# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.70843225
_cell_length_b   12.73534191
_cell_length_c   47.47168126
_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   3363.75127786
_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  0.872688  0.741291  0.292880  1
  Al  Al2  1  0.030895  0.057822  0.312333  1
  Al  Al3  1  0.714468  0.424917  0.275284  1
  Al  Al4  1  0.714468  0.924917  0.275284  1
  Al  Al5  1  0.872688  0.241291  0.292880  1
  Al  Al6  1  0.030895  0.557822  0.312333  1
  Al  Al7  1  0.214468  0.924917  0.275284  1
  Al  Al8  1  0.372688  0.241291  0.292880  1
  Al  Al9  1  0.530895  0.557822  0.312333  1
  Al  Al10  1  0.372688  0.741291  0.292880  1
  Al  Al11  1  0.530895  0.057822  0.312333  1
  Al  Al12  1  0.214468  0.424917  0.275284  1
  Al  Al13  1  0.346020  0.688214  0.351524  1
  Al  Al14  1  0.503830  0.003904  0.371210  1
  Al  Al15  1  0.188059  0.372219  0.332008  1
  Al  Al16  1  0.188059  0.872219  0.332008  1
  Al  Al17  1  0.346020  0.188214  0.351524  1
  Al  Al18  1  0.503830  0.503904  0.371210  1
  Al  Al19  1  0.688059  0.872219  0.332008  1
  Al  Al20  1  0.846020  0.188214  0.351524  1
  Al  Al21  1  0.003830  0.503904  0.371210  1
  Al  Al22  1  0.846020  0.688214  0.351524  1
  Al  Al23  1  0.003830  0.003904  0.371210  1
  Al  Al24  1  0.688059  0.372219  0.332008  1
  Al  Al25  1  0.819340  0.635070  0.410562  1
  Al  Al26  1  0.977143  0.950747  0.430237  1
  Al  Al27  1  0.661564  0.319446  0.390942  1
  Al  Al28  1  0.661564  0.819446  0.390942  1
  Al  Al29  1  0.819340  0.135070  0.410562  1
  Al  Al30  1  0.977143  0.450747  0.430237  1
  Al  Al31  1  0.161564  0.819446  0.390942  1
  Al  Al32  1  0.319340  0.135070  0.410562  1
  Al  Al33  1  0.477143  0.450747  0.430237  1
  Al  Al34  1  0.319340  0.635070  0.410562  1
  Al  Al35  1  0.477143  0.950747  0.430237  1
  Al  Al36  1  0.161564  0.319446  0.390942  1
  Al  Al37  1  0.292689  0.581983  0.469568  1
  Al  Al38  1  0.450467  0.897611  0.489232  1
  Al  Al39  1  0.134903  0.266339  0.449907  1
  Al  Al40  1  0.134903  0.766339  0.449907  1
  Al  Al41  1  0.292689  0.081983  0.469568  1
  Al  Al42  1  0.450467  0.397611  0.489232  1
  Al  Al43  1  0.634903  0.766339  0.449907  1
  Al  Al44  1  0.792689  0.081983  0.469568  1
  Al  Al45  1  0.950467  0.397611  0.489232  1
  Al  Al46  1  0.792689  0.581983  0.469568  1
  Al  Al47  1  0.950467  0.897611  0.489232  1
  Al  Al48  1  0.634903  0.266339  0.449907  1
  Al  Al49  1  0.766022  0.528866  0.528565  1
  Al  Al50  1  0.923808  0.844509  0.548226  1
  Al  Al51  1  0.608244  0.213238  0.508901  1
  Al  Al52  1  0.608244  0.713238  0.508901  1
  Al  Al53  1  0.766022  0.028866  0.528565  1
  Al  Al54  1  0.923808  0.344509  0.548226  1
  Al  Al55  1  0.108244  0.713238  0.508901  1
  Al  Al56  1  0.266022  0.028866  0.528565  1
  Al  Al57  1  0.423808  0.344509  0.548226  1
  Al  Al58  1  0.266022  0.528866  0.528565  1
  Al  Al59  1  0.423808  0.844509  0.548226  1
  Al  Al60  1  0.108244  0.213238  0.508901  1
  Al  Al61  1  0.239371  0.475779  0.587571  1
  Al  Al62  1  0.397147  0.791402  0.607192  1
  Al  Al63  1  0.081568  0.160101  0.567896  1
  Al  Al64  1  0.081568  0.660101  0.567896  1
  Al  Al65  1  0.239371  0.975779  0.587571  1
  Al  Al66  1  0.397147  0.291402  0.607192  1
  Al  Al67  1  0.581568  0.660101  0.567896  1
  Al  Al68  1  0.739371  0.975779  0.587571  1
  Al  Al69  1  0.897147  0.291402  0.607192  1
  Al  Al70  1  0.739371  0.475779  0.587571  1
  Al  Al71  1  0.897147  0.791402  0.607192  1
  Al  Al72  1  0.581568  0.160101  0.567896  1
  Al  Al73  1  0.712691  0.422635  0.646609  1
  Al  Al74  1  0.870652  0.738630  0.666125  1
  Al  Al75  1  0.554881  0.106945  0.626923  1
  Al  Al76  1  0.554881  0.606945  0.626923  1
  Al  Al77  1  0.712691  0.922635  0.646609  1
  Al  Al78  1  0.870652  0.238630  0.666125  1
  Al  Al79  1  0.054881  0.606945  0.626923  1
  Al  Al80  1  0.212691  0.922635  0.646609  1
  Al  Al81  1  0.370652  0.238630  0.666125  1
  Al  Al82  1  0.212691  0.422635  0.646609  1
  Al  Al83  1  0.370652  0.738630  0.666125  1
  Al  Al84  1  0.054881  0.106945  0.626923  1
  Al  Al85  1  0.186023  0.369558  0.705253  1
  Al  Al86  1  0.344243  0.685932  0.722849  1
  Al  Al87  1  0.027816  0.053026  0.685800  1
  Al  Al88  1  0.027816  0.553026  0.685800  1
  Al  Al89  1  0.186023  0.869558  0.705253  1
  Al  Al90  1  0.344243  0.185932  0.722849  1
  Al  Al91  1  0.527816  0.553026  0.685800  1
  Al  Al92  1  0.686023  0.869558  0.705253  1
  Al  Al93  1  0.844243  0.185932  0.722849  1
  Al  Al94  1  0.686023  0.369558  0.705253  1
  Al  Al95  1  0.844243  0.685932  0.722849  1
  Al  Al96  1  0.527816  0.053026  0.685800  1
