# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.99075415
_cell_length_b   8.99830274
_cell_length_c   49.85306427
_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   3951.70209409
_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  0.981543  0.981686  0.305667  1
  Al  Al2  1  0.481543  0.481686  0.305667  1
  Al  Al3  1  0.566667  0.066564  0.273440  1
  Al  Al4  1  0.066667  0.566564  0.273440  1
  Al  Al5  1  0.816667  0.816564  0.273440  1
  Al  Al6  1  0.316667  0.316564  0.273440  1
  Al  Al7  1  0.231543  0.731686  0.305667  1
  Al  Al8  1  0.731543  0.231686  0.305667  1
  Al  Al9  1  0.939713  0.689782  0.322930  1
  Al  Al10  1  0.439713  0.189782  0.322930  1
  Al  Al11  1  0.521218  0.771285  0.288575  1
  Al  Al12  1  0.021218  0.271285  0.288575  1
  Al  Al13  1  0.689713  0.939782  0.322930  1
  Al  Al14  1  0.189713  0.439782  0.322930  1
  Al  Al15  1  0.271218  0.021285  0.288575  1
  Al  Al16  1  0.771218  0.521285  0.288575  1
  Al  Al17  1  0.816207  0.816338  0.372431  1
  Al  Al18  1  0.316207  0.316338  0.372431  1
  Al  Al19  1  0.399397  0.899511  0.338908  1
  Al  Al20  1  0.899397  0.399511  0.338908  1
  Al  Al21  1  0.649397  0.649511  0.338908  1
  Al  Al22  1  0.149397  0.149511  0.338908  1
  Al  Al23  1  0.066207  0.566338  0.372431  1
  Al  Al24  1  0.566207  0.066338  0.372431  1
  Al  Al25  1  0.774220  0.524369  0.388945  1
  Al  Al26  1  0.274220  0.024369  0.388945  1
  Al  Al27  1  0.357924  0.608058  0.355459  1
  Al  Al28  1  0.857924  0.108058  0.355459  1
  Al  Al29  1  0.524220  0.774369  0.388945  1
  Al  Al30  1  0.024220  0.274369  0.388945  1
  Al  Al31  1  0.107924  0.858058  0.355459  1
  Al  Al32  1  0.607924  0.358058  0.355459  1
  Al  Al33  1  0.649048  0.649230  0.439044  1
  Al  Al34  1  0.149048  0.149230  0.439044  1
  Al  Al35  1  0.232615  0.732776  0.405607  1
  Al  Al36  1  0.732615  0.232776  0.405607  1
  Al  Al37  1  0.482615  0.482776  0.405607  1
  Al  Al38  1  0.982615  0.982776  0.405607  1
  Al  Al39  1  0.899048  0.399230  0.439044  1
  Al  Al40  1  0.399048  0.899230  0.439044  1
  Al  Al41  1  0.607349  0.357542  0.455731  1
  Al  Al42  1  0.107349  0.857542  0.455731  1
  Al  Al43  1  0.190828  0.440997  0.422395  1
  Al  Al44  1  0.690828  0.940997  0.422395  1
  Al  Al45  1  0.357349  0.607542  0.455731  1
  Al  Al46  1  0.857349  0.107542  0.455731  1
  Al  Al47  1  0.940828  0.690997  0.422395  1
  Al  Al48  1  0.440828  0.190997  0.422395  1
  Al  Al49  1  0.482132  0.482357  0.505829  1
  Al  Al50  1  0.982132  0.982357  0.505829  1
  Al  Al51  1  0.065601  0.565805  0.472449  1
  Al  Al52  1  0.565601  0.065805  0.472449  1
  Al  Al53  1  0.315601  0.315805  0.472449  1
  Al  Al54  1  0.815601  0.815805  0.472449  1
  Al  Al55  1  0.732132  0.232357  0.505829  1
  Al  Al56  1  0.232132  0.732357  0.505829  1
  Al  Al57  1  0.440379  0.190616  0.522518  1
  Al  Al58  1  0.940379  0.690616  0.522518  1
  Al  Al59  1  0.023848  0.274063  0.489138  1
  Al  Al60  1  0.523848  0.774063  0.489138  1
  Al  Al61  1  0.190379  0.440616  0.522518  1
  Al  Al62  1  0.690379  0.940616  0.522518  1
  Al  Al63  1  0.773848  0.524063  0.489138  1
  Al  Al64  1  0.273848  0.024063  0.489138  1
  Al  Al65  1  0.315152  0.315423  0.572572  1
  Al  Al66  1  0.815152  0.815423  0.572572  1
  Al  Al67  1  0.898631  0.398878  0.539236  1
  Al  Al68  1  0.398631  0.898878  0.539236  1
  Al  Al69  1  0.148631  0.148878  0.539236  1
  Al  Al70  1  0.648631  0.648878  0.539236  1
  Al  Al71  1  0.565152  0.065423  0.572572  1
  Al  Al72  1  0.065152  0.565423  0.572572  1
  Al  Al73  1  0.273366  0.023644  0.589361  1
  Al  Al74  1  0.773366  0.523644  0.589361  1
  Al  Al75  1  0.856932  0.107191  0.555923  1
  Al  Al76  1  0.356932  0.607191  0.555923  1
  Al  Al77  1  0.023366  0.273644  0.589361  1
  Al  Al78  1  0.523366  0.773644  0.589361  1
  Al  Al79  1  0.606932  0.357191  0.555923  1
  Al  Al80  1  0.106932  0.857191  0.555923  1
  Al  Al81  1  0.148057  0.148362  0.639508  1
  Al  Al82  1  0.648057  0.648362  0.639508  1
  Al  Al83  1  0.731760  0.232051  0.606023  1
  Al  Al84  1  0.231760  0.732051  0.606023  1
  Al  Al85  1  0.981760  0.982051  0.606023  1
  Al  Al86  1  0.481760  0.482051  0.606023  1
  Al  Al87  1  0.398057  0.898362  0.639508  1
  Al  Al88  1  0.898057  0.398362  0.639508  1
  Al  Al89  1  0.106584  0.856910  0.656059  1
  Al  Al90  1  0.606584  0.356910  0.656059  1
  Al  Al91  1  0.689773  0.940082  0.622536  1
  Al  Al92  1  0.189773  0.440082  0.622536  1
  Al  Al93  1  0.856584  0.106910  0.656059  1
  Al  Al94  1  0.356584  0.606910  0.656059  1
  Al  Al95  1  0.439773  0.190082  0.622536  1
  Al  Al96  1  0.939773  0.690082  0.622536  1
  Al  Al97  1  0.984762  0.985135  0.706393  1
  Al  Al98  1  0.484762  0.485135  0.706393  1
  Al  Al99  1  0.566268  0.066639  0.672037  1
  Al  Al100  1  0.066268  0.566639  0.672037  1
  Al  Al101  1  0.816268  0.816639  0.672037  1
  Al  Al102  1  0.316268  0.316639  0.672037  1
  Al  Al103  1  0.234762  0.735135  0.706393  1
  Al  Al104  1  0.734762  0.235135  0.706393  1
  Al  Al105  1  0.939313  0.689856  0.721527  1
  Al  Al106  1  0.439313  0.189856  0.721527  1
  Al  Al107  1  0.524437  0.774734  0.689300  1
  Al  Al108  1  0.024437  0.274734  0.689300  1
  Al  Al109  1  0.689313  0.939856  0.721527  1
  Al  Al110  1  0.189313  0.439856  0.721527  1
  Al  Al111  1  0.274437  0.024734  0.689300  1
  Al  Al112  1  0.774437  0.524734  0.689300  1
