# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.89961973
_cell_length_b   9.43015630
_cell_length_c   46.07893709
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.26082953
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al126
_cell_volume   4712.48832529
_cell_formula_units_Z   126
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  0.876894  0.485241  0.325097  1
  Al  Al2  1  0.249485  0.133861  0.337051  1
  Al  Al3  1  0.311229  0.534775  0.307035  1
  Al  Al4  1  0.609047  0.796169  0.351216  1
  Al  Al5  1  0.641663  0.239599  0.301908  1
  Al  Al6  1  0.616526  0.509232  0.324902  1
  Al  Al7  1  0.942834  0.881191  0.294155  1
  Al  Al8  1  0.902291  0.185279  0.307902  1
  Al  Al9  1  0.250838  0.836586  0.317358  1
  Al  Al10  1  0.746910  0.288965  0.352606  1
  Al  Al11  1  0.123664  0.063991  0.289527  1
  Al  Al12  1  0.108384  0.350604  0.306208  1
  Al  Al13  1  0.481603  0.737577  0.303516  1
  Al  Al14  1  0.486065  1.020423  0.317633  1
  Al  Al15  1  0.447467  0.311056  0.337268  1
  Al  Al16  1  0.739940  0.729149  0.302538  1
  Al  Al17  1  0.744313  1.000694  0.325446  1
  Al  Al18  1  0.071090  0.645704  0.320539  1
  Al  Al19  1  0.860790  0.345691  0.405570  1
  Al  Al20  1  0.155418  1.035370  0.390353  1
  Al  Al21  1  0.216049  0.429975  0.356212  1
  Al  Al22  1  0.529340  0.675419  0.406573  1
  Al  Al23  1  0.588715  0.088526  0.369441  1
  Al  Al24  1  0.558584  0.380576  0.388556  1
  Al  Al25  1  0.874212  0.779333  0.351060  1
  Al  Al26  1  0.859607  0.062640  0.377811  1
  Al  Al27  1  0.181788  0.731402  0.369753  1
  Al  Al28  1  0.698721  0.146507  0.422869  1
  Al  Al29  1  0.042682  0.971535  0.341231  1
  Al  Al30  1  0.014843  0.261993  0.357383  1
  Al  Al31  1  0.418304  0.609325  0.356062  1
  Al  Al32  1  0.381994  0.906745  0.367588  1
  Al  Al33  1  0.355872  0.204492  0.389191  1
  Al  Al34  1  0.738200  0.569388  0.375989  1
  Al  Al35  1  0.724146  0.854701  0.402376  1
  Al  Al36  1  -0.004073  0.553201  0.378420  1
  Al  Al37  1  0.806858  0.207996  0.475534  1
  Al  Al38  1  0.101184  0.898961  0.460507  1
  Al  Al39  1  0.124840  0.329146  0.410244  1
  Al  Al40  1  0.431900  0.567154  0.459090  1
  Al  Al41  1  0.492823  0.973710  0.421888  1
  Al  Al42  1  0.463788  0.269931  0.441389  1
  Al  Al43  1  0.851045  0.627094  0.431106  1
  Al  Al44  1  0.834802  0.914351  0.455795  1
  Al  Al45  1  0.108931  0.616105  0.434165  1
  Al  Al46  1  0.601606  1.037707  0.475236  1
  Al  Al47  1  -0.012363  0.840190  0.405422  1
  Al  Al48  1  -0.019576  0.121141  0.432720  1
  Al  Al49  1  0.324514  0.499959  0.407606  1
  Al  Al50  1  0.289931  0.801497  0.422240  1
  Al  Al51  1  0.259396  0.099615  0.442323  1
  Al  Al52  1  0.667697  0.442579  0.441168  1
  Al  Al53  1  0.634839  0.741845  0.458059  1
  Al  Al54  1  -0.025885  0.402594  0.460277  1
  Al  Al55  1  0.710547  0.100680  0.527952  1
  Al  Al56  1  0.076135  0.747205  0.540248  1
  Al  Al57  1  0.097733  0.180260  0.488069  1
  Al  Al58  1  0.349690  0.452342  0.517746  1
  Al  Al59  1  0.397386  0.866791  0.475115  1
  Al  Al60  1  0.368175  0.162535  0.494830  1
  Al  Al61  1  0.774428  0.505660  0.493489  1
  Al  Al62  1  0.741457  0.805272  0.510178  1
  Al  Al63  1  0.089058  0.461625  0.514796  1
  Al  Al64  1  0.505318  0.931119  0.527735  1
  Al  Al65  1  0.963493  0.686511  0.486011  1
  Al  Al66  1  0.945180  0.975930  0.508873  1
  Al  Al67  1  0.236838  0.391413  0.463711  1
  Al  Al68  1  0.223874  0.676885  0.488986  1
  Al  Al69  1  0.216554  0.957700  0.515816  1
  Al  Al70  1  0.571578  0.333709  0.493629  1
  Al  Al71  1  0.538520  0.633578  0.510473  1
  Al  Al72  1  0.914532  0.271436  0.527901  1
  Al  Al73  1  0.612834  0.993523  0.580684  1
  Al  Al74  1  -0.011238  0.637256  0.596853  1
  Al  Al75  1  0.053659  1.038706  0.561371  1
  Al  Al76  1  0.327742  0.297138  0.598256  1
  Al  Al77  1  0.339088  0.736355  0.543907  1
  Al  Al78  1  0.334601  1.017581  0.571242  1
  Al  Al79  1  0.678671  0.397237  0.545959  1
  Al  Al80  1  0.644275  0.697321  0.562817  1
  Al  Al81  1  0.021657  0.335365  0.579919  1
  Al  Al82  1  0.451544  0.794723  0.599426  1
  Al  Al83  1  0.881348  0.570788  0.545123  1
  Al  Al84  1  0.848525  0.868236  0.562374  1
  Al  Al85  1  0.213230  0.238718  0.543157  1
  Al  Al86  1  0.203167  0.521372  0.569262  1
  Al  Al87  1  0.188066  0.810349  0.593959  1
  Al  Al88  1  0.479015  0.224837  0.547950  1
  Al  Al89  1  0.461788  0.511573  0.572546  1
  Al  Al90  1  0.818381  0.163281  0.580855  1
  Al  Al91  1  0.565882  0.850793  0.653888  1
  Al  Al92  1  0.895326  0.526531  0.649163  1
  Al  Al93  1  0.956068  0.934173  0.614399  1
  Al  Al94  1  0.269852  0.173994  0.663030  1
  Al  Al95  1  0.314521  0.581461  0.623927  1
  Al  Al96  1  0.297519  0.880011  0.647829  1
  Al  Al97  1  0.590297  0.285015  0.601772  1
  Al  Al98  1  0.576269  0.570352  0.627019  1
  Al  Al99  1  0.926530  0.230026  0.633817  1
  Al  Al100  1  0.428944  0.645600  0.675733  1
  Al  Al101  1  0.786321  0.461107  0.597869  1
  Al  Al102  1  0.753288  0.759844  0.615583  1
  Al  Al103  1  0.158164  0.104020  0.613497  1
  Al  Al104  1  0.126368  0.403569  0.631398  1
  Al  Al105  1  0.098175  0.707545  0.648263  1
  Al  Al106  1  0.455087  0.076724  0.626929  1
  Al  Al107  1  0.442308  0.360350  0.653431  1
  Al  Al108  1  0.722783  0.052331  0.634809  1
  Al  Al109  1  0.538496  0.710159  0.724439  1
  Al  Al110  1  0.823988  0.408738  0.703462  1
  Al  Al111  1  0.866661  0.827905  0.666551  1
  Al  Al112  1  0.189189  0.074266  0.713094  1
  Al  Al113  1  0.232307  0.482637  0.680646  1
  Al  Al114  1  0.214217  0.777423  0.699650  1
  Al  Al115  1  0.569245  0.140790  0.680417  1
  Al  Al116  1  0.566129  0.423603  0.704458  1
  Al  Al117  1  0.833677  0.124813  0.685683  1
  Al  Al118  1  0.349396  0.550649  0.728245  1
  Al  Al119  1  0.702746  0.346106  0.654398  1
  Al  Al120  1  0.695044  0.632143  0.679559  1
  Al  Al121  1  0.064375  1.002802  0.666165  1
  Al  Al122  1  0.047249  0.300415  0.684397  1
  Al  Al123  1  0.001515  0.605182  0.698238  1
  Al  Al124  1  0.414291  0.948494  0.698326  1
  Al  Al125  1  0.368158  0.265092  0.711131  1
  Al  Al126  1  0.682159  0.905400  0.703600  1
