# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.45373420
_cell_length_b   14.45272563
_cell_length_c   47.25819492
_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   Al252
_cell_volume   9393.10796781
_cell_formula_units_Z   252
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  0.796998  0.131642  0.286292  1
  Al  Al2  1  0.130331  0.798308  0.286292  1
  Al  Al3  1  0.052428  0.053721  0.324903  1
  Al  Al4  1  0.424312  0.092276  0.304880  1
  Al  Al5  1  0.757646  0.758943  0.304880  1
  Al  Al6  1  0.090979  0.425609  0.304880  1
  Al  Al7  1  0.463665  0.464975  0.286292  1
  Al  Al8  1  0.385761  0.720388  0.324903  1
  Al  Al9  1  0.719094  0.387054  0.324903  1
  Al  Al10  1  0.885761  0.220388  0.324903  1
  Al  Al11  1  0.219094  0.887054  0.324903  1
  Al  Al12  1  0.257646  0.258943  0.304880  1
  Al  Al13  1  0.630331  0.298308  0.286292  1
  Al  Al14  1  0.963665  0.964975  0.286292  1
  Al  Al15  1  0.296998  0.631642  0.286292  1
  Al  Al16  1  0.552428  0.553721  0.324903  1
  Al  Al17  1  0.590979  0.925609  0.304880  1
  Al  Al18  1  0.924312  0.592276  0.304880  1
  Al  Al19  1  0.698869  0.200169  0.337134  1
  Al  Al20  1  0.032203  0.866835  0.337134  1
  Al  Al21  1  0.070960  0.238923  0.314442  1
  Al  Al22  1  0.443904  0.278538  0.294934  1
  Al  Al23  1  0.777238  0.945205  0.294934  1
  Al  Al24  1  0.110571  0.611872  0.294934  1
  Al  Al25  1  0.365536  0.533502  0.337134  1
  Al  Al26  1  0.404293  0.905590  0.314442  1
  Al  Al27  1  0.737627  0.572256  0.314442  1
  Al  Al28  1  0.865536  0.033502  0.337134  1
  Al  Al29  1  0.198869  0.700169  0.337134  1
  Al  Al30  1  0.237627  0.072256  0.314442  1
  Al  Al31  1  0.610571  0.111872  0.294934  1
  Al  Al32  1  0.943904  0.778538  0.294934  1
  Al  Al33  1  0.277238  0.445205  0.294934  1
  Al  Al34  1  0.532203  0.366835  0.337134  1
  Al  Al35  1  0.570960  0.738923  0.314442  1
  Al  Al36  1  0.904293  0.405590  0.314442  1
  Al  Al37  1  0.679350  0.013979  0.346666  1
  Al  Al38  1  0.012684  0.680646  0.346666  1
  Al  Al39  1  0.934680  0.935972  0.388507  1
  Al  Al40  1  0.307433  0.975391  0.367003  1
  Al  Al41  1  0.640766  0.642058  0.367003  1
  Al  Al42  1  0.974100  0.308725  0.367003  1
  Al  Al43  1  0.346017  0.347313  0.346666  1
  Al  Al44  1  0.268013  0.602639  0.388507  1
  Al  Al45  1  0.601346  0.269305  0.388507  1
  Al  Al46  1  0.768013  0.102639  0.388507  1
  Al  Al47  1  0.101346  0.769305  0.388507  1
  Al  Al48  1  0.140766  0.142058  0.367003  1
  Al  Al49  1  0.512684  0.180646  0.346666  1
  Al  Al50  1  0.846017  0.847313  0.346666  1
  Al  Al51  1  0.179350  0.513979  0.346666  1
  Al  Al52  1  0.434680  0.435972  0.388507  1
  Al  Al53  1  0.474100  0.808725  0.367003  1
  Al  Al54  1  0.807433  0.475391  0.367003  1
  Al  Al55  1  0.581440  0.082730  0.398620  1
  Al  Al56  1  0.914773  0.749397  0.398620  1
  Al  Al57  1  0.954697  0.122654  0.377502  1
  Al  Al58  1  0.326436  0.161062  0.356703  1
  Al  Al59  1  0.659769  0.827729  0.356703  1
  Al  Al60  1  0.993102  0.494396  0.356703  1
  Al  Al61  1  0.248107  0.416064  0.398620  1
  Al  Al62  1  0.288030  0.789321  0.377502  1
  Al  Al63  1  0.621363  0.455987  0.377502  1
  Al  Al64  1  0.748107  0.916064  0.398620  1
  Al  Al65  1  0.081440  0.582730  0.398620  1
  Al  Al66  1  0.121363  0.955987  0.377502  1
  Al  Al67  1  0.493102  0.994396  0.356703  1
  Al  Al68  1  0.826436  0.661062  0.356703  1
  Al  Al69  1  0.159769  0.327729  0.356703  1
  Al  Al70  1  0.414773  0.249397  0.398620  1
  Al  Al71  1  0.454697  0.622654  0.377502  1
  Al  Al72  1  0.788030  0.289321  0.377502  1
  Al  Al73  1  0.561860  0.896483  0.408884  1
  Al  Al74  1  0.895194  0.563149  0.408884  1
  Al  Al75  1  0.816622  0.817907  0.450753  1
  Al  Al76  1  0.189460  0.857413  0.429864  1
  Al  Al77  1  0.522793  0.524080  0.429864  1
  Al  Al78  1  0.856126  0.190747  0.429864  1
  Al  Al79  1  0.228527  0.229816  0.408884  1
  Al  Al80  1  0.149955  0.484574  0.450753  1
  Al  Al81  1  0.483289  0.151241  0.450753  1
  Al  Al82  1  0.649955  0.984574  0.450753  1
  Al  Al83  1  0.983289  0.651241  0.450753  1
  Al  Al84  1  0.022793  0.024080  0.429864  1
  Al  Al85  1  0.395194  0.063149  0.408884  1
  Al  Al86  1  0.728527  0.729816  0.408884  1
  Al  Al87  1  0.061860  0.396483  0.408884  1
  Al  Al88  1  0.316622  0.317907  0.450753  1
  Al  Al89  1  0.356126  0.690747  0.429864  1
  Al  Al90  1  0.689460  0.357413  0.429864  1
  Al  Al91  1  0.463644  0.964928  0.461116  1
  Al  Al92  1  0.796977  0.631595  0.461116  1
  Al  Al93  1  0.836348  0.004302  0.440462  1
  Al  Al94  1  0.208992  0.043612  0.419290  1
  Al  Al95  1  0.542325  0.710279  0.419290  1
  Al  Al96  1  0.875658  0.376946  0.419290  1
  Al  Al97  1  0.130311  0.298262  0.461116  1
  Al  Al98  1  0.169682  0.670968  0.440462  1
  Al  Al99  1  0.503015  0.337635  0.440462  1
  Al  Al100  1  0.630311  0.798262  0.461116  1
  Al  Al101  1  0.963644  0.464928  0.461116  1
  Al  Al102  1  0.003015  0.837635  0.440462  1
  Al  Al103  1  0.375658  0.876946  0.419290  1
  Al  Al104  1  0.708992  0.543612  0.419290  1
  Al  Al105  1  0.042325  0.210279  0.419290  1
  Al  Al106  1  0.296977  0.131595  0.461116  1
  Al  Al107  1  0.336348  0.504302  0.440462  1
  Al  Al108  1  0.669682  0.170968  0.440462  1
  Al  Al109  1  0.444064  0.778680  0.471589  1
  Al  Al110  1  0.777397  0.445347  0.471589  1
  Al  Al111  1  0.698720  0.699999  0.513342  1
  Al  Al112  1  0.071444  0.739392  0.492562  1
  Al  Al113  1  0.404777  0.406059  0.492562  1
  Al  Al114  1  0.738111  0.072726  0.492562  1
  Al  Al115  1  0.110730  0.112013  0.471589  1
  Al  Al116  1  0.032053  0.366666  0.513342  1
  Al  Al117  1  0.365386  0.033333  0.513342  1
  Al  Al118  1  0.532053  0.866666  0.513342  1
  Al  Al119  1  0.865386  0.533333  0.513342  1
  Al  Al120  1  0.904777  0.906059  0.492562  1
  Al  Al121  1  0.277397  0.945347  0.471589  1
  Al  Al122  1  0.610730  0.612013  0.471589  1
  Al  Al123  1  0.944064  0.278680  0.471589  1
  Al  Al124  1  0.198720  0.199999  0.513342  1
  Al  Al125  1  0.238111  0.572726  0.492562  1
  Al  Al126  1  0.571444  0.239392  0.492562  1
  Al  Al127  1  0.345786  0.847065  0.523864  1
  Al  Al128  1  0.679120  0.513732  0.523864  1
  Al  Al129  1  0.718406  0.886353  0.502891  1
  Al  Al130  1  0.091130  0.925746  0.482110  1
  Al  Al131  1  0.424464  0.592413  0.482110  1
  Al  Al132  1  0.757797  0.259079  0.482110  1
  Al  Al133  1  0.012453  0.180399  0.523864  1
  Al  Al134  1  0.051739  0.553020  0.502891  1
  Al  Al135  1  0.385073  0.219686  0.502891  1
  Al  Al136  1  0.512453  0.680399  0.523864  1
  Al  Al137  1  0.845786  0.347065  0.523864  1
  Al  Al138  1  0.885073  0.719686  0.502891  1
  Al  Al139  1  0.257797  0.759079  0.482110  1
  Al  Al140  1  0.591130  0.425746  0.482110  1
  Al  Al141  1  0.924464  0.092413  0.482110  1
  Al  Al142  1  0.179120  0.013732  0.523864  1
  Al  Al143  1  0.218406  0.386353  0.502891  1
  Al  Al144  1  0.551739  0.053020  0.502891  1
  Al  Al145  1  0.326206  0.660817  0.534336  1
  Al  Al146  1  0.659539  0.327484  0.534336  1
  Al  Al147  1  0.580859  0.582133  0.576163  1
  Al  Al148  1  0.953502  0.621444  0.554991  1
  Al  Al149  1  0.286835  0.288110  0.554991  1
  Al  Al150  1  0.620168  0.954777  0.554991  1
  Al  Al151  1  0.992873  0.994150  0.534336  1
  Al  Al152  1  0.914192  0.248800  0.576163  1
  Al  Al153  1  0.247525  0.915466  0.576163  1
  Al  Al154  1  0.414192  0.748800  0.576163  1
  Al  Al155  1  0.747525  0.415466  0.576163  1
  Al  Al156  1  0.786835  0.788110  0.554991  1
  Al  Al157  1  0.159539  0.827484  0.534336  1
  Al  Al158  1  0.492873  0.494150  0.534336  1
  Al  Al159  1  0.826206  0.160817  0.534336  1
  Al  Al160  1  0.080859  0.082133  0.576163  1
  Al  Al161  1  0.120168  0.454777  0.554991  1
  Al  Al162  1  0.453502  0.121444  0.554991  1
  Al  Al163  1  0.227990  0.729263  0.586568  1
  Al  Al164  1  0.561323  0.395929  0.586568  1
  Al  Al165  1  0.600390  0.768332  0.565589  1
  Al  Al166  1  0.973228  0.807838  0.544699  1
  Al  Al167  1  0.306561  0.474505  0.544699  1
  Al  Al168  1  0.639895  0.141171  0.544699  1
  Al  Al169  1  0.894656  0.062596  0.586568  1
  Al  Al170  1  0.933724  0.434999  0.565589  1
  Al  Al171  1  0.267057  0.101665  0.565589  1
  Al  Al172  1  0.394656  0.562596  0.586568  1
  Al  Al173  1  0.727990  0.229263  0.586568  1
  Al  Al174  1  0.767057  0.601665  0.565589  1
  Al  Al175  1  0.139895  0.641171  0.544699  1
  Al  Al176  1  0.473228  0.307838  0.544699  1
  Al  Al177  1  0.806561  0.974505  0.544699  1
  Al  Al178  1  0.061323  0.895929  0.586568  1
  Al  Al179  1  0.100390  0.268332  0.565589  1
  Al  Al180  1  0.433724  0.934999  0.565589  1
  Al  Al181  1  0.208410  0.543015  0.596832  1
  Al  Al182  1  0.541743  0.209681  0.596832  1
  Al  Al183  1  0.463415  0.464683  0.638750  1
  Al  Al184  1  0.835154  0.503091  0.617951  1
  Al  Al185  1  0.168487  0.169758  0.617951  1
  Al  Al186  1  0.501820  0.836425  0.617951  1
  Al  Al187  1  0.875077  0.876348  0.596832  1
  Al  Al188  1  0.796748  0.131350  0.638750  1
  Al  Al189  1  0.130081  0.798016  0.638750  1
  Al  Al190  1  0.296748  0.631350  0.638750  1
  Al  Al191  1  0.630081  0.298016  0.638750  1
  Al  Al192  1  0.668487  0.669758  0.617951  1
  Al  Al193  1  0.041743  0.709681  0.596832  1
  Al  Al194  1  0.375077  0.376348  0.596832  1
  Al  Al195  1  0.708410  0.043015  0.596832  1
  Al  Al196  1  0.963415  0.964683  0.638750  1
  Al  Al197  1  1.001820  0.336425  0.617951  1
  Al  Al198  1  0.335154  1.003091  0.617951  1
  Al  Al199  1  0.110500  0.611766  0.648787  1
  Al  Al200  1  0.443833  0.278433  0.648787  1
  Al  Al201  1  0.482417  0.650354  0.628449  1
  Al  Al202  1  0.855170  0.689773  0.606945  1
  Al  Al203  1  0.188504  0.356440  0.606945  1
  Al  Al204  1  0.521837  0.023107  0.606945  1
  Al  Al205  1  0.777166  0.945099  0.648787  1
  Al  Al206  1  0.815750  0.317021  0.628449  1
  Al  Al207  1  0.149084  0.983687  0.628449  1
  Al  Al208  1  0.277166  0.445099  0.648787  1
  Al  Al209  1  0.610500  0.111766  0.648787  1
  Al  Al210  1  0.649084  0.483687  0.628449  1
  Al  Al211  1  0.021837  0.523107  0.606945  1
  Al  Al212  1  0.355170  0.189773  0.606945  1
  Al  Al213  1  0.688504  0.856440  0.606945  1
  Al  Al214  1  0.943833  0.778433  0.648787  1
  Al  Al215  1  0.982417  0.150354  0.628449  1
  Al  Al216  1  0.315750  0.817021  0.628449  1
  Al  Al217  1  0.090981  0.425577  0.658319  1
  Al  Al218  1  0.424314  0.092243  0.658319  1
  Al  Al219  1  0.345946  0.347207  0.700519  1
  Al  Al220  1  0.718890  0.386822  0.681011  1
  Al  Al221  1  0.052223  0.053489  0.681011  1
  Al  Al222  1  0.385557  0.720156  0.681011  1
  Al  Al223  1  0.757648  0.758910  0.658319  1
  Al  Al224  1  0.679279  0.013874  0.700519  1
  Al  Al225  1  0.012612  0.680540  0.700519  1
  Al  Al226  1  0.179279  0.513874  0.700519  1
  Al  Al227  1  0.512612  0.180540  0.700519  1
  Al  Al228  1  0.552223  0.553489  0.681011  1
  Al  Al229  1  0.924314  0.592243  0.658319  1
  Al  Al230  1  0.257648  0.258910  0.658319  1
  Al  Al231  1  0.590981  0.925577  0.658319  1
  Al  Al232  1  0.845946  0.847207  0.700519  1
  Al  Al233  1  0.885557  0.220156  0.681011  1
  Al  Al234  1  0.218890  0.886822  0.681011  1
  Al  Al235  1  0.992852  0.494103  0.709160  1
  Al  Al236  1  0.326186  0.160770  0.709160  1
  Al  Al237  1  0.365538  0.533469  0.690573  1
  Al  Al238  1  0.737423  0.572024  0.670549  1
  Al  Al239  1  0.070756  0.238691  0.670549  1
  Al  Al240  1  0.404089  0.905358  0.670549  1
  Al  Al241  1  0.659519  0.827437  0.709160  1
  Al  Al242  1  0.698871  0.200136  0.690573  1
  Al  Al243  1  0.032204  0.866803  0.690573  1
  Al  Al244  1  0.159519  0.327437  0.709160  1
  Al  Al245  1  0.492852  0.994103  0.709160  1
  Al  Al246  1  0.532204  0.366803  0.690573  1
  Al  Al247  1  0.904089  0.405358  0.670549  1
  Al  Al248  1  0.237423  0.072024  0.670549  1
  Al  Al249  1  0.570756  0.738691  0.670549  1
  Al  Al250  1  0.826186  0.660770  0.709160  1
  Al  Al251  1  0.865538  0.033469  0.690573  1
  Al  Al252  1  0.198871  0.700136  0.690573  1
