# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.99900158
_cell_length_b   10.32864674
_cell_length_c   49.17179147
_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   6281.62222983
_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  0.649026  0.460308  0.290372  1
  Al  Al2  1  -0.023319  0.126485  0.288442  1
  Al  Al3  1  0.931592  0.379925  0.310614  1
  Al  Al4  1  0.296880  0.410624  0.298900  1
  Al  Al5  1  0.616848  0.090550  0.298569  1
  Al  Al6  1  -0.047203  0.740567  0.298607  1
  Al  Al7  1  0.307724  0.795688  0.288397  1
  Al  Al8  1  0.262383  1.041864  0.312725  1
  Al  Al9  1  0.597650  0.711424  0.312112  1
  Al  Al10  1  0.420119  0.182361  0.321622  1
  Al  Al11  1  0.823463  0.984704  0.284131  1
  Al  Al12  1  0.778545  0.228544  0.308558  1
  Al  Al13  1  0.134869  0.277434  0.294172  1
  Al  Al14  1  0.466008  0.942195  0.294412  1
  Al  Al15  1  0.796621  0.611929  0.292902  1
  Al  Al16  1  0.157933  0.647908  0.284026  1
  Al  Al17  1  0.106111  0.895301  0.307347  1
  Al  Al18  1  0.443262  0.557617  0.303356  1
  Al  Al19  1  0.573041  0.323694  0.330171  1
  Al  Al20  1  0.911416  0.982397  0.334397  1
  Al  Al21  1  0.855332  0.216664  0.363890  1
  Al  Al22  1  0.218670  0.269057  0.347933  1
  Al  Al23  1  0.550011  0.939572  0.347713  1
  Al  Al24  1  0.886460  0.607055  0.346673  1
  Al  Al25  1  0.251142  0.649789  0.333586  1
  Al  Al26  1  0.189874  0.885603  0.362840  1
  Al  Al27  1  0.523940  0.552617  0.361931  1
  Al  Al28  1  0.339103  1.021335  0.371004  1
  Al  Al29  1  0.748370  0.849428  0.322428  1
  Al  Al30  1  0.700289  1.081943  0.354758  1
  Al  Al31  1  0.063088  0.132757  0.340234  1
  Al  Al32  1  0.400766  0.794730  0.339293  1
  Al  Al33  1  0.737020  0.464836  0.341081  1
  Al  Al34  1  0.091270  0.509265  0.323594  1
  Al  Al35  1  0.041515  0.742219  0.355310  1
  Al  Al36  1  0.372203  0.407697  0.355946  1
  Al  Al37  1  0.488887  0.155165  0.381370  1
  Al  Al38  1  0.822834  0.830365  0.378873  1
  Al  Al39  1  0.757091  1.038209  0.414658  1
  Al  Al40  1  0.124290  0.094721  0.398811  1
  Al  Al41  1  0.457491  0.762024  0.398038  1
  Al  Al42  1  0.790338  0.428211  0.399048  1
  Al  Al43  1  0.155711  0.489525  0.380852  1
  Al  Al44  1  0.091764  0.702689  0.415161  1
  Al  Al45  1  0.424464  0.370776  0.414955  1
  Al  Al46  1  0.242452  0.840859  0.423320  1
  Al  Al47  1  0.673560  0.691264  0.371178  1
  Al  Al48  1  0.608413  0.898292  0.406810  1
  Al  Al49  1  -0.024629  0.957370  0.390755  1
  Al  Al50  1  0.307510  0.625129  0.390114  1
  Al  Al51  1  0.637259  0.296734  0.388568  1
  Al  Al52  1  0.003111  0.357752  0.371135  1
  Al  Al53  1  0.938308  0.570680  0.405826  1
  Al  Al54  1  0.273536  0.232617  0.406656  1
  Al  Al55  1  0.392963  0.978066  0.431496  1
  Al  Al56  1  0.726300  0.645483  0.431568  1
  Al  Al57  1  0.663077  0.859441  0.465690  1
  Al  Al58  1  0.028739  0.917353  0.449332  1
  Al  Al59  1  0.362112  0.583932  0.449255  1
  Al  Al60  1  0.694782  0.251484  0.448837  1
  Al  Al61  1  0.057897  0.314256  0.431155  1
  Al  Al62  1  -0.003165  0.524876  0.465952  1
  Al  Al63  1  0.330079  0.191636  0.465863  1
  Al  Al64  1  0.147353  0.662341  0.474320  1
  Al  Al65  1  0.575074  0.508516  0.422905  1
  Al  Al66  1  0.512930  0.721090  0.457474  1
  Al  Al67  1  0.877052  0.782076  0.440178  1
  Al  Al68  1  0.210576  0.447540  0.440507  1
  Al  Al69  1  0.543794  0.115186  0.440204  1
  Al  Al70  1  0.908206  0.174948  0.423475  1
  Al  Al71  1  0.846104  0.388038  0.457788  1
  Al  Al72  1  0.178993  1.055548  0.457517  1
  Al  Al73  1  0.297661  0.800505  0.482466  1
  Al  Al74  1  0.631453  0.466077  0.482500  1
  Al  Al75  1  0.568059  0.679911  0.516702  1
  Al  Al76  1  0.933221  0.739429  0.499796  1
  Al  Al77  1  0.266530  0.406161  0.499793  1
  Al  Al78  1  0.599865  1.073118  0.499740  1
  Al  Al79  1  -0.035290  0.133204  0.482643  1
  Al  Al80  1  0.901242  0.347211  0.516803  1
  Al  Al81  1  0.235274  1.012486  0.517039  1
  Al  Al82  1  0.052197  0.483736  0.525228  1
  Al  Al83  1  0.480807  0.328889  0.474281  1
  Al  Al84  1  0.417091  0.543521  0.508292  1
  Al  Al85  1  0.781755  0.604158  0.490959  1
  Al  Al86  1  0.115850  0.269303  0.491302  1
  Al  Al87  1  0.448902  0.936450  0.491032  1
  Al  Al88  1  0.814228  0.995518  0.474308  1
  Al  Al89  1  0.751116  0.208809  0.508450  1
  Al  Al90  1  0.084256  0.875934  0.508514  1
  Al  Al91  1  0.202922  0.620926  0.533576  1
  Al  Al92  1  0.535960  0.288256  0.533479  1
  Al  Al93  1  0.474957  0.498725  0.568408  1
  Al  Al94  1  0.838190  0.561194  0.550627  1
  Al  Al95  1  0.171668  0.227508  0.550673  1
  Al  Al96  1  0.504220  0.895341  0.550203  1
  Al  Al97  1  0.869916  0.953385  0.533716  1
  Al  Al98  1  0.806843  0.167193  0.567881  1
  Al  Al99  1  0.139902  0.834796  0.567836  1
  Al  Al100  1  -0.042085  0.304416  0.576345  1
  Al  Al101  1  0.385570  0.150465  0.525146  1
  Al  Al102  1  0.322425  0.365020  0.559097  1
  Al  Al103  1  0.686549  0.425310  0.541503  1
  Al  Al104  1  0.019725  0.092447  0.541655  1
  Al  Al105  1  0.353923  0.757401  0.542068  1
  Al  Al106  1  0.718826  0.817168  0.525157  1
  Al  Al107  1  0.655711  1.031390  0.559200  1
  Al  Al108  1  -0.010395  0.696719  0.559507  1
  Al  Al109  1  0.109151  0.441030  0.584645  1
  Al  Al110  1  0.441179  0.110399  0.584193  1
  Al  Al111  1  0.377601  0.324154  0.618318  1
  Al  Al112  1  0.741661  0.385374  0.600111  1
  Al  Al113  1  0.075636  1.051050  0.600815  1
  Al  Al114  1  0.408958  0.716009  0.601353  1
  Al  Al115  1  0.775371  0.775611  0.584557  1
  Al  Al116  1  0.709974  0.983372  0.620316  1
  Al  Al117  1  0.043631  0.654514  0.619026  1
  Al  Al118  1  0.861105  0.119925  0.628357  1
  Al  Al119  1  0.291070  0.971220  0.576443  1
  Al  Al120  1  0.227713  0.184475  0.610662  1
  Al  Al121  1  0.594375  0.243367  0.593644  1
  Al  Al122  1  0.925064  0.913812  0.592612  1
  Al  Al123  1  0.258103  0.581722  0.592454  1
  Al  Al124  1  0.624018  0.638775  0.575845  1
  Al  Al125  1  0.557024  0.855859  0.608807  1
  Al  Al126  1  0.894385  0.517535  0.610425  1
  Al  Al127  1  0.009413  0.263095  0.636566  1
  Al  Al128  1  0.342242  0.928853  0.636665  1
  Al  Al129  1  0.289393  0.160755  0.668053  1
  Al  Al130  1  0.646930  0.207917  0.652283  1
  Al  Al131  1  -0.016930  0.871310  0.652210  1
  Al  Al132  1  0.315611  0.541600  0.651424  1
  Al  Al133  1  0.676808  0.597388  0.635275  1
  Al  Al134  1  0.620028  0.832357  0.665043  1
  Al  Al135  1  -0.037939  0.492485  0.668672  1
  Al  Al136  1  0.782303  0.967610  0.676474  1
  Al  Al137  1  0.193084  0.788973  0.628631  1
  Al  Al138  1  0.129738  1.020665  0.658383  1
  Al  Al139  1  0.492276  1.073010  0.643613  1
  Al  Al140  1  0.830731  0.732553  0.644456  1
  Al  Al141  1  0.162979  0.403649  0.643464  1
  Al  Al142  1  0.528028  0.455817  0.629187  1
  Al  Al143  1  0.468989  0.687205  0.659217  1
  Al  Al144  1  0.798817  0.349257  0.657552  1
  Al  Al145  1  0.936396  0.102016  0.687344  1
  Al  Al146  1  0.270018  0.772801  0.685389  1
  Al  Al147  1  0.220688  1.019370  0.708178  1
  Al  Al148  1  0.574853  1.070744  0.700255  1
  Al  Al149  1  0.917787  0.727370  0.700322  1
  Al  Al150  1  0.245597  0.393186  0.698245  1
  Al  Al151  1  0.605892  0.437923  0.687119  1
  Al  Al152  1  0.558705  0.689454  0.710204  1
  Al  Al153  1  0.885033  0.353950  0.708295  1
  Al  Al154  1  0.712232  0.832319  0.714944  1
  Al  Al155  1  0.116693  0.627021  0.679428  1
  Al  Al156  1  0.069768  0.873152  0.705087  1
  Al  Al157  1  0.426318  0.929028  0.694070  1
  Al  Al158  1  0.758002  0.588151  0.690371  1
  Al  Al159  1  0.089933  0.260436  0.694257  1
  Al  Al160  1  0.445279  0.297652  0.678616  1
  Al  Al161  1  0.402465  0.542998  0.703663  1
  Al  Al162  1  0.735942  0.202886  0.705522  1
