# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.95677169
_cell_length_b   8.96019017
_cell_length_c   49.63204207
_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   3902.71189418
_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  0.815348  0.816102  0.278434  1
  Al  Al2  1  0.315348  0.316102  0.278434  1
  Al  Al3  1  0.231888  0.732763  0.307378  1
  Al  Al4  1  0.731888  0.232763  0.307378  1
  Al  Al5  1  0.981888  0.982763  0.307378  1
  Al  Al6  1  0.481888  0.482763  0.307378  1
  Al  Al7  1  0.565348  0.066102  0.278434  1
  Al  Al8  1  0.065348  0.566102  0.278434  1
  Al  Al9  1  0.691340  0.942158  0.325375  1
  Al  Al10  1  0.191340  0.442158  0.325375  1
  Al  Al11  1  0.272476  0.023309  0.292018  1
  Al  Al12  1  0.772476  0.523309  0.292018  1
  Al  Al13  1  0.941340  0.692158  0.325375  1
  Al  Al14  1  0.441340  0.192158  0.325375  1
  Al  Al15  1  0.522476  0.773309  0.292018  1
  Al  Al16  1  0.022476  0.273309  0.292018  1
  Al  Al17  1  0.652283  0.653128  0.340080  1
  Al  Al18  1  0.152283  0.153128  0.340080  1
  Al  Al19  1  0.068710  0.569551  0.373807  1
  Al  Al20  1  0.568710  0.069551  0.373807  1
  Al  Al21  1  0.818710  0.819551  0.373807  1
  Al  Al22  1  0.318710  0.319551  0.373807  1
  Al  Al23  1  0.402283  0.903128  0.340080  1
  Al  Al24  1  0.902283  0.403128  0.340080  1
  Al  Al25  1  0.526253  0.777107  0.390110  1
  Al  Al26  1  0.026253  0.277107  0.390110  1
  Al  Al27  1  0.110639  0.861496  0.356161  1
  Al  Al28  1  0.610639  0.361496  0.356161  1
  Al  Al29  1  0.776253  0.527107  0.390110  1
  Al  Al30  1  0.276253  0.027107  0.390110  1
  Al  Al31  1  0.360639  0.611496  0.356161  1
  Al  Al32  1  0.860639  0.111496  0.356161  1
  Al  Al33  1  0.484404  0.485265  0.406873  1
  Al  Al34  1  0.984404  0.985265  0.406873  1
  Al  Al35  1  0.900582  0.401446  0.440758  1
  Al  Al36  1  0.400582  0.901446  0.440758  1
  Al  Al37  1  0.650582  0.651446  0.440758  1
  Al  Al38  1  0.150582  0.151446  0.440758  1
  Al  Al39  1  0.234404  0.735265  0.406873  1
  Al  Al40  1  0.734404  0.235265  0.406873  1
  Al  Al41  1  0.358849  0.609719  0.457534  1
  Al  Al42  1  0.858849  0.109719  0.457534  1
  Al  Al43  1  0.942440  0.693297  0.424058  1
  Al  Al44  1  0.442440  0.193297  0.424058  1
  Al  Al45  1  0.608849  0.359719  0.457534  1
  Al  Al46  1  0.108849  0.859719  0.457534  1
  Al  Al47  1  0.192440  0.443297  0.424058  1
  Al  Al48  1  0.692440  0.943297  0.424058  1
  Al  Al49  1  0.317100  0.317971  0.474482  1
  Al  Al50  1  0.817100  0.817971  0.474482  1
  Al  Al51  1  0.733615  0.234495  0.508092  1
  Al  Al52  1  0.233615  0.734495  0.508092  1
  Al  Al53  1  0.483615  0.484495  0.508092  1
  Al  Al54  1  0.983615  0.984495  0.508092  1
  Al  Al55  1  0.067100  0.567971  0.474482  1
  Al  Al56  1  0.567100  0.067971  0.474482  1
  Al  Al57  1  0.191846  0.442730  0.524916  1
  Al  Al58  1  0.691846  0.942730  0.524916  1
  Al  Al59  1  0.775331  0.526206  0.491306  1
  Al  Al60  1  0.275331  0.026206  0.491306  1
  Al  Al61  1  0.441846  0.192730  0.524916  1
  Al  Al62  1  0.941846  0.692730  0.524916  1
  Al  Al63  1  0.025331  0.276206  0.491306  1
  Al  Al64  1  0.525331  0.776206  0.491306  1
  Al  Al65  1  0.150096  0.150982  0.541864  1
  Al  Al66  1  0.650096  0.650982  0.541864  1
  Al  Al67  1  0.566506  0.067404  0.575340  1
  Al  Al68  1  0.066506  0.567404  0.575340  1
  Al  Al69  1  0.316506  0.317404  0.575340  1
  Al  Al70  1  0.816506  0.817404  0.575340  1
  Al  Al71  1  0.900096  0.400982  0.541864  1
  Al  Al72  1  0.400096  0.900982  0.541864  1
  Al  Al73  1  0.024542  0.275436  0.592526  1
  Al  Al74  1  0.524542  0.775436  0.592526  1
  Al  Al75  1  0.608364  0.359255  0.558640  1
  Al  Al76  1  0.108364  0.859255  0.558640  1
  Al  Al77  1  0.274542  0.025436  0.592526  1
  Al  Al78  1  0.774542  0.525436  0.592526  1
  Al  Al79  1  0.858364  0.109255  0.558640  1
  Al  Al80  1  0.358364  0.609255  0.558640  1
  Al  Al81  1  0.982693  0.983594  0.609288  1
  Al  Al82  1  0.482693  0.483594  0.609288  1
  Al  Al83  1  0.398307  0.899206  0.643237  1
  Al  Al84  1  0.898307  0.399206  0.643237  1
  Al  Al85  1  0.148307  0.149206  0.643237  1
  Al  Al86  1  0.648307  0.649206  0.643237  1
  Al  Al87  1  0.732693  0.233594  0.609288  1
  Al  Al88  1  0.232693  0.733594  0.609288  1
  Al  Al89  1  0.856663  0.107574  0.659318  1
  Al  Al90  1  0.356663  0.607574  0.659318  1
  Al  Al91  1  0.440236  0.191151  0.625591  1
  Al  Al92  1  0.940236  0.691151  0.625591  1
  Al  Al93  1  0.106663  0.857574  0.659318  1
  Al  Al94  1  0.606663  0.357574  0.659318  1
  Al  Al95  1  0.690236  0.941151  0.625591  1
  Al  Al96  1  0.190236  0.441151  0.625591  1
  Al  Al97  1  0.817606  0.818543  0.674024  1
  Al  Al98  1  0.317606  0.318543  0.674024  1
  Al  Al99  1  0.236470  0.737393  0.707381  1
  Al  Al100  1  0.736470  0.237393  0.707381  1
  Al  Al101  1  0.986470  0.987393  0.707381  1
  Al  Al102  1  0.486470  0.487393  0.707381  1
  Al  Al103  1  0.567606  0.068543  0.674024  1
  Al  Al104  1  0.067606  0.568543  0.674024  1
  Al  Al105  1  0.693598  0.944600  0.720964  1
  Al  Al106  1  0.193598  0.444600  0.720964  1
  Al  Al107  1  0.277058  0.027938  0.692020  1
  Al  Al108  1  0.777058  0.527938  0.692020  1
  Al  Al109  1  0.943598  0.694600  0.720964  1
  Al  Al110  1  0.443598  0.194600  0.720964  1
  Al  Al111  1  0.527058  0.777938  0.692020  1
  Al  Al112  1  0.027058  0.277938  0.692020  1
