# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.72797193
_cell_length_b   12.78677691
_cell_length_c   47.99324320
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al96
_cell_volume   3426.13025906
_cell_formula_units_Z   96
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  0.718699  0.929492  0.274813  1
  Al  Al2  1  0.874159  0.240403  0.290509  1
  Al  Al3  1  0.033804  0.559731  0.311020  1
  Al  Al4  1  0.874159  0.740403  0.290509  1
  Al  Al5  1  0.033804  0.059731  0.311020  1
  Al  Al6  1  0.718699  0.429492  0.274813  1
  Al  Al7  1  0.374159  0.740403  0.290509  1
  Al  Al8  1  0.533804  0.059731  0.311020  1
  Al  Al9  1  0.218699  0.429492  0.274813  1
  Al  Al10  1  0.218699  0.929492  0.274813  1
  Al  Al11  1  0.374159  0.240403  0.290509  1
  Al  Al12  1  0.533804  0.559731  0.311020  1
  Al  Al13  1  0.190244  0.872636  0.330584  1
  Al  Al14  1  0.349164  0.190473  0.349903  1
  Al  Al15  1  0.506772  0.505714  0.369317  1
  Al  Al16  1  0.349164  0.690473  0.349903  1
  Al  Al17  1  0.506772  0.005714  0.369317  1
  Al  Al18  1  0.190244  0.372636  0.330584  1
  Al  Al19  1  0.849164  0.690473  0.349903  1
  Al  Al20  1  0.006772  0.005714  0.369317  1
  Al  Al21  1  0.690244  0.372636  0.330584  1
  Al  Al22  1  0.690244  0.872636  0.330584  1
  Al  Al23  1  0.849164  0.190473  0.349903  1
  Al  Al24  1  0.006772  0.505714  0.369317  1
  Al  Al25  1  0.664591  0.821363  0.389313  1
  Al  Al26  1  0.822274  0.136746  0.408878  1
  Al  Al27  1  0.980211  0.452634  0.428596  1
  Al  Al28  1  0.822274  0.636746  0.408878  1
  Al  Al29  1  0.980211  0.952634  0.428596  1
  Al  Al30  1  0.664591  0.321363  0.389313  1
  Al  Al31  1  0.322274  0.636746  0.408878  1
  Al  Al32  1  0.480211  0.952634  0.428596  1
  Al  Al33  1  0.164591  0.321363  0.389313  1
  Al  Al34  1  0.164591  0.821363  0.389313  1
  Al  Al35  1  0.322274  0.136746  0.408878  1
  Al  Al36  1  0.480211  0.452634  0.428596  1
  Al  Al37  1  0.137970  0.768166  0.448307  1
  Al  Al38  1  0.295814  0.083869  0.467995  1
  Al  Al39  1  0.453629  0.399515  0.487676  1
  Al  Al40  1  0.295814  0.583869  0.467995  1
  Al  Al41  1  0.453629  0.899515  0.487676  1
  Al  Al42  1  0.137970  0.268166  0.448307  1
  Al  Al43  1  0.795814  0.583869  0.467995  1
  Al  Al44  1  0.953629  0.899515  0.487676  1
  Al  Al45  1  0.637970  0.268166  0.448307  1
  Al  Al46  1  0.637970  0.768166  0.448307  1
  Al  Al47  1  0.795814  0.083869  0.467995  1
  Al  Al48  1  0.953629  0.399515  0.487676  1
  Al  Al49  1  0.611453  0.715176  0.507385  1
  Al  Al50  1  0.769268  0.030822  0.527066  1
  Al  Al51  1  0.927112  0.346525  0.546754  1
  Al  Al52  1  0.769268  0.530822  0.527066  1
  Al  Al53  1  0.927112  0.846525  0.546754  1
  Al  Al54  1  0.611453  0.215176  0.507385  1
  Al  Al55  1  0.269268  0.530822  0.527066  1
  Al  Al56  1  0.427112  0.846525  0.546754  1
  Al  Al57  1  0.111453  0.215176  0.507385  1
  Al  Al58  1  0.111453  0.715176  0.507385  1
  Al  Al59  1  0.269268  0.030822  0.527066  1
  Al  Al60  1  0.427112  0.346525  0.546754  1
  Al  Al61  1  0.084870  0.662057  0.566465  1
  Al  Al62  1  0.242808  0.977945  0.586183  1
  Al  Al63  1  0.400491  0.293328  0.605747  1
  Al  Al64  1  0.242808  0.477945  0.586183  1
  Al  Al65  1  0.400491  0.793328  0.605747  1
  Al  Al66  1  0.084870  0.162057  0.566465  1
  Al  Al67  1  0.742808  0.477945  0.586183  1
  Al  Al68  1  0.900491  0.793328  0.605747  1
  Al  Al69  1  0.584870  0.162057  0.566465  1
  Al  Al70  1  0.584870  0.662057  0.566465  1
  Al  Al71  1  0.742808  0.977945  0.586183  1
  Al  Al72  1  0.900491  0.293328  0.605747  1
  Al  Al73  1  0.558310  0.608977  0.625744  1
  Al  Al74  1  0.715918  0.924218  0.645158  1
  Al  Al75  1  0.874838  0.242055  0.664477  1
  Al  Al76  1  0.715918  0.424218  0.645158  1
  Al  Al77  1  0.874838  0.742055  0.664477  1
  Al  Al78  1  0.558310  0.108977  0.625744  1
  Al  Al79  1  0.215918  0.424218  0.645158  1
  Al  Al80  1  0.374838  0.742055  0.664477  1
  Al  Al81  1  0.058310  0.108977  0.625744  1
  Al  Al82  1  0.058310  0.608977  0.625744  1
  Al  Al83  1  0.215918  0.924218  0.645158  1
  Al  Al84  1  0.374838  0.242055  0.664477  1
  Al  Al85  1  0.031278  0.554960  0.684041  1
  Al  Al86  1  0.190923  0.874287  0.704552  1
  Al  Al87  1  0.346383  0.185198  0.720248  1
  Al  Al88  1  0.190923  0.374287  0.704552  1
  Al  Al89  1  0.346383  0.685198  0.720248  1
  Al  Al90  1  0.031278  0.054960  0.684041  1
  Al  Al91  1  0.690923  0.374287  0.704552  1
  Al  Al92  1  0.846383  0.685198  0.720248  1
  Al  Al93  1  0.531278  0.054960  0.684041  1
  Al  Al94  1  0.531278  0.554960  0.684041  1
  Al  Al95  1  0.690923  0.874287  0.704552  1
  Al  Al96  1  0.846383  0.185198  0.720248  1
