# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.98299917
_cell_length_b   12.64283962
_cell_length_c   49.98733807
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al72
_cell_volume   2517.18337338
_cell_formula_units_Z   72
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  0.505253  0.053512  0.341958  1
  Al  Al2  1  0.505253  0.754822  0.317543  1
  Al  Al3  1  0.505253  0.452956  0.291175  1
  Al  Al4  1  1.005253  0.304112  0.279533  1
  Al  Al5  1  1.005253  0.904167  0.329640  1
  Al  Al6  1  1.005253  0.602101  0.304677  1
  Al  Al7  1  1.005253  0.103597  0.302941  1
  Al  Al8  1  1.005253  0.803126  0.279057  1
  Al  Al9  1  1.005253  0.403835  0.330056  1
  Al  Al10  1  0.505253  0.252244  0.316945  1
  Al  Al11  1  0.505253  0.954553  0.290668  1
  Al  Al12  1  0.505253  0.651932  0.267513  1
  Al  Al13  1  0.505253  0.953778  0.419380  1
  Al  Al14  1  0.505253  0.653796  0.393836  1
  Al  Al15  1  0.505253  0.353058  0.367945  1
  Al  Al16  1  1.005253  0.202950  0.354968  1
  Al  Al17  1  1.005253  0.803844  0.406585  1
  Al  Al18  1  1.005253  0.503583  0.381093  1
  Al  Al19  1  1.005253  0.004046  0.380706  1
  Al  Al20  1  1.005253  0.703688  0.355308  1
  Al  Al21  1  1.005253  0.303297  0.406503  1
  Al  Al22  1  0.505253  0.153490  0.393575  1
  Al  Al23  1  0.505253  0.854364  0.368130  1
  Al  Al24  1  0.505253  0.553399  0.342638  1
  Al  Al25  1  0.505253  0.853462  0.496514  1
  Al  Al26  1  0.505253  0.553383  0.470822  1
  Al  Al27  1  0.505253  0.253348  0.445074  1
  Al  Al28  1  1.005253  0.103506  0.432203  1
  Al  Al29  1  1.005253  0.703462  0.483673  1
  Al  Al30  1  1.005253  0.403318  0.457957  1
  Al  Al31  1  1.005253  0.903572  0.457953  1
  Al  Al32  1  1.005253  0.603573  0.432340  1
  Al  Al33  1  1.005253  0.203327  0.483645  1
  Al  Al34  1  0.505253  0.053453  0.470795  1
  Al  Al35  1  0.505253  0.753635  0.445143  1
  Al  Al36  1  0.505253  0.453324  0.419444  1
  Al  Al37  1  0.505253  0.753386  0.573566  1
  Al  Al38  1  0.505253  0.453076  0.547868  1
  Al  Al39  1  0.505253  0.153258  0.522216  1
  Al  Al40  1  1.005253  0.003384  0.509366  1
  Al  Al41  1  1.005253  0.603137  0.560670  1
  Al  Al42  1  1.005253  0.303139  0.535058  1
  Al  Al43  1  1.005253  0.803392  0.535053  1
  Al  Al44  1  1.005253  0.503249  0.509337  1
  Al  Al45  1  1.005253  0.103204  0.560808  1
  Al  Al46  1  0.505253  0.953363  0.547936  1
  Al  Al47  1  0.505253  0.653327  0.522188  1
  Al  Al48  1  0.505253  0.353249  0.496497  1
  Al  Al49  1  0.505253  0.653312  0.650372  1
  Al  Al50  1  0.505253  0.352346  0.624880  1
  Al  Al51  1  0.505253  0.053221  0.599436  1
  Al  Al52  1  1.005253  0.903414  0.586507  1
  Al  Al53  1  1.005253  0.503023  0.637703  1
  Al  Al54  1  1.005253  0.202664  0.612304  1
  Al  Al55  1  1.005253  0.703127  0.611917  1
  Al  Al56  1  1.005253  0.402867  0.586425  1
  Al  Al57  1  1.005253  0.003761  0.638043  1
  Al  Al58  1  0.505253  0.853652  0.625066  1
  Al  Al59  1  0.505253  0.552914  0.599174  1
  Al  Al60  1  0.505253  0.252932  0.573630  1
  Al  Al61  1  0.505253  0.554779  0.725498  1
  Al  Al62  1  0.505253  0.252157  0.702342  1
  Al  Al63  1  0.505253  0.954467  0.676065  1
  Al  Al64  1  1.005253  0.802876  0.662955  1
  Al  Al65  1  1.005253  0.403585  0.713953  1
  Al  Al66  1  1.005253  0.103114  0.690069  1
  Al  Al67  1  1.005253  0.604610  0.688333  1
  Al  Al68  1  1.005253  0.302544  0.663370  1
  Al  Al69  1  1.005253  0.902599  0.713477  1
  Al  Al70  1  0.505253  0.753755  0.701835  1
  Al  Al71  1  0.505253  0.451888  0.675467  1
  Al  Al72  1  0.505253  0.153199  0.651052  1
