# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.06414958
_cell_length_b   10.01295644
_cell_length_c   46.97036853
_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   4709.56694312
_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  0.031937  0.395017  0.323257  1
  Al  Al2  1  0.360284  0.073597  0.324545  1
  Al  Al3  1  0.427786  0.483850  0.279136  1
  Al  Al4  1  0.713002  0.724286  0.330986  1
  Al  Al5  1  0.777060  0.136511  0.290935  1
  Al  Al6  1  0.745675  0.423422  0.307870  1
  Al  Al7  1  0.099677  0.826744  0.282010  1
  Al  Al8  1  0.063916  0.107970  0.303512  1
  Al  Al9  1  0.381163  0.769386  0.297536  1
  Al  Al10  1  0.863780  0.207764  0.343107  1
  Al  Al11  1  0.291019  0.009548  0.272134  1
  Al  Al12  1  0.253630  0.288020  0.290038  1
  Al  Al13  1  0.632419  0.654855  0.279004  1
  Al  Al14  1  0.585386  0.938482  0.294844  1
  Al  Al15  1  0.535138  0.253231  0.308699  1
  Al  Al16  1  0.918201  0.632200  0.295317  1
  Al  Al17  1  0.889867  0.913039  0.319057  1
  Al  Al18  1  0.202624  0.586985  0.310451  1
  Al  Al19  1  0.948464  0.281879  0.396427  1
  Al  Al20  1  0.268199  0.961465  0.388130  1
  Al  Al21  1  0.327231  0.372747  0.342639  1
  Al  Al22  1  0.592434  0.630515  0.383644  1
  Al  Al23  1  0.659389  0.034498  0.345809  1
  Al  Al24  1  0.622797  0.333184  0.361957  1
  Al  Al25  1  0.006917  0.692593  0.349293  1
  Al  Al26  1  0.980602  0.988738  0.373252  1
  Al  Al27  1  0.293981  0.660985  0.364826  1
  Al  Al28  1  0.745116  0.109339  0.398244  1
  Al  Al29  1  0.180275  0.886420  0.334955  1
  Al  Al30  1  0.149207  0.184975  0.357697  1
  Al  Al31  1  0.508391  0.556727  0.330668  1
  Al  Al32  1  0.471598  0.845389  0.350911  1
  Al  Al33  1  0.440556  0.157223  0.376372  1
  Al  Al34  1  0.832560  0.498445  0.361719  1
  Al  Al35  1  0.793760  0.807925  0.382112  1
  Al  Al36  1  0.119728  0.469544  0.378862  1
  Al  Al37  1  0.829465  0.184849  0.450658  1
  Al  Al38  1  0.183085  0.841421  0.457897  1
  Al  Al39  1  0.235173  0.257046  0.412323  1
  Al  Al40  1  0.499023  0.520658  0.450674  1
  Al  Al41  1  0.554565  0.927962  0.404019  1
  Al  Al42  1  0.526915  0.228457  0.429425  1
  Al  Al43  1  0.914453  0.580222  0.415138  1
  Al  Al44  1  0.877403  0.881536  0.434179  1
  Al  Al45  1  0.207812  0.545815  0.433506  1
  Al  Al46  1  0.641452  1.002083  0.457669  1
  Al  Al47  1  0.096074  0.767369  0.403298  1
  Al  Al48  1  0.067275  0.061859  0.427372  1
  Al  Al49  1  0.412722  0.445070  0.396748  1
  Al  Al50  1  0.382037  0.738396  0.419122  1
  Al  Al51  1  0.353804  0.034090  0.442204  1
  Al  Al52  1  0.707724  0.408976  0.415678  1
  Al  Al53  1  0.673598  0.710201  0.436426  1
  Al  Al54  1  0.032103  0.359359  0.449450  1
  Al  Al55  1  0.727828  0.077855  0.511495  1
  Al  Al56  1  0.084208  0.734383  0.521473  1
  Al  Al57  1  0.152935  0.137946  0.481099  1
  Al  Al58  1  0.411650  0.403866  0.519813  1
  Al  Al59  1  0.467963  0.813822  0.473742  1
  Al  Al60  1  0.441540  0.108280  0.495996  1
  Al  Al61  1  0.791320  0.488599  0.468817  1
  Al  Al62  1  0.758487  0.784740  0.489749  1
  Al  Al63  1  0.118311  0.433077  0.502318  1
  Al  Al64  1  0.555031  0.888669  0.528173  1
  Al  Al65  1  0.999568  0.656431  0.468494  1
  Al  Al66  1  0.959306  0.958666  0.486263  1
  Al  Al67  1  0.323640  0.330718  0.466044  1
  Al  Al68  1  0.295149  0.619889  0.487945  1
  Al  Al69  1  0.269958  0.918629  0.512640  1
  Al  Al70  1  0.614206  0.303123  0.482630  1
  Al  Al71  1  0.585153  0.595562  0.504822  1
  Al  Al72  1  0.912234  0.262880  0.502856  1
  Al  Al73  1  0.641770  0.964669  0.582553  1
  Al  Al74  1  0.964502  0.640587  0.575530  1
  Al  Al75  1  0.039977  0.037700  0.538336  1
  Al  Al76  1  0.326521  0.286365  0.588246  1
  Al  Al77  1  0.381723  0.694266  0.542127  1
  Al  Al78  1  0.358585  0.995396  0.567459  1
  Al  Al79  1  0.701170  0.378199  0.536168  1
  Al  Al80  1  0.673734  0.669119  0.558928  1
  Al  Al81  1  0.996849  0.338205  0.555142  1
  Al  Al82  1  0.470043  0.768140  0.595711  1
  Al  Al83  1  0.878125  0.564368  0.522082  1
  Al  Al84  1  0.843592  0.860014  0.543164  1
  Al  Al85  1  0.240062  0.211801  0.534738  1
  Al  Al86  1  0.203097  0.507594  0.554859  1
  Al  Al87  1  0.168061  0.814552  0.574182  1
  Al  Al88  1  0.529061  0.182983  0.549839  1
  Al  Al89  1  0.499759  0.477279  0.573764  1
  Al  Al90  1  0.813783  0.154806  0.565506  1
  Al  Al91  1  0.554771  0.838560  0.649344  1
  Al  Al92  1  0.877621  0.527515  0.643645  1
  Al  Al93  1  0.928013  0.936777  0.596398  1
  Al  Al94  1  0.204528  0.193538  0.643023  1
  Al  Al95  1  0.286464  0.584963  0.606826  1
  Al  Al96  1  0.256506  0.891086  0.627068  1
  Al  Al97  1  0.616123  0.255855  0.603869  1
  Al  Al98  1  0.588417  0.553826  0.627751  1
  Al  Al99  1  0.902112  0.227822  0.619994  1
  Al  Al100  1  0.368937  0.657965  0.658993  1
  Al  Al101  1  0.789088  0.450739  0.590056  1
  Al  Al102  1  0.762250  0.745673  0.613197  1
  Al  Al103  1  0.123238  0.114182  0.590615  1
  Al  Al104  1  0.080944  0.413229  0.607365  1
  Al  Al105  1  0.051665  0.720603  0.628873  1
  Al  Al106  1  0.446397  0.072987  0.622541  1
  Al  Al107  1  0.411337  0.365127  0.641402  1
  Al  Al108  1  0.727802  0.035786  0.637417  1
  Al  Al109  1  0.441237  0.746913  0.709272  1
  Al  Al110  1  0.777997  0.392862  0.709795  1
  Al  Al111  1  0.855235  0.816574  0.668244  1
  Al  Al112  1  0.103864  0.077029  0.701459  1
  Al  Al113  1  0.164102  0.493570  0.658980  1
  Al  Al114  1  0.141541  0.795877  0.682990  1
  Al  Al115  1  0.534347  0.161510  0.676929  1
  Al  Al116  1  0.498543  0.446871  0.694051  1
  Al  Al117  1  0.821127  0.110490  0.689985  1
  Al  Al118  1  0.247855  0.563080  0.711358  1
  Al  Al119  1  0.705622  0.333393  0.656609  1
  Al  Al120  1  0.678751  0.629736  0.682383  1
  Al  Al121  1  0.017081  0.008358  0.649289  1
  Al  Al122  1  0.990030  0.306424  0.674805  1
  Al  Al123  1  0.966221  0.583744  0.697597  1
  Al  Al124  1  0.344646  0.981269  0.678788  1
  Al  Al125  1  0.278185  0.284967  0.694752  1
  Al  Al126  1  0.637004  0.919332  0.700712  1
