# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68663109
_cell_length_b   12.70149700
_cell_length_c   47.66919609
_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   3355.90451479
_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  0.717882  0.928521  0.272441  1
  Al  Al2  1  0.872968  0.238658  0.290224  1
  Al  Al3  1  0.032237  0.557228  0.311096  1
  Al  Al4  1  0.872968  0.738658  0.290224  1
  Al  Al5  1  0.032237  0.057228  0.311096  1
  Al  Al6  1  0.717882  0.428521  0.272441  1
  Al  Al7  1  0.372968  0.738658  0.290224  1
  Al  Al8  1  0.532237  0.057228  0.311096  1
  Al  Al9  1  0.217882  0.428521  0.272441  1
  Al  Al10  1  0.217882  0.928521  0.272441  1
  Al  Al11  1  0.372968  0.238658  0.290224  1
  Al  Al12  1  0.532237  0.557228  0.311096  1
  Al  Al13  1  0.189001  0.870769  0.330452  1
  Al  Al14  1  0.348076  0.188916  0.349898  1
  Al  Al15  1  0.505758  0.504294  0.369215  1
  Al  Al16  1  0.348076  0.688916  0.349898  1
  Al  Al17  1  0.505758  0.004294  0.369215  1
  Al  Al18  1  0.189001  0.370769  0.330452  1
  Al  Al19  1  0.848076  0.688916  0.349898  1
  Al  Al20  1  0.005758  0.004294  0.369215  1
  Al  Al21  1  0.689001  0.370769  0.330452  1
  Al  Al22  1  0.689001  0.870769  0.330452  1
  Al  Al23  1  0.848076  0.188916  0.349898  1
  Al  Al24  1  0.005758  0.504294  0.369215  1
  Al  Al25  1  0.663709  0.820197  0.389143  1
  Al  Al26  1  0.821453  0.135690  0.408626  1
  Al  Al27  1  0.979458  0.451703  0.428274  1
  Al  Al28  1  0.821453  0.635690  0.408626  1
  Al  Al29  1  0.979458  0.951703  0.428274  1
  Al  Al30  1  0.663709  0.320197  0.389143  1
  Al  Al31  1  0.321453  0.635690  0.408626  1
  Al  Al32  1  0.479458  0.951703  0.428274  1
  Al  Al33  1  0.163709  0.320197  0.389143  1
  Al  Al34  1  0.163709  0.820197  0.389143  1
  Al  Al35  1  0.321453  0.135690  0.408626  1
  Al  Al36  1  0.479458  0.451703  0.428274  1
  Al  Al37  1  0.137276  0.767345  0.447945  1
  Al  Al38  1  0.295170  0.083138  0.467569  1
  Al  Al39  1  0.453058  0.398920  0.487201  1
  Al  Al40  1  0.295170  0.583138  0.467569  1
  Al  Al41  1  0.453058  0.898920  0.487201  1
  Al  Al42  1  0.137276  0.267345  0.447945  1
  Al  Al43  1  0.795170  0.583138  0.467569  1
  Al  Al44  1  0.953058  0.898920  0.487201  1
  Al  Al45  1  0.637276  0.267345  0.447945  1
  Al  Al46  1  0.637276  0.767345  0.447945  1
  Al  Al47  1  0.795170  0.083138  0.467569  1
  Al  Al48  1  0.953058  0.398920  0.487201  1
  Al  Al49  1  0.610931  0.714669  0.506856  1
  Al  Al50  1  0.768819  0.030450  0.526488  1
  Al  Al51  1  0.926713  0.346243  0.546111  1
  Al  Al52  1  0.768819  0.530450  0.526488  1
  Al  Al53  1  0.926713  0.846243  0.546111  1
  Al  Al54  1  0.610931  0.214669  0.506856  1
  Al  Al55  1  0.268819  0.530450  0.526488  1
  Al  Al56  1  0.426713  0.846243  0.546111  1
  Al  Al57  1  0.110931  0.214669  0.506856  1
  Al  Al58  1  0.110931  0.714669  0.506856  1
  Al  Al59  1  0.268819  0.030450  0.526488  1
  Al  Al60  1  0.426713  0.346243  0.546111  1
  Al  Al61  1  0.084531  0.661885  0.565782  1
  Al  Al62  1  0.242536  0.977898  0.585430  1
  Al  Al63  1  0.400279  0.293392  0.604914  1
  Al  Al64  1  0.242536  0.477898  0.585430  1
  Al  Al65  1  0.400279  0.793392  0.604914  1
  Al  Al66  1  0.084531  0.161885  0.565782  1
  Al  Al67  1  0.742536  0.477898  0.585430  1
  Al  Al68  1  0.900279  0.793392  0.604914  1
  Al  Al69  1  0.584531  0.161885  0.565782  1
  Al  Al70  1  0.584531  0.661885  0.565782  1
  Al  Al71  1  0.742536  0.977898  0.585430  1
  Al  Al72  1  0.900279  0.293392  0.604914  1
  Al  Al73  1  0.558231  0.609295  0.624841  1
  Al  Al74  1  0.715913  0.924672  0.644159  1
  Al  Al75  1  0.874988  0.242819  0.663604  1
  Al  Al76  1  0.715913  0.424672  0.644159  1
  Al  Al77  1  0.874988  0.742819  0.663604  1
  Al  Al78  1  0.558231  0.109295  0.624841  1
  Al  Al79  1  0.215913  0.424672  0.644159  1
  Al  Al80  1  0.374988  0.742819  0.663604  1
  Al  Al81  1  0.058231  0.109295  0.624841  1
  Al  Al82  1  0.058231  0.609295  0.624841  1
  Al  Al83  1  0.215913  0.924672  0.644159  1
  Al  Al84  1  0.374988  0.242819  0.663604  1
  Al  Al85  1  0.031752  0.556360  0.682960  1
  Al  Al86  1  0.191021  0.874930  0.703832  1
  Al  Al87  1  0.346107  0.185068  0.721615  1
  Al  Al88  1  0.191021  0.374930  0.703832  1
  Al  Al89  1  0.346107  0.685068  0.721615  1
  Al  Al90  1  0.031752  0.056360  0.682960  1
  Al  Al91  1  0.691021  0.374930  0.703832  1
  Al  Al92  1  0.846107  0.685068  0.721615  1
  Al  Al93  1  0.531752  0.056360  0.682960  1
  Al  Al94  1  0.531752  0.556360  0.682960  1
  Al  Al95  1  0.691021  0.874930  0.703832  1
  Al  Al96  1  0.846107  0.185068  0.721615  1
