# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.58220517
_cell_length_b   11.50196255
_cell_length_c   46.99123040
_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   5956.37980848
_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  0.794376  0.145301  0.277654  1
  Al  Al2  1  0.145262  0.861169  0.277415  1
  Al  Al3  1  0.055675  0.109882  0.312203  1
  Al  Al4  1  0.421959  0.180963  0.299319  1
  Al  Al5  1  0.761505  0.892055  0.275389  1
  Al  Al6  1  0.119162  0.430784  0.306063  1
  Al  Al7  1  0.604799  0.507237  0.276339  1
  Al  Al8  1  0.394130  0.734279  0.288733  1
  Al  Al9  1  0.728776  0.448334  0.328469  1
  Al  Al10  1  0.559521  0.870056  0.306250  1
  Al  Al11  1  0.980945  0.698410  0.293497  1
  Al  Al12  1  0.931704  0.945994  0.309191  1
  Al  Al13  1  0.309102  0.992077  0.307358  1
  Al  Al14  1  0.756622  0.645664  0.291691  1
  Al  Al15  1  0.899595  0.349396  0.290161  1
  Al  Al16  1  0.379085  0.446703  0.279897  1
  Al  Al17  1  0.217243  0.631341  0.310363  1
  Al  Al18  1  0.589072  0.305962  0.309044  1
  Al  Al19  1  0.660594  0.056080  0.319865  1
  Al  Al20  1  0.030112  0.732555  0.355576  1
  Al  Al21  1  0.964395  0.987792  0.364468  1
  Al  Al22  1  0.346476  0.020962  0.371012  1
  Al  Al23  1  0.655576  0.678510  0.347069  1
  Al  Al24  1  0.978658  0.322104  0.347696  1
  Al  Al25  1  0.345256  0.397621  0.335772  1
  Al  Al26  1  0.271973  0.639459  0.366228  1
  Al  Al27  1  0.615024  0.342338  0.367276  1
  Al  Al28  1  0.412888  0.795621  0.347812  1
  Al  Al29  1  0.909690  0.564905  0.338545  1
  Al  Al30  1  0.800033  0.820693  0.335563  1
  Al  Al31  1  0.172757  0.867016  0.334287  1
  Al  Al32  1  0.476755  0.554426  0.329049  1
  Al  Al33  1  0.818202  0.191953  0.334699  1
  Al  Al34  1  0.229625  0.217492  0.338071  1
  Al  Al35  1  0.138854  0.464294  0.366948  1
  Al  Al36  1  0.477263  0.182953  0.359467  1
  Al  Al37  1  0.593459  0.916576  0.366534  1
  Al  Al38  1  0.950823  0.605034  0.399707  1
  Al  Al39  1  0.851299  0.859110  0.397455  1
  Al  Al40  1  0.209072  0.873428  0.390011  1
  Al  Al41  1  0.527280  0.590032  0.385681  1
  Al  Al42  1  0.855303  0.225014  0.392762  1
  Al  Al43  1  0.272146  0.251032  0.398480  1
  Al  Al44  1  0.183010  0.490942  0.427618  1
  Al  Al45  1  0.517193  0.213413  0.419153  1
  Al  Al46  1  0.326181  0.658645  0.422301  1
  Al  Al47  1  0.786746  0.477079  0.383802  1
  Al  Al48  1  0.701285  0.711238  0.404724  1
  Al  Al49  1  0.079139  0.755079  0.420058  1
  Al  Al50  1  0.391469  0.427366  0.393001  1
  Al  Al51  1  0.711098  0.083539  0.378522  1
  Al  Al52  1  0.105156  0.126061  0.379567  1
  Al  Al53  1  0.017599  0.354496  0.408118  1
  Al  Al54  1  0.384998  0.052835  0.432638  1
  Al  Al55  1  0.454360  0.828391  0.408082  1
  Al  Al56  1  0.823516  0.509745  0.441653  1
  Al  Al57  1  0.737920  0.741588  0.464227  1
  Al  Al58  1  0.115976  0.784499  0.482110  1
  Al  Al59  1  0.431373  0.452954  0.453105  1
  Al  Al60  1  0.748507  0.117895  0.438819  1
  Al  Al61  1  0.141995  0.156755  0.440816  1
  Al  Al62  1  0.052766  0.384071  0.468469  1
  Al  Al63  1  0.420213  0.080517  0.493270  1
  Al  Al64  1  0.219593  0.518769  0.488154  1
  Al  Al65  1  0.652998  0.380937  0.423913  1
  Al  Al66  1  0.566029  0.622535  0.444376  1
  Al  Al67  1  0.988080  0.633567  0.461073  1
  Al  Al68  1  0.309047  0.279357  0.459525  1
  Al  Al69  1  0.635182  0.947117  0.426744  1
  Al  Al70  1  1.000665  0.015039  0.422583  1
  Al  Al71  1  0.890086  0.257800  0.452069  1
  Al  Al72  1  0.241491  0.896064  0.447043  1
  Al  Al73  1  0.362959  0.684777  0.480245  1
  Al  Al74  1  0.686070  0.411445  0.481580  1
  Al  Al75  1  0.600613  0.651214  0.503392  1
  Al  Al76  1  0.021777  0.662457  0.521843  1
  Al  Al77  1  0.343979  0.307430  0.519837  1
  Al  Al78  1  0.671941  0.976034  0.487223  1
  Al  Al79  1  0.033086  0.045112  0.481405  1
  Al  Al80  1  0.924634  0.288311  0.511745  1
  Al  Al81  1  0.273496  0.922296  0.505519  1
  Al  Al82  1  0.087481  0.412481  0.528639  1
  Al  Al83  1  0.552390  0.240580  0.479639  1
  Al  Al84  1  0.467372  0.480591  0.512637  1
  Al  Al85  1  0.857241  0.539016  0.500926  1
  Al  Al86  1  0.176794  0.184116  0.501403  1
  Al  Al87  1  0.488993  0.857725  0.467958  1
  Al  Al88  1  0.889282  0.890872  0.457926  1
  Al  Al89  1  0.782916  0.149907  0.499287  1
  Al  Al90  1  0.149666  0.813937  0.542998  1
  Al  Al91  1  0.253879  0.547059  0.548105  1
  Al  Al92  1  0.585301  0.268246  0.540208  1
  Al  Al93  1  0.501410  0.507428  0.572021  1
  Al  Al94  1  0.890699  0.566972  0.560686  1
  Al  Al95  1  0.210817  0.210747  0.561487  1
  Al  Al96  1  0.522480  0.884841  0.527779  1
  Al  Al97  1  0.922899  0.921250  0.518058  1
  Al  Al98  1  0.815420  0.181121  0.560035  1
  Al  Al99  1  0.182100  0.842614  0.603517  1
  Al  Al100  1  0.959401  0.316822  0.571595  1
  Al  Al101  1  0.454151  0.107124  0.553400  1
  Al  Al102  1  0.377506  0.334588  0.579800  1
  Al  Al103  1  0.718577  0.439758  0.539796  1
  Al  Al104  1  0.064349  0.074169  0.541019  1
  Al  Al105  1  0.396524  0.712177  0.539157  1
  Al  Al106  1  0.771863  0.769935  0.524259  1
  Al  Al107  1  0.706620  1.004187  0.547813  1
  Al  Al108  1  0.054517  0.690818  0.582249  1
  Al  Al109  1  0.121408  0.440346  0.588541  1
  Al  Al110  1  0.487796  0.132497  0.613194  1
  Al  Al111  1  0.410431  0.362594  0.639357  1
  Al  Al112  1  0.750623  0.466505  0.597974  1
  Al  Al113  1  0.095807  0.102424  0.600888  1
  Al  Al114  1  0.429156  0.739175  0.598717  1
  Al  Al115  1  0.804845  0.796870  0.584510  1
  Al  Al116  1  0.740476  0.031802  0.608571  1
  Al  Al117  1  0.086234  0.719205  0.642595  1
  Al  Al118  1  0.847737  0.211921  0.620981  1
  Al  Al119  1  0.305937  0.949249  0.565017  1
  Al  Al120  1  0.245288  0.236744  0.621141  1
  Al  Al121  1  0.617504  0.295149  0.600735  1
  Al  Al122  1  0.955012  0.950203  0.578252  1
  Al  Al123  1  0.286793  0.575168  0.607446  1
  Al  Al124  1  0.633589  0.678278  0.562792  1
  Al  Al125  1  0.555885  0.910579  0.587641  1
  Al  Al126  1  0.924046  0.593624  0.620955  1
  Al  Al127  1  0.996287  0.343403  0.631614  1
  Al  Al128  1  0.339396  0.974980  0.625113  1
  Al  Al129  1  0.281265  0.264019  0.679323  1
  Al  Al130  1  0.648932  0.321387  0.660602  1
  Al  Al131  1  0.987620  0.978788  0.638722  1
  Al  Al132  1  0.319849  0.600956  0.665827  1
  Al  Al133  1  0.666533  0.703250  0.622628  1
  Al  Al134  1  0.590085  0.933556  0.647548  1
  Al  Al135  1  0.956749  0.616772  0.681201  1
  Al  Al136  1  0.774960  0.056800  0.668409  1
  Al  Al137  1  0.214765  0.868876  0.663778  1
  Al  Al138  1  0.129634  0.127714  0.660274  1
  Al  Al139  1  0.522230  0.157584  0.671286  1
  Al  Al140  1  0.837892  0.822783  0.644557  1
  Al  Al141  1  0.155847  0.469152  0.647882  1
  Al  Al142  1  0.534775  0.533649  0.631331  1
  Al  Al143  1  0.462020  0.762672  0.658889  1
  Al  Al144  1  0.783010  0.487591  0.655417  1
  Al  Al145  1  0.879579  0.243533  0.681554  1
  Al  Al146  1  0.252838  0.888393  0.723421  1
  Al  Al147  1  0.177081  0.146357  0.718967  1
  Al  Al148  1  0.424705  0.170287  0.726978  1
  Al  Al149  1  0.867370  0.848085  0.705159  1
  Al  Al150  1  0.195266  0.491421  0.707850  1
  Al  Al151  1  0.571458  0.553463  0.690730  1
  Al  Al152  1  0.504760  0.785560  0.718450  1
  Al  Al153  1  0.810000  0.492405  0.713067  1
  Al  Al154  1  0.621212  0.967040  0.707978  1
  Al  Al155  1  0.118989  0.742497  0.702563  1
  Al  Al156  1  0.015624  1.005619  0.698868  1
  Al  Al157  1  0.377496  0.999451  0.684728  1
  Al  Al158  1  0.704462  0.722292  0.682206  1
  Al  Al159  1  0.038040  0.366719  0.690854  1
  Al  Al160  1  0.448137  0.384604  0.699967  1
  Al  Al161  1  0.358948  0.623351  0.723752  1
  Al  Al162  1  0.669996  0.205463  0.714985  1
