# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.66150056
_cell_length_b   5.66150056
_cell_length_c   46.68475470
_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   Al36
_cell_volume   1295.89203826
_cell_formula_units_Z   36
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  0.004039  0.502693  0.297846  1
  Al  Al2  1  0.004039  1.002693  0.297846  1
  Al  Al3  1  0.504039  1.002693  0.297846  1
  Al  Al4  1  0.504039  0.502693  0.297846  1
  Al  Al5  1  0.337373  0.169359  0.347682  1
  Al  Al6  1  0.337373  0.669359  0.347682  1
  Al  Al7  1  0.837373  0.669359  0.347682  1
  Al  Al8  1  0.837373  0.169359  0.347682  1
  Al  Al9  1  0.670706  0.836026  0.397686  1
  Al  Al10  1  0.670706  0.336026  0.397686  1
  Al  Al11  1  0.170706  0.336026  0.397686  1
  Al  Al12  1  0.170706  0.836026  0.397686  1
  Al  Al13  1  0.004039  0.502693  0.447718  1
  Al  Al14  1  0.004039  1.002693  0.447718  1
  Al  Al15  1  0.504039  1.002693  0.447718  1
  Al  Al16  1  0.504039  0.502693  0.447718  1
  Al  Al17  1  0.337373  0.169359  0.497753  1
  Al  Al18  1  0.337373  0.669359  0.497753  1
  Al  Al19  1  0.837373  0.669359  0.497753  1
  Al  Al20  1  0.837373  0.169359  0.497753  1
  Al  Al21  1  0.670706  0.836026  0.547787  1
  Al  Al22  1  0.670706  0.336026  0.547787  1
  Al  Al23  1  0.170706  0.336026  0.547787  1
  Al  Al24  1  0.170706  0.836026  0.547787  1
  Al  Al25  1  0.004039  0.502693  0.597819  1
  Al  Al26  1  0.004039  1.002693  0.597819  1
  Al  Al27  1  0.504039  1.002693  0.597819  1
  Al  Al28  1  0.504039  0.502693  0.597819  1
  Al  Al29  1  0.337373  0.169359  0.647823  1
  Al  Al30  1  0.337373  0.669359  0.647823  1
  Al  Al31  1  0.837373  0.669359  0.647823  1
  Al  Al32  1  0.837373  0.169359  0.647823  1
  Al  Al33  1  0.670706  0.836026  0.697659  1
  Al  Al34  1  0.670706  0.336026  0.697659  1
  Al  Al35  1  0.170706  0.336026  0.697659  1
  Al  Al36  1  0.170706  0.836026  0.697659  1
