# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.00605228
_cell_length_b   5.69164952
_cell_length_c   45.84604394
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al28
_cell_volume   1045.33773634
_cell_formula_units_Z   28
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  0.004895  0.627568  0.297547  1
  Al  Al2  1  0.504895  0.877568  0.326729  1
  Al  Al3  1  0.504895  0.377568  0.326729  1
  Al  Al4  1  0.004895  0.127568  0.297547  1
  Al  Al5  1  0.004895  0.127568  0.357901  1
  Al  Al6  1  0.504895  0.377568  0.389004  1
  Al  Al7  1  0.504895  0.877568  0.389004  1
  Al  Al8  1  0.004895  0.627568  0.357901  1
  Al  Al9  1  0.004895  0.627568  0.420570  1
  Al  Al10  1  0.504895  0.877568  0.451971  1
  Al  Al11  1  0.504895  0.377568  0.451971  1
  Al  Al12  1  0.004895  0.127568  0.420570  1
  Al  Al13  1  0.004895  0.127568  0.483425  1
  Al  Al14  1  0.504895  0.377568  0.514851  1
  Al  Al15  1  0.504895  0.877568  0.514851  1
  Al  Al16  1  0.004895  0.627568  0.483425  1
  Al  Al17  1  0.004895  0.627568  0.546305  1
  Al  Al18  1  0.504895  0.877568  0.577706  1
  Al  Al19  1  0.504895  0.377568  0.577706  1
  Al  Al20  1  0.004895  0.127568  0.546305  1
  Al  Al21  1  0.004895  0.127568  0.609272  1
  Al  Al22  1  0.504895  0.377568  0.640375  1
  Al  Al23  1  0.504895  0.877568  0.640375  1
  Al  Al24  1  0.004895  0.627568  0.609272  1
  Al  Al25  1  0.004895  0.627568  0.671547  1
  Al  Al26  1  0.504895  0.877568  0.700729  1
  Al  Al27  1  0.504895  0.377568  0.700729  1
  Al  Al28  1  0.004895  0.127568  0.671547  1
