# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.99026606
_cell_length_b   8.99705999
_cell_length_c   49.85919244
_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   3951.42749413
_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  0.771237  0.021375  0.288519  1
  Al  Al2  1  0.271237  0.521375  0.288519  1
  Al  Al3  1  0.189728  0.939868  0.322873  1
  Al  Al4  1  0.689728  0.439868  0.322873  1
  Al  Al5  1  0.021237  0.771375  0.288519  1
  Al  Al6  1  0.521237  0.271375  0.288519  1
  Al  Al7  1  0.439728  0.689868  0.322873  1
  Al  Al8  1  0.939728  0.189868  0.322873  1
  Al  Al9  1  0.731565  0.731773  0.305614  1
  Al  Al10  1  0.231565  0.231773  0.305614  1
  Al  Al11  1  0.316690  0.816675  0.273385  1
  Al  Al12  1  0.816690  0.316675  0.273385  1
  Al  Al13  1  0.066690  0.066675  0.273385  1
  Al  Al14  1  0.566690  0.566675  0.273385  1
  Al  Al15  1  0.481565  0.981773  0.305614  1
  Al  Al16  1  0.981565  0.481773  0.305614  1
  Al  Al17  1  0.607941  0.858140  0.355403  1
  Al  Al18  1  0.107941  0.358140  0.355403  1
  Al  Al19  1  0.024237  0.774449  0.388887  1
  Al  Al20  1  0.524237  0.274449  0.388887  1
  Al  Al21  1  0.857941  0.608140  0.355403  1
  Al  Al22  1  0.357941  0.108140  0.355403  1
  Al  Al23  1  0.274237  0.524449  0.388887  1
  Al  Al24  1  0.774237  0.024449  0.388887  1
  Al  Al25  1  0.566223  0.566419  0.372373  1
  Al  Al26  1  0.066223  0.066419  0.372373  1
  Al  Al27  1  0.149414  0.649595  0.338851  1
  Al  Al28  1  0.649414  0.149595  0.338851  1
  Al  Al29  1  0.899414  0.899595  0.338851  1
  Al  Al30  1  0.399414  0.399595  0.338851  1
  Al  Al31  1  0.316223  0.816419  0.372373  1
  Al  Al32  1  0.816223  0.316419  0.372373  1
  Al  Al33  1  0.440843  0.691074  0.422336  1
  Al  Al34  1  0.940843  0.191074  0.422336  1
  Al  Al35  1  0.857364  0.607616  0.455671  1
  Al  Al36  1  0.357364  0.107616  0.455671  1
  Al  Al37  1  0.690843  0.441074  0.422336  1
  Al  Al38  1  0.190843  0.941074  0.422336  1
  Al  Al39  1  0.107364  0.357616  0.455671  1
  Al  Al40  1  0.607364  0.857616  0.455671  1
  Al  Al41  1  0.399063  0.399305  0.438985  1
  Al  Al42  1  0.899063  0.899305  0.438985  1
  Al  Al43  1  0.982630  0.482854  0.405548  1
  Al  Al44  1  0.482630  0.982854  0.405548  1
  Al  Al45  1  0.732630  0.732854  0.405548  1
  Al  Al46  1  0.232630  0.232854  0.405548  1
  Al  Al47  1  0.149063  0.649305  0.438985  1
  Al  Al48  1  0.649063  0.149305  0.438985  1
  Al  Al49  1  0.273863  0.524134  0.489078  1
  Al  Al50  1  0.773863  0.024134  0.489078  1
  Al  Al51  1  0.690392  0.440684  0.522457  1
  Al  Al52  1  0.190392  0.940684  0.522457  1
  Al  Al53  1  0.523863  0.274134  0.489078  1
  Al  Al54  1  0.023863  0.774134  0.489078  1
  Al  Al55  1  0.940392  0.190684  0.522457  1
  Al  Al56  1  0.440392  0.690684  0.522457  1
  Al  Al57  1  0.232146  0.232427  0.505769  1
  Al  Al58  1  0.732146  0.732427  0.505769  1
  Al  Al59  1  0.815616  0.315877  0.472389  1
  Al  Al60  1  0.315616  0.815877  0.472389  1
  Al  Al61  1  0.565616  0.565877  0.472389  1
  Al  Al62  1  0.065616  0.065877  0.472389  1
  Al  Al63  1  0.982146  0.482427  0.505769  1
  Al  Al64  1  0.482146  0.982427  0.505769  1
  Al  Al65  1  0.106945  0.357256  0.555861  1
  Al  Al66  1  0.606945  0.857256  0.555861  1
  Al  Al67  1  0.523378  0.273707  0.589298  1
  Al  Al68  1  0.023378  0.773707  0.589298  1
  Al  Al69  1  0.356945  0.107256  0.555861  1
  Al  Al70  1  0.856945  0.607256  0.555861  1
  Al  Al71  1  0.773378  0.023707  0.589298  1
  Al  Al72  1  0.273378  0.523707  0.589298  1
  Al  Al73  1  0.065165  0.065487  0.572510  1
  Al  Al74  1  0.565165  0.565487  0.572510  1
  Al  Al75  1  0.648644  0.148945  0.539175  1
  Al  Al76  1  0.148644  0.648945  0.539175  1
  Al  Al77  1  0.398644  0.398945  0.539175  1
  Al  Al78  1  0.898644  0.898945  0.539175  1
  Al  Al79  1  0.815165  0.315487  0.572510  1
  Al  Al80  1  0.315165  0.815487  0.572510  1
  Al  Al81  1  0.939786  0.190142  0.622473  1
  Al  Al82  1  0.439786  0.690142  0.622473  1
  Al  Al83  1  0.356594  0.106966  0.655995  1
  Al  Al84  1  0.856594  0.606966  0.655995  1
  Al  Al85  1  0.189786  0.940142  0.622473  1
  Al  Al86  1  0.689786  0.440142  0.622473  1
  Al  Al87  1  0.606594  0.856966  0.655995  1
  Al  Al88  1  0.106594  0.356966  0.655995  1
  Al  Al89  1  0.898067  0.898421  0.639443  1
  Al  Al90  1  0.398067  0.398421  0.639443  1
  Al  Al91  1  0.481771  0.982112  0.605959  1
  Al  Al92  1  0.981771  0.482112  0.605959  1
  Al  Al93  1  0.231771  0.232112  0.605959  1
  Al  Al94  1  0.731771  0.732112  0.605959  1
  Al  Al95  1  0.648067  0.148421  0.639443  1
  Al  Al96  1  0.148067  0.648421  0.639443  1
  Al  Al97  1  0.774443  0.024788  0.689232  1
  Al  Al98  1  0.274443  0.524788  0.689232  1
  Al  Al99  1  0.189318  0.939885  0.721461  1
  Al  Al100  1  0.689318  0.439885  0.721461  1
  Al  Al101  1  0.024443  0.774788  0.689232  1
  Al  Al102  1  0.524443  0.274788  0.689232  1
  Al  Al103  1  0.439318  0.689885  0.721461  1
  Al  Al104  1  0.939318  0.189885  0.721461  1
  Al  Al105  1  0.734771  0.735185  0.706327  1
  Al  Al106  1  0.234771  0.235185  0.706327  1
  Al  Al107  1  0.316280  0.816693  0.671973  1
  Al  Al108  1  0.816280  0.316693  0.671973  1
  Al  Al109  1  0.066280  0.066693  0.671973  1
  Al  Al110  1  0.566280  0.566693  0.671973  1
  Al  Al111  1  0.484771  0.985185  0.706327  1
  Al  Al112  1  0.984771  0.485185  0.706327  1
