# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.99882581
_cell_length_b   12.66909944
_cell_length_c   50.02244093
_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   2534.21298086
_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  1.006399  0.254468  0.319829  1
  Al  Al2  1  1.006399  0.953786  0.294294  1
  Al  Al3  1  1.006399  0.647538  0.272832  1
  Al  Al4  1  0.506399  0.105855  0.305986  1
  Al  Al5  1  0.506399  0.799622  0.283553  1
  Al  Al6  1  0.506399  0.406874  0.332642  1
  Al  Al7  1  0.506399  0.307881  0.284217  1
  Al  Al8  1  0.506399  0.906178  0.331673  1
  Al  Al9  1  0.506399  0.602465  0.308020  1
  Al  Al10  1  1.006399  0.056153  0.343617  1
  Al  Al11  1  1.006399  0.756509  0.320202  1
  Al  Al12  1  1.006399  0.453633  0.295409  1
  Al  Al13  1  1.006399  0.155628  0.395241  1
  Al  Al14  1  1.006399  0.857403  0.369555  1
  Al  Al15  1  1.006399  0.556268  0.344458  1
  Al  Al16  1  0.506399  0.006674  0.382143  1
  Al  Al17  1  0.506399  0.706595  0.356691  1
  Al  Al18  1  0.506399  0.305268  0.408411  1
  Al  Al19  1  0.506399  0.205514  0.356554  1
  Al  Al20  1  0.506399  0.806327  0.408407  1
  Al  Al21  1  0.506399  0.506165  0.382940  1
  Al  Al22  1  1.006399  0.956069  0.421334  1
  Al  Al23  1  1.006399  0.656412  0.395643  1
  Al  Al24  1  1.006399  0.355403  0.369527  1
  Al  Al25  1  1.006399  0.055524  0.473312  1
  Al  Al26  1  1.006399  0.755899  0.447456  1
  Al  Al27  1  1.006399  0.455378  0.421569  1
  Al  Al28  1  0.506399  0.905718  0.460330  1
  Al  Al29  1  0.506399  0.605879  0.434616  1
  Al  Al30  1  0.506399  0.205358  0.486296  1
  Al  Al31  1  0.506399  0.105507  0.434329  1
  Al  Al32  1  0.506399  0.705646  0.486331  1
  Al  Al33  1  0.506399  0.405310  0.460412  1
  Al  Al34  1  1.006399  0.855649  0.499249  1
  Al  Al35  1  1.006399  0.555477  0.473381  1
  Al  Al36  1  1.006399  0.255281  0.447380  1
  Al  Al37  1  1.006399  0.955622  0.551136  1
  Al  Al38  1  1.006399  0.655425  0.525134  1
  Al  Al39  1  1.006399  0.355254  0.499266  1
  Al  Al40  1  0.506399  0.805593  0.538104  1
  Al  Al41  1  0.506399  0.505256  0.512185  1
  Al  Al42  1  0.506399  0.105396  0.564186  1
  Al  Al43  1  0.506399  0.005545  0.512220  1
  Al  Al44  1  0.506399  0.605024  0.563899  1
  Al  Al45  1  0.506399  0.305185  0.538185  1
  Al  Al46  1  1.006399  0.755524  0.576947  1
  Al  Al47  1  1.006399  0.455003  0.551060  1
  Al  Al48  1  1.006399  0.155379  0.525204  1
  Al  Al49  1  1.006399  0.855499  0.628988  1
  Al  Al50  1  1.006399  0.554490  0.602872  1
  Al  Al51  1  1.006399  0.254833  0.577182  1
  Al  Al52  1  0.506399  0.704737  0.615575  1
  Al  Al53  1  0.506399  0.404576  0.590109  1
  Al  Al54  1  0.506399  1.005389  0.641961  1
  Al  Al55  1  0.506399  0.905635  0.590105  1
  Al  Al56  1  0.506399  0.504308  0.641824  1
  Al  Al57  1  0.506399  0.204229  0.616372  1
  Al  Al58  1  1.006399  0.654634  0.654058  1
  Al  Al59  1  1.006399  0.353499  0.628960  1
  Al  Al60  1  1.006399  0.055275  0.603275  1
  Al  Al61  1  1.006399  0.757270  0.703106  1
  Al  Al62  1  1.006399  0.454394  0.678314  1
  Al  Al63  1  1.006399  0.154750  0.654898  1
  Al  Al64  1  0.506399  0.608437  0.690495  1
  Al  Al65  1  0.506399  0.304725  0.666843  1
  Al  Al66  1  0.506399  0.903021  0.714299  1
  Al  Al67  1  0.506399  0.804029  0.665873  1
  Al  Al68  1  0.506399  0.411281  0.714963  1
  Al  Al69  1  0.506399  0.105047  0.692530  1
  Al  Al70  1  1.006399  0.563364  0.725683  1
  Al  Al71  1  1.006399  0.257116  0.704222  1
  Al  Al72  1  1.006399  0.956434  0.678686  1
