# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.54868506
_cell_length_b   11.52775895
_cell_length_c   46.59294662
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.07978686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al162
_cell_volume   5902.01031828
_cell_formula_units_Z   162
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  0.810067  0.141901  0.290798  1
  Al  Al2  1  0.143400  0.808568  0.290798  1
  Al  Al3  1  0.046801  0.071021  0.321137  1
  Al  Al4  1  0.452069  0.080968  0.306115  1
  Al  Al5  1  0.785403  0.747635  0.306115  1
  Al  Al6  1  0.118736  0.414301  0.306115  1
  Al  Al7  1  0.476734  0.475234  0.290798  1
  Al  Al8  1  0.380134  0.737688  0.321137  1
  Al  Al9  1  0.713468  0.404355  0.321137  1
  Al  Al10  1  0.679765  0.977696  0.283550  1
  Al  Al11  1  0.013098  0.644362  0.283550  1
  Al  Al12  1  0.913551  0.909654  0.313130  1
  Al  Al13  1  0.277246  0.967116  0.298458  1
  Al  Al14  1  0.610580  0.633783  0.298458  1
  Al  Al15  1  0.943913  0.300449  0.298458  1
  Al  Al16  1  0.346432  0.311029  0.283550  1
  Al  Al17  1  0.246884  0.576320  0.313130  1
  Al  Al18  1  0.580218  0.242987  0.313130  1
  Al  Al19  1  0.692409  0.023854  0.340092  1
  Al  Al20  1  0.025742  0.690521  0.340092  1
  Al  Al21  1  0.933127  0.962309  0.371719  1
  Al  Al22  1  0.338956  0.967915  0.355781  1
  Al  Al23  1  0.672289  0.634582  0.355781  1
  Al  Al24  1  0.005622  0.301248  0.355781  1
  Al  Al25  1  0.359076  0.357188  0.340092  1
  Al  Al26  1  0.266461  0.628976  0.371719  1
  Al  Al27  1  0.599794  0.295642  0.371719  1
  Al  Al28  1  0.559656  0.857176  0.329699  1
  Al  Al29  1  0.892989  0.523842  0.329699  1
  Al  Al30  1  0.800898  0.799795  0.363984  1
  Al  Al31  1  0.159609  0.853058  0.347919  1
  Al  Al32  1  0.492942  0.519725  0.347919  1
  Al  Al33  1  0.826276  0.186392  0.347919  1
  Al  Al34  1  0.226322  0.190509  0.329699  1
  Al  Al35  1  0.134231  0.466461  0.363984  1
  Al  Al36  1  0.467564  0.133128  0.363984  1
  Al  Al37  1  0.577460  0.909773  0.388393  1
  Al  Al38  1  0.910793  0.576439  0.388393  1
  Al  Al39  1  0.818772  0.852688  0.422076  1
  Al  Al40  1  0.225969  0.855028  0.405741  1
  Al  Al41  1  0.559302  0.521695  0.405741  1
  Al  Al42  1  0.892636  0.188362  0.405741  1
  Al  Al43  1  0.244127  0.243106  0.388393  1
  Al  Al44  1  0.152106  0.519354  0.422076  1
  Al  Al45  1  0.485439  0.186021  0.422076  1
  Al  Al46  1  0.447323  0.743792  0.379942  1
  Al  Al47  1  0.780656  0.410458  0.379942  1
  Al  Al48  1  0.688368  0.688157  0.413831  1
  Al  Al49  1  0.043272  0.741608  0.397643  1
  Al  Al50  1  0.376605  0.408275  0.397643  1
  Al  Al51  1  0.709939  0.074942  0.397643  1
  Al  Al52  1  0.113990  0.077125  0.379942  1
  Al  Al53  1  0.021702  0.354824  0.413831  1
  Al  Al54  1  0.355035  0.021490  0.413831  1
  Al  Al55  1  0.464623  0.797870  0.438367  1
  Al  Al56  1  0.797957  0.464537  0.438367  1
  Al  Al57  1  0.705176  0.741920  0.471896  1
  Al  Al58  1  0.112661  0.742749  0.455613  1
  Al  Al59  1  0.445994  0.409416  0.455613  1
  Al  Al60  1  0.779328  0.076083  0.455613  1
  Al  Al61  1  0.131290  0.131204  0.438367  1
  Al  Al62  1  0.038509  0.408587  0.471896  1
  Al  Al63  1  0.371843  0.075253  0.471896  1
  Al  Al64  1  0.335116  0.631559  0.430212  1
  Al  Al65  1  0.668449  0.298226  0.430212  1
  Al  Al66  1  0.575454  0.576134  0.463720  1
  Al  Al67  1  0.928464  0.630286  0.446826  1
  Al  Al68  1  0.261797  0.296953  0.446826  1
  Al  Al69  1  0.595131  0.963620  0.446826  1
  Al  Al70  1  0.001783  0.964893  0.430212  1
  Al  Al71  1  0.908788  0.242801  0.463720  1
  Al  Al72  1  0.242121  0.909467  0.463720  1
  Al  Al73  1  0.351794  0.686159  0.488330  1
  Al  Al74  1  0.685127  0.352825  0.488330  1
  Al  Al75  1  0.591865  0.630764  0.521742  1
  Al  Al76  1  0.999294  0.631159  0.505294  1
  Al  Al77  1  0.332627  0.297825  0.505294  1
  Al  Al78  1  0.665960  0.964492  0.505294  1
  Al  Al79  1  0.018460  0.019492  0.488330  1
  Al  Al80  1  0.925198  0.297431  0.521742  1
  Al  Al81  1  0.258532  0.964098  0.521742  1
  Al  Al82  1  0.222404  0.519703  0.480235  1
  Al  Al83  1  0.555737  0.186370  0.480235  1
  Al  Al84  1  0.462475  0.464309  0.513647  1
  Al  Al85  1  0.814975  0.519309  0.496683  1
  Al  Al86  1  0.148309  0.185976  0.496683  1
  Al  Al87  1  0.481642  0.852642  0.496683  1
  Al  Al88  1  0.889071  0.853036  0.480235  1
  Al  Al89  1  0.795809  0.130975  0.513647  1
  Al  Al90  1  0.129142  0.797642  0.513647  1
  Al  Al91  1  0.238815  0.574333  0.538257  1
  Al  Al92  1  0.572148  0.241000  0.538257  1
  Al  Al93  1  0.479153  0.518908  0.571764  1
  Al  Al94  1  0.885805  0.520181  0.555151  1
  Al  Al95  1  0.219138  0.186848  0.555151  1
  Al  Al96  1  0.552472  0.853514  0.555151  1
  Al  Al97  1  0.905481  0.907667  0.538257  1
  Al  Al98  1  0.812486  0.185575  0.571764  1
  Al  Al99  1  0.145820  0.852241  0.571764  1
  Al  Al100  1  0.109093  0.408547  0.530081  1
  Al  Al101  1  0.442426  0.075214  0.530081  1
  Al  Al102  1  0.349646  0.352597  0.563610  1
  Al  Al103  1  0.701608  0.407718  0.546364  1
  Al  Al104  1  0.034941  0.074385  0.546364  1
  Al  Al105  1  0.368275  0.741051  0.546364  1
  Al  Al106  1  0.775760  0.741881  0.530081  1
  Al  Al107  1  0.682979  0.019264  0.563610  1
  Al  Al108  1  0.016312  0.685931  0.563610  1
  Al  Al109  1  0.125901  0.462310  0.588146  1
  Al  Al110  1  0.459234  0.128977  0.588146  1
  Al  Al111  1  0.366946  0.406676  0.622035  1
  Al  Al112  1  0.770997  0.408859  0.604334  1
  Al  Al113  1  0.104330  0.075526  0.604334  1
  Al  Al114  1  0.437664  0.742193  0.604334  1
  Al  Al115  1  0.792567  0.795644  0.588146  1
  Al  Al116  1  0.700279  0.073342  0.622035  1
  Al  Al117  1  0.033613  0.740009  0.622035  1
  Al  Al118  1  0.995497  0.297780  0.579901  1
  Al  Al119  1  0.328830  0.964446  0.579901  1
  Al  Al120  1  0.236809  0.240695  0.613584  1
  Al  Al121  1  0.588300  0.295439  0.596235  1
  Al  Al122  1  0.921633  0.962106  0.596235  1
  Al  Al123  1  0.254967  0.628772  0.596235  1
  Al  Al124  1  0.662163  0.631113  0.579901  1
  Al  Al125  1  0.570142  0.907361  0.613584  1
  Al  Al126  1  0.903476  0.574028  0.613584  1
  Al  Al127  1  0.013371  0.350673  0.637993  1
  Al  Al128  1  0.346705  0.017339  0.637993  1
  Al  Al129  1  0.254613  0.293292  0.672278  1
  Al  Al130  1  0.654660  0.297409  0.654057  1
  Al  Al131  1  0.987993  0.964076  0.654057  1
  Al  Al132  1  0.321327  0.630742  0.654057  1
  Al  Al133  1  0.680038  0.684006  0.637993  1
  Al  Al134  1  0.587947  0.959958  0.672278  1
  Al  Al135  1  0.921280  0.626625  0.672278  1
  Al  Al136  1  0.881142  0.188158  0.630258  1
  Al  Al137  1  0.214475  0.854825  0.630258  1
  Al  Al138  1  0.121860  0.126613  0.661885  1
  Al  Al139  1  0.475313  0.182552  0.646195  1
  Al  Al140  1  0.808647  0.849219  0.646195  1
  Al  Al141  1  0.141980  0.515886  0.646195  1
  Al  Al142  1  0.547808  0.521492  0.630258  1
  Al  Al143  1  0.455193  0.793280  0.661885  1
  Al  Al144  1  0.788527  0.459947  0.661885  1
  Al  Al145  1  0.900718  0.240814  0.688847  1
  Al  Al146  1  0.234051  0.907480  0.688847  1
  Al  Al147  1  0.134504  0.172772  0.718427  1
  Al  Al148  1  0.537023  0.183352  0.703518  1
  Al  Al149  1  0.870356  0.850018  0.703518  1
  Al  Al150  1  0.203689  0.516685  0.703518  1
  Al  Al151  1  0.567385  0.574147  0.688847  1
  Al  Al152  1  0.467837  0.839438  0.718427  1
  Al  Al153  1  0.801171  0.506105  0.718427  1
  Al  Al154  1  0.767468  0.079446  0.680840  1
  Al  Al155  1  0.100801  0.746113  0.680840  1
  Al  Al156  1  0.004202  0.008567  0.711178  1
  Al  Al157  1  0.362200  0.069499  0.695861  1
  Al  Al158  1  0.695533  0.736166  0.695861  1
  Al  Al159  1  0.028866  0.402833  0.695861  1
  Al  Al160  1  0.434135  0.412779  0.680840  1
  Al  Al161  1  0.337535  0.675233  0.711178  1
  Al  Al162  1  0.670869  0.341900  0.711178  1
