# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.99343600
_cell_length_b   8.93293247
_cell_length_c   47.22694167
_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   Al48
_cell_volume   1684.73113244
_cell_formula_units_Z   48
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  0.507082  0.480154  0.297079  1
  Al  Al2  1  0.507082  0.884320  0.334736  1
  Al  Al3  1  0.007082  0.679199  0.315995  1
  Al  Al4  1  0.007082  0.277806  0.280617  1
  Al  Al5  1  0.007082  0.384320  0.334736  1
  Al  Al6  1  0.007082  0.980154  0.297079  1
  Al  Al7  1  0.507082  0.777806  0.280617  1
  Al  Al8  1  0.507082  0.179199  0.315995  1
  Al  Al9  1  0.507082  0.283016  0.371790  1
  Al  Al10  1  0.507082  0.682524  0.410889  1
  Al  Al11  1  0.007082  0.483028  0.391598  1
  Al  Al12  1  0.007082  0.083388  0.352895  1
  Al  Al13  1  0.007082  0.182524  0.410889  1
  Al  Al14  1  0.007082  0.783016  0.371790  1
  Al  Al15  1  0.507082  0.583388  0.352895  1
  Al  Al16  1  0.507082  0.983028  0.391598  1
  Al  Al17  1  0.507082  0.082166  0.449964  1
  Al  Al18  1  0.507082  0.481875  0.488811  1
  Al  Al19  1  0.007082  0.281987  0.469385  1
  Al  Al20  1  0.007082  0.882067  0.430385  1
  Al  Al21  1  0.007082  0.981875  0.488811  1
  Al  Al22  1  0.007082  0.582166  0.449964  1
  Al  Al23  1  0.507082  0.382067  0.430385  1
  Al  Al24  1  0.507082  0.781987  0.469385  1
  Al  Al25  1  0.507082  0.881798  0.527749  1
  Al  Al26  1  0.507082  0.281718  0.566749  1
  Al  Al27  1  0.007082  0.081619  0.547170  1
  Al  Al28  1  0.007082  0.681910  0.508323  1
  Al  Al29  1  0.007082  0.781718  0.566749  1
  Al  Al30  1  0.007082  0.381798  0.527749  1
  Al  Al31  1  0.507082  0.181910  0.508323  1
  Al  Al32  1  0.507082  0.581619  0.547170  1
  Al  Al33  1  0.507082  0.680757  0.605536  1
  Al  Al34  1  0.507082  0.080398  0.644239  1
  Al  Al35  1  0.007082  0.880769  0.625344  1
  Al  Al36  1  0.007082  0.481261  0.586245  1
  Al  Al37  1  0.007082  0.580398  0.644239  1
  Al  Al38  1  0.007082  0.180757  0.605536  1
  Al  Al39  1  0.507082  0.981261  0.586245  1
  Al  Al40  1  0.507082  0.380769  0.625344  1
  Al  Al41  1  0.507082  0.484586  0.681139  1
  Al  Al42  1  0.507082  0.885979  0.716517  1
  Al  Al43  1  0.007082  0.683632  0.700055  1
  Al  Al44  1  0.007082  0.279465  0.662398  1
  Al  Al45  1  0.007082  0.385979  0.716517  1
  Al  Al46  1  0.007082  0.984586  0.681139  1
  Al  Al47  1  0.507082  0.779465  0.662398  1
  Al  Al48  1  0.507082  0.183632  0.700055  1
