# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.99008777
_cell_length_b   8.98631397
_cell_length_c   49.61349432
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al112
_cell_volume   3927.18131162
_cell_formula_units_Z   112
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  0.025700  0.776605  0.291630  1
  Al  Al2  1  0.525700  0.276605  0.291630  1
  Al  Al3  1  0.440674  0.691602  0.324362  1
  Al  Al4  1  0.940674  0.191602  0.324362  1
  Al  Al5  1  0.775700  0.026605  0.291630  1
  Al  Al6  1  0.275700  0.526605  0.291630  1
  Al  Al7  1  0.190674  0.941602  0.324362  1
  Al  Al8  1  0.690674  0.441602  0.324362  1
  Al  Al9  1  0.065602  0.066569  0.276530  1
  Al  Al10  1  0.565602  0.566569  0.276530  1
  Al  Al11  1  0.482532  0.983439  0.306805  1
  Al  Al12  1  0.982532  0.483439  0.306805  1
  Al  Al13  1  0.732532  0.733439  0.306805  1
  Al  Al14  1  0.232532  0.233439  0.306805  1
  Al  Al15  1  0.315602  0.816569  0.276530  1
  Al  Al16  1  0.815602  0.316569  0.276530  1
  Al  Al17  1  0.857959  0.608866  0.356530  1
  Al  Al18  1  0.357959  0.108866  0.356530  1
  Al  Al19  1  0.273832  0.524732  0.390387  1
  Al  Al20  1  0.773832  0.024732  0.390387  1
  Al  Al21  1  0.607959  0.858866  0.356530  1
  Al  Al22  1  0.107959  0.358866  0.356530  1
  Al  Al23  1  0.023832  0.774732  0.390387  1
  Al  Al24  1  0.523832  0.274732  0.390387  1
  Al  Al25  1  0.899190  0.900097  0.340146  1
  Al  Al26  1  0.399190  0.400097  0.340146  1
  Al  Al27  1  0.316019  0.816929  0.373887  1
  Al  Al28  1  0.816019  0.316929  0.373887  1
  Al  Al29  1  0.566019  0.566929  0.373887  1
  Al  Al30  1  0.066019  0.066929  0.373887  1
  Al  Al31  1  0.149190  0.650097  0.340146  1
  Al  Al32  1  0.649190  0.150097  0.340146  1
  Al  Al33  1  0.690386  0.441277  0.423995  1
  Al  Al34  1  0.190386  0.941277  0.423995  1
  Al  Al35  1  0.106854  0.357737  0.457403  1
  Al  Al36  1  0.606854  0.857737  0.457403  1
  Al  Al37  1  0.440386  0.691277  0.423995  1
  Al  Al38  1  0.940386  0.191277  0.423995  1
  Al  Al39  1  0.856854  0.607737  0.457403  1
  Al  Al40  1  0.356854  0.107737  0.457403  1
  Al  Al41  1  0.732209  0.733106  0.407074  1
  Al  Al42  1  0.232209  0.233106  0.407074  1
  Al  Al43  1  0.148565  0.649452  0.440666  1
  Al  Al44  1  0.648565  0.149452  0.440666  1
  Al  Al45  1  0.398565  0.399452  0.440666  1
  Al  Al46  1  0.898565  0.899452  0.440666  1
  Al  Al47  1  0.982209  0.483106  0.407074  1
  Al  Al48  1  0.482209  0.983106  0.407074  1
  Al  Al49  1  0.523292  0.274163  0.490927  1
  Al  Al50  1  0.023292  0.774163  0.490927  1
  Al  Al51  1  0.939770  0.190632  0.524411  1
  Al  Al52  1  0.439770  0.690632  0.524411  1
  Al  Al53  1  0.273292  0.524163  0.490927  1
  Al  Al54  1  0.773292  0.024163  0.490927  1
  Al  Al55  1  0.689770  0.440632  0.524411  1
  Al  Al56  1  0.189770  0.940632  0.524411  1
  Al  Al57  1  0.565075  0.565951  0.474190  1
  Al  Al58  1  0.065075  0.065951  0.474190  1
  Al  Al59  1  0.981553  0.482421  0.507675  1
  Al  Al60  1  0.481553  0.982421  0.507675  1
  Al  Al61  1  0.231553  0.232421  0.507675  1
  Al  Al62  1  0.731553  0.732421  0.507675  1
  Al  Al63  1  0.815075  0.315951  0.474190  1
  Al  Al64  1  0.315075  0.815951  0.474190  1
  Al  Al65  1  0.356280  0.107132  0.557936  1
  Al  Al66  1  0.856280  0.607132  0.557936  1
  Al  Al67  1  0.772636  0.023478  0.591527  1
  Al  Al68  1  0.272636  0.523478  0.591527  1
  Al  Al69  1  0.106280  0.357132  0.557936  1
  Al  Al70  1  0.606280  0.857132  0.557936  1
  Al  Al71  1  0.522636  0.273478  0.591527  1
  Al  Al72  1  0.022636  0.773478  0.591527  1
  Al  Al73  1  0.397991  0.398847  0.541199  1
  Al  Al74  1  0.897991  0.898847  0.541199  1
  Al  Al75  1  0.814459  0.315307  0.574607  1
  Al  Al76  1  0.314459  0.815307  0.574607  1
  Al  Al77  1  0.064459  0.065307  0.574607  1
  Al  Al78  1  0.564459  0.565307  0.574607  1
  Al  Al79  1  0.647991  0.148847  0.541199  1
  Al  Al80  1  0.147991  0.648847  0.541199  1
  Al  Al81  1  0.188826  0.939654  0.624715  1
  Al  Al82  1  0.688826  0.439654  0.624715  1
  Al  Al83  1  0.605655  0.856487  0.658456  1
  Al  Al84  1  0.105655  0.356487  0.658456  1
  Al  Al85  1  0.938826  0.189654  0.624715  1
  Al  Al86  1  0.438826  0.689654  0.624715  1
  Al  Al87  1  0.355655  0.106487  0.658456  1
  Al  Al88  1  0.855655  0.606487  0.658456  1
  Al  Al89  1  0.231013  0.231851  0.608215  1
  Al  Al90  1  0.731013  0.731851  0.608215  1
  Al  Al91  1  0.646885  0.147717  0.642071  1
  Al  Al92  1  0.146885  0.647717  0.642071  1
  Al  Al93  1  0.896885  0.897717  0.642071  1
  Al  Al94  1  0.396885  0.397717  0.642071  1
  Al  Al95  1  0.481013  0.981851  0.608215  1
  Al  Al96  1  0.981013  0.481851  0.608215  1
  Al  Al97  1  0.022312  0.773144  0.691796  1
  Al  Al98  1  0.522312  0.273144  0.691796  1
  Al  Al99  1  0.439243  0.690015  0.722071  1
  Al  Al100  1  0.939243  0.190015  0.722071  1
  Al  Al101  1  0.772312  0.023144  0.691796  1
  Al  Al102  1  0.272312  0.523144  0.691796  1
  Al  Al103  1  0.189243  0.940015  0.722071  1
  Al  Al104  1  0.689243  0.440015  0.722071  1
  Al  Al105  1  0.064171  0.064981  0.674239  1
  Al  Al106  1  0.564171  0.564981  0.674239  1
  Al  Al107  1  0.479145  0.979979  0.706971  1
  Al  Al108  1  0.979145  0.479979  0.706971  1
  Al  Al109  1  0.729145  0.729979  0.706971  1
  Al  Al110  1  0.229145  0.229979  0.706971  1
  Al  Al111  1  0.314171  0.814981  0.674239  1
  Al  Al112  1  0.814171  0.314981  0.674239  1
