# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.81667978
_cell_length_b   6.59459021
_cell_length_c   50.52046904
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.43494882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al40
_cell_volume   1522.38402222
_cell_formula_units_Z   40
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  0.894484  0.743388  0.275840  1
  Al  Al2  1  0.043085  0.169755  0.296400  1
  Al  Al3  1  0.306292  0.526002  0.268286  1
  Al  Al4  1  0.474595  0.967414  0.284608  1
  Al  Al5  1  0.192642  0.606183  0.319397  1
  Al  Al6  1  0.341245  1.031422  0.339692  1
  Al  Al7  1  0.625925  0.387084  0.306791  1
  Al  Al8  1  0.764108  0.816303  0.329248  1
  Al  Al9  1  0.491870  0.458091  0.361662  1
  Al  Al10  1  0.638472  0.888319  0.383960  1
  Al  Al11  1  0.916535  0.243927  0.350935  1
  Al  Al12  1  0.064338  0.674362  0.373154  1
  Al  Al13  1  0.787854  0.316822  0.405918  1
  Al  Al14  1  0.936670  0.745859  0.427942  1
  Al  Al15  1  0.213545  0.102887  0.394841  1
  Al  Al16  1  0.362646  0.531139  0.416817  1
  Al  Al17  1  0.085575  0.174475  0.449851  1
  Al  Al18  1  0.234411  0.603023  0.471814  1
  Al  Al19  1  0.511017  0.960048  0.438898  1
  Al  Al20  1  0.659949  0.388755  0.460858  1
  Al  Al21  1  0.383157  1.031843  0.493823  1
  Al  Al22  1  0.532089  0.460550  0.515783  1
  Al  Al23  1  0.808695  0.817575  0.482867  1
  Al  Al24  1  0.957531  0.246123  0.504830  1
  Al  Al25  1  0.680460  0.889459  0.537864  1
  Al  Al26  1  0.829561  0.317711  0.559840  1
  Al  Al27  1  0.106436  0.674739  0.526739  1
  Al  Al28  1  0.255252  0.103776  0.548763  1
  Al  Al29  1  0.978767  0.746236  0.581527  1
  Al  Al30  1  0.126571  0.176671  0.603746  1
  Al  Al31  1  0.404634  0.532279  0.570721  1
  Al  Al32  1  0.551236  0.962507  0.593019  1
  Al  Al33  1  0.278998  0.604295  0.625433  1
  Al  Al34  1  0.417181  1.033514  0.647890  1
  Al  Al35  1  0.701861  0.389176  0.614989  1
  Al  Al36  1  0.850464  0.814415  0.635284  1
  Al  Al37  1  0.568511  0.453184  0.670073  1
  Al  Al38  1  0.736814  0.894596  0.686395  1
  Al  Al39  1  1.000021  0.250843  0.658281  1
  Al  Al40  1  0.148622  0.677210  0.678840  1
