# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.00540875
_cell_length_b   12.68348322
_cell_length_c   50.12567520
_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   Al72
_cell_volume   2546.5113544
_cell_formula_units_Z   72
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  1.004434  0.247987  0.324388  1
  Al  Al2  1  1.004434  0.945416  0.297233  1
  Al  Al3  1  1.004434  0.644505  0.274809  1
  Al  Al4  1  0.504434  0.095731  0.311231  1
  Al  Al5  1  0.504434  0.797006  0.285717  1
  Al  Al6  1  0.504434  0.397225  0.336391  1
  Al  Al7  1  0.504434  0.297006  0.285717  1
  Al  Al8  1  0.504434  0.897225  0.336391  1
  Al  Al9  1  0.504434  0.595731  0.311231  1
  Al  Al10  1  1.004434  0.144505  0.274809  1
  Al  Al11  1  1.004434  0.747987  0.324388  1
  Al  Al12  1  1.004434  0.445416  0.297233  1
  Al  Al13  1  1.004434  0.146467  0.400689  1
  Al  Al14  1  1.004434  0.847014  0.375064  1
  Al  Al15  1  1.004434  0.546482  0.349268  1
  Al  Al16  1  0.504434  0.996638  0.387836  1
  Al  Al17  1  0.504434  0.696809  0.362132  1
  Al  Al18  1  0.504434  0.296309  0.413567  1
  Al  Al19  1  0.504434  0.196809  0.362132  1
  Al  Al20  1  0.504434  0.796309  0.413567  1
  Al  Al21  1  0.504434  0.496638  0.387836  1
  Al  Al22  1  1.004434  0.046482  0.349268  1
  Al  Al23  1  1.004434  0.646467  0.400689  1
  Al  Al24  1  1.004434  0.347014  0.375064  1
  Al  Al25  1  1.004434  0.045629  0.477834  1
  Al  Al26  1  1.004434  0.745898  0.452123  1
  Al  Al27  1  1.004434  0.446217  0.426428  1
  Al  Al28  1  0.504434  0.895765  0.464980  1
  Al  Al29  1  0.504434  0.596047  0.439268  1
  Al  Al30  1  0.504434  0.195485  0.490686  1
  Al  Al31  1  0.504434  0.096047  0.439268  1
  Al  Al32  1  0.504434  0.695485  0.490686  1
  Al  Al33  1  0.504434  0.395765  0.464980  1
  Al  Al34  1  1.004434  0.946217  0.426428  1
  Al  Al35  1  1.004434  0.545629  0.477834  1
  Al  Al36  1  1.004434  0.245898  0.452123  1
  Al  Al37  1  1.004434  0.944780  0.554958  1
  Al  Al38  1  1.004434  0.645063  0.529246  1
  Al  Al39  1  1.004434  0.345342  0.503540  1
  Al  Al40  1  0.504434  0.794929  0.542103  1
  Al  Al41  1  0.504434  0.495198  0.516393  1
  Al  Al42  1  0.504434  0.094610  0.567799  1
  Al  Al43  1  0.504434  0.995198  0.516393  1
  Al  Al44  1  0.504434  0.594610  0.567799  1
  Al  Al45  1  0.504434  0.294929  0.542103  1
  Al  Al46  1  1.004434  0.845342  0.503540  1
  Al  Al47  1  1.004434  0.444780  0.554958  1
  Al  Al48  1  1.004434  0.145063  0.529246  1
  Al  Al49  1  1.004434  0.844019  0.632094  1
  Al  Al50  1  1.004434  0.544189  0.606390  1
  Al  Al51  1  1.004434  0.244519  0.580660  1
  Al  Al52  1  0.504434  0.693813  0.619162  1
  Al  Al53  1  0.504434  0.394360  0.593538  1
  Al  Al54  1  0.504434  0.994345  0.644959  1
  Al  Al55  1  0.504434  0.894360  0.593538  1
  Al  Al56  1  0.504434  0.494345  0.644959  1
  Al  Al57  1  0.504434  0.193813  0.619162  1
  Al  Al58  1  1.004434  0.744519  0.580660  1
  Al  Al59  1  1.004434  0.344019  0.632094  1
  Al  Al60  1  1.004434  0.044189  0.606390  1
  Al  Al61  1  1.004434  0.743821  0.708509  1
  Al  Al62  1  1.004434  0.445096  0.682996  1
  Al  Al63  1  1.004434  0.143602  0.657836  1
  Al  Al64  1  0.504434  0.595412  0.696994  1
  Al  Al65  1  0.504434  0.292840  0.669838  1
  Al  Al66  1  0.504434  0.896322  0.719417  1
  Al  Al67  1  0.504434  0.792840  0.669838  1
  Al  Al68  1  0.504434  0.396322  0.719417  1
  Al  Al69  1  0.504434  0.095412  0.696994  1
  Al  Al70  1  1.004434  0.643602  0.657836  1
  Al  Al71  1  1.004434  0.243821  0.708509  1
  Al  Al72  1  1.004434  0.945096  0.682996  1
