# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.82127015
_cell_length_b   6.56224187
_cell_length_c   50.73680820
_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   1522.8534021
_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  0.926314  0.752937  0.279685  1
  Al  Al2  1  0.072199  0.177845  0.299648  1
  Al  Al3  1  0.338968  0.534561  0.272081  1
  Al  Al4  1  0.506914  0.981304  0.287506  1
  Al  Al5  1  0.218596  0.616443  0.322745  1
  Al  Al6  1  0.364683  1.039162  0.342316  1
  Al  Al7  1  0.654824  0.395689  0.310244  1
  Al  Al8  1  0.787622  0.825343  0.332327  1
  Al  Al9  1  0.513172  0.464783  0.364093  1
  Al  Al10  1  0.655769  0.896044  0.386266  1
  Al  Al11  1  0.939880  0.251192  0.353500  1
  Al  Al12  1  0.082649  0.682468  0.375689  1
  Al  Al13  1  0.802929  0.323844  0.407787  1
  Al  Al14  1  0.947994  0.753202  0.429731  1
  Al  Al15  1  0.229954  0.110156  0.396837  1
  Al  Al16  1  0.376046  0.538089  0.418535  1
  Al  Al17  1  0.094485  0.181313  0.451231  1
  Al  Al18  1  0.240660  0.609302  0.472877  1
  Al  Al19  1  0.521097  0.967181  0.440503  1
  Al  Al20  1  0.667559  0.395273  0.462075  1
  Al  Al21  1  0.386160  1.038146  0.494749  1
  Al  Al22  1  0.532622  0.466239  0.516321  1
  Al  Al23  1  0.813059  0.824118  0.483948  1
  Al  Al24  1  0.959235  0.252107  0.505593  1
  Al  Al25  1  0.677674  0.895331  0.538289  1
  Al  Al26  1  0.823766  0.323263  0.559987  1
  Al  Al27  1  0.105725  0.680217  0.527093  1
  Al  Al28  1  0.250791  0.109575  0.549037  1
  Al  Al29  1  0.971070  0.750952  0.581135  1
  Al  Al30  1  0.113840  0.182228  0.603324  1
  Al  Al31  1  0.397951  0.537375  0.570559  1
  Al  Al32  1  0.540547  0.968637  0.592732  1
  Al  Al33  1  0.266098  0.608076  0.624497  1
  Al  Al34  1  0.398896  1.037730  0.646581  1
  Al  Al35  1  0.689036  0.394257  0.614509  1
  Al  Al36  1  0.835124  0.816977  0.634079  1
  Al  Al37  1  0.546805  0.452116  0.669318  1
  Al  Al38  1  0.714752  0.898859  0.684743  1
  Al  Al39  1  0.981520  0.255575  0.657176  1
  Al  Al40  1  0.127406  0.680483  0.677139  1
