0.795176  0.583144  0.467570  1
  Al  Al47  1  0.953064  0.898925  0.487202  1
  Al  Al48  1  0.637281  0.267351  0.447947  1
  Al  Al49  1  0.768824  0.530456  0.526490  1
  Al  Al50  1  0.926718  0.846249  0.546113  1
  Al  Al51  1  0.610936  0.214675  0.506858  1
  Al  Al52  1  0.610936  0.714675  0.506858  1
  Al  Al53  1  0.768824  0.030456  0.526490  1
  Al  Al54  1  0.926718  0.346249  0.546113  1
  Al  Al55  1  0.110936  0.714675  0.506858  1
  Al  Al56  1  0.268824  0.030456  0.526490  1
  Al  Al57  1  0.426718  0.346249  0.546113  1
  Al  Al58  1  0.268824  0.530456  0.526490  1
  Al  Al59  1  0.426718  0.846249  0.546113  1
  Al  Al60  1  0.110936  0.214675  0.506858  1
  Al  Al61  1  0.242541  0.477904  0.585433  1
  Al  Al62  1  0.400285  0.793397  0.604917  1
  Al  Al63  1  0.084536  0.161891  0.565785  1
  Al  Al64  1  0.084536  0.661891  0.565785  1
  Al  Al65  1  0.242541  0.977904  0.585433  1
  Al  Al66  1  0.400285  0.293397  0.604917  1
  Al  Al67  1  0.584536  0.661891  0.565785  1
  Al  Al68  1  0.742541  0.977904  0.585433  1
  Al  Al69  1  0.900285  0.293397  0.604917  1
  Al  Al70  1  0.742541  0.477904  0.585433  1
  Al  Al71  1  0.900285  0.793397  0.604917  1
  Al  Al72  1  0.584536  0.161891  0.565785  1
  Al  Al73  1  0.715918  0.424678  0.644162  1
  Al  Al74  1  0.874993  0.742825  0.663608  1
  Al  Al75  1  0.558236  0.109300  0.624845  1
  Al  Al76  1  0.558236  0.609300  0.624845  1
  Al  Al77  1  0.715918  0.924678  0.644162  1
  Al  Al78  1  0.874993  0.242825  0.663608  1
  Al  Al79  1  0.058236  0.609300  0.624845  1
  Al  Al80  1  0.215918  0.924678  0.644162  1
  Al  Al81  1  0.374993  0.242825  0.663608  1
  Al  Al82  1  0.215918  0.424678  0.644162  1
  Al  Al83  1  0.374993  0.742825  0.663608  1
  Al  Al84  1  0.058236  0.109300  0.624845  1
  Al  Al85  1  0.191026  0.374936  0.703837  1
  Al  Al86  1  0.346111  0.685071  0.721620  1
  Al  Al87  1  0.031757  0.056365  0.682964  1
  Al  Al88  1  0.031757  0.556365  0.682964  1
  Al  Al89  1  0.191026  0.874936  0.703837  1
  Al  Al90  1  0.346111  0.185071  0.721620  1
  Al  Al91  1  0.531757  0.556365  0.682964  1
  Al  Al92  1  0.691026  0.874936  0.703837  1
  Al  Al93  1  0.846111  0.185071  0.721620  1
  Al  Al94  1  0.691026  0.374936  0.703837  1
  Al  Al95  1  0.846111  0.685071  0.721620  1
  Al  Al96  1  0.531757  0.056365  0.682964  1
