# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.66090129
_cell_length_b   4.61033488
_cell_length_c   47.58160983
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al22
_cell_volume   885.466512328
_cell_formula_units_Z   22
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  0.013036  0.046877  0.312618  1
  Al  Al2  1  0.364493  0.725253  0.299105  1
  Al  Al3  1  0.249787  0.653188  0.354125  1
  Al  Al4  1  0.648274  0.362601  0.329359  1
  Al  Al5  1  0.539352  0.291019  0.388935  1
  Al  Al6  1  0.889971  0.970189  0.370482  1
  Al  Al7  1  0.853637  0.939548  0.431321  1
  Al  Al8  1  0.193115  0.612272  0.412088  1
  Al  Al9  1  0.178458  0.597151  0.471931  1
  Al  Al10  1  0.515885  0.268198  0.450650  1
  Al  Al11  1  0.504094  0.255716  0.511819  1
  Al  Al12  1  0.841134  0.926279  0.492252  1
  Al  Al13  1  0.829342  0.913797  0.553421  1
  Al  Al14  1  0.166769  0.584844  0.532139  1
  Al  Al15  1  0.152113  0.569723  0.591982  1
  Al  Al16  1  0.491591  0.242447  0.572750  1
  Al  Al17  1  0.455257  0.211806  0.633589  1
  Al  Al18  1  0.805875  0.890976  0.615136  1
  Al  Al19  1  0.696953  0.819394  0.674712  1
  Al  Al20  1  0.095440  0.528807  0.649945  1
  Al  Al21  1  0.980734  0.456742  0.704966  1
  Al  Al22  1  0.332192  0.135118  0.691453  1
