# generated using pymatgen
data_AlSi216
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.40618400
_cell_length_b   16.40618400
_cell_length_c   16.40618400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlSi216
_chemical_formula_sum   'Al1 Si216'
_cell_volume   4415.93562766
_cell_formula_units_Z   1
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  0.083217  0.250119  0.083448  1
  Si  Si2  1  0.252208  0.250240  0.083569  1
  Si  Si3  1  0.250033  0.250394  0.417351  1
  Si  Si4  1  0.249975  0.250053  0.749775  1
  Si  Si5  1  0.250036  0.584021  0.083721  1
  Si  Si6  1  0.250205  0.584203  0.417540  1
  Si  Si7  1  0.249800  0.583662  0.750157  1
  Si  Si8  1  0.249989  0.916448  0.083400  1
  Si  Si9  1  0.249801  0.916822  0.416986  1
  Si  Si10  1  0.250111  0.916081  0.749399  1
  Si  Si11  1  0.583140  0.250196  0.083521  1
  Si  Si12  1  0.583118  0.250110  0.417074  1
  Si  Si13  1  0.583043  0.250202  0.750084  1
  Si  Si14  1  0.583117  0.583741  0.083436  1
  Si  Si15  1  0.583272  0.583585  0.416899  1
  Si  Si16  1  0.583036  0.583603  0.750079  1
  Si  Si17  1  0.583054  0.916759  0.083525  1
  Si  Si18  1  0.583037  0.916734  0.416940  1
  Si  Si19  1  0.583194  0.916848  0.750182  1
  Si  Si20  1  0.914101  0.250180  0.083511  1
  Si  Si21  1  0.916276  0.249976  0.417305  1
  Si  Si22  1  0.916273  0.250378  0.749676  1
  Si  Si23  1  0.916286  0.583959  0.083317  1
  Si  Si24  1  0.916479  0.583624  0.416957  1
  Si  Si25  1  0.916170  0.584267  0.749338  1
  Si  Si26  1  0.916277  0.916346  0.083710  1
  Si  Si27  1  0.916167  0.915993  0.417602  1
  Si  Si28  1  0.916389  0.916793  0.750158  1
  Si  Si29  1  0.998979  0.999221  0.999461  1
  Si  Si30  1  0.000140  0.998543  0.335106  1
  Si  Si31  1  0.999672  0.000011  0.666845  1
  Si  Si32  1  0.995359  0.337977  0.995769  1
  Si  Si33  1  0.999072  0.334254  0.334543  1
  Si  Si34  1  0.999775  0.333560  0.666622  1
  Si  Si35  1  0.999749  0.667067  0.000132  1
  Si  Si36  1  0.999786  0.666956  0.333759  1
  Si  Si37  1  0.999913  0.667229  0.666542  1
  Si  Si38  1  0.334708  0.998633  0.000492  1
  Si  Si39  1  0.333405  0.999926  0.333865  1
  Si  Si40  1  0.333206  0.000139  0.666708  1
  Si  Si41  1  0.334109  0.334360  0.999462  1
  Si  Si42  1  0.334789  0.333193  0.335101  1
  Si  Si43  1  0.333302  0.333651  0.666822  1
  Si  Si44  1  0.333300  0.667038  0.000091  1
  Si  Si45  1  0.333325  0.667033  0.333610  1
  Si  Si46  1  0.333191  0.666888  0.666827  1
  Si  Si47  1  0.666300  0.000040  0.000092  1
  Si  Si48  1  0.666301  0.000001  0.333614  1
  Si  Si49  1  0.666442  0.000139  0.666817  1
  Si  Si50  1  0.666267  0.333587  0.000122  1
  Si  Si51  1  0.666373  0.333549  0.333758  1
  Si  Si52  1  0.666099  0.333430  0.666533  1
  Si  Si53  1  0.666205  0.667128  0.000108  1
  Si  Si54  1  0.666419  0.666916  0.333517  1
  Si  Si55  1  0.666487  0.666839  0.666808  1
  Si  Si56  1  0.250098  0.083239  0.250605  1
  Si  Si57  1  0.249809  0.083525  0.583592  1
  Si  Si58  1  0.254550  0.078788  0.912115  1
  Si  Si59  1  0.254664  0.421564  0.254897  1
  Si  Si60  1  0.249918  0.416986  0.583607  1
  Si  Si61  1  0.250092  0.417275  0.916567  1
  Si  Si62  1  0.249929  0.750284  0.250311  1
  Si  Si63  1  0.249863  0.750157  0.583486  1
  Si  Si64  1  0.249803  0.750259  0.916860  1
  Si  Si65  1  0.583066  0.083421  0.250320  1
  Si  Si66  1  0.583176  0.083472  0.583475  1
  Si  Si67  1  0.583073  0.083526  0.916860  1
  Si  Si68  1  0.583311  0.416925  0.250247  1
  Si  Si69  1  0.583144  0.416827  0.583521  1
  Si  Si70  1  0.583048  0.416978  0.916738  1
  Si  Si71  1  0.583149  0.750189  0.250150  1
  Si  Si72  1  0.583128  0.750190  0.583541  1
  Si  Si73  1  0.583178  0.750161  0.916802  1
  Si  Si74  1  0.911775  0.078670  0.254895  1
  Si  Si75  1  0.916355  0.083405  0.583616  1
  Si  Si76  1  0.916057  0.083237  0.916569  1
  Si  Si77  1  0.916187  0.417145  0.250494  1
  Si  Si78  1  0.916418  0.416921  0.583354  1
  Si  Si79  1  0.911764  0.421557  0.912002  1
  Si  Si80  1  0.916408  0.750017  0.250248  1
  Si  Si81  1  0.916513  0.750179  0.583529  1
  Si  Si82  1  0.916354  0.750273  0.916749  1
  Si  Si83  1  0.995362  0.162433  0.171305  1
  Si  Si84  1  0.999749  0.166790  0.500406  1
  Si  Si85  1  0.998975  0.166134  0.832556  1
  Si  Si86  1  0.999075  0.501194  0.167606  1
  Si  Si87  1  0.999793  0.500437  0.500292  1
  Si  Si88  1  0.000135  0.501763  0.831887  1
  Si  Si89  1  0.999768  0.833287  0.166898  1
  Si  Si90  1  0.999902  0.833194  0.500568  1
  Si  Si91  1  0.999688  0.833491  0.833366  1
  Si  Si92  1  0.334118  0.166130  0.167687  1
  Si  Si93  1  0.333295  0.166759  0.500368  1
  Si  Si94  1  0.334709  0.167163  0.831956  1
  Si  Si95  1  0.334785  0.501773  0.166528  1
  Si  Si96  1  0.333329  0.500275  0.500364  1
  Si  Si97  1  0.333405  0.500539  0.833261  1
  Si  Si98  1  0.333326  0.833513  0.166998  1
  Si  Si99  1  0.333196  0.833495  0.500221  1
  Si  Si100  1  0.333193  0.833375  0.833463  1
  Si  Si101  1  0.666266  0.166802  0.166922  1
  Si  Si102  1  0.666214  0.166783  0.500452  1
  Si  Si103  1  0.666293  0.166756  0.833365  1
  Si  Si104  1  0.666379  0.500433  0.166870  1
  Si  Si105  1  0.666413  0.500200  0.500246  1
  Si  Si106  1  0.666298  0.500274  0.833341  1
  Si  Si107  1  0.666104  0.833203  0.166752  1
  Si  Si108  1  0.666484  0.833464  0.500187  1
  Si  Si109  1  0.666450  0.833495  0.833472  1
  Si  Si110  1  0.083157  0.250178  0.252567  1
  Si  Si111  1  0.083144  0.250193  0.583527  1
  Si  Si112  1  0.083094  0.250241  0.914461  1
  Si  Si113  1  0.083355  0.583968  0.250385  1
  Si  Si114  1  0.083228  0.583742  0.583551  1
  Si  Si115  1  0.082942  0.584019  0.916631  1
  Si  Si116  1  0.082958  0.916345  0.250391  1
  Si  Si117  1  0.083132  0.916755  0.583613  1
  Si  Si118  1  0.083286  0.916446  0.916695  1
  Si  Si119  1  0.416992  0.250377  0.250392  1
  Si  Si120  1  0.416578  0.250195  0.583616  1
  Si  Si121  1  0.416884  0.250072  0.916680  1
  Si  Si122  1  0.417334  0.584267  0.250502  1
  Si  Si123  1  0.416589  0.583605  0.583632  1
  Si  Si124  1  0.416512  0.583657  0.916867  1
  Si  Si125  1  0.416546  0.916825  0.250279  1
  Si  Si126  1  0.416491  0.916843  0.583479  1
  Si  Si127  1  0.417253  0.916068  0.916557  1
  Si  Si128  1  0.749370  0.249985  0.250387  1
  Si  Si129  1  0.749592  0.250107  0.583552  1
  Si  Si130  1  0.749314  0.250384  0.916629  1
  Si  Si131  1  0.749713  0.583615  0.250186  1
  Si  Si132  1  0.749756  0.583571  0.583390  1
  Si  Si133  1  0.749125  0.584201  0.916460  1
  Si  Si134  1  0.749063  0.916001  0.250492  1
  Si  Si135  1  0.749730  0.916733  0.583632  1
  Si  Si136  1  0.749679  0.916821  0.916867  1
  Si  Si137  1  0.167206  0.999223  0.167688  1
  Si  Si138  1  0.166575  0.000037  0.500368  1
  Si  Si139  1  0.166175  0.998632  0.831958  1
  Si  Si140  1  0.170901  0.337975  0.171308  1
  Si  Si141  1  0.166537  0.333589  0.500401  1
  Si  Si142  1  0.167202  0.334353  0.832549  1
  Si  Si143  1  0.166543  0.667074  0.166917  1
  Si  Si144  1  0.166555  0.667126  0.500457  1
  Si  Si145  1  0.166575  0.667038  0.833370  1
  Si  Si146  1  0.499849  0.000032  0.166986  1
  Si  Si147  1  0.499839  0.000134  0.500218  1
  Si  Si148  1  0.499958  0.000127  0.833474  1
  Si  Si149  1  0.500044  0.333562  0.166893  1
  Si  Si150  1  0.500136  0.333425  0.500569  1
  Si  Si151  1  0.499818  0.333664  0.833343  1
  Si  Si152  1  0.500133  0.667233  0.166760  1
  Si  Si153  1  0.499854  0.666846  0.500180  1
  Si  Si154  1  0.499842  0.666887  0.833478  1
  Si  Si155  1  0.831563  0.998547  0.166526  1
  Si  Si156  1  0.833059  0.000001  0.500369  1
  Si  Si157  1  0.832798  0.999925  0.833260  1
  Si  Si158  1  0.832136  0.334263  0.167598  1
  Si  Si159  1  0.832901  0.333545  0.500295  1
  Si  Si160  1  0.831560  0.333190  0.831879  1
  Si  Si161  1  0.832898  0.666946  0.166873  1
  Si  Si162  1  0.833135  0.666919  0.500249  1
  Si  Si163  1  0.833055  0.667033  0.833341  1
  Si  Si164  1  0.083099  0.081126  0.083566  1
  Si  Si165  1  0.082945  0.083300  0.417352  1
  Si  Si166  1  0.083264  0.083360  0.749780  1
  Si  Si167  1  0.083157  0.419235  0.083512  1
  Si  Si168  1  0.083350  0.417057  0.417300  1
  Si  Si169  1  0.082954  0.417059  0.749677  1
  Si  Si170  1  0.083141  0.750198  0.083528  1
  Si  Si171  1  0.083223  0.750214  0.417073  1
  Si  Si172  1  0.083143  0.750288  0.750088  1
  Si  Si173  1  0.416894  0.083362  0.083386  1
  Si  Si174  1  0.416506  0.083529  0.416989  1
  Si  Si175  1  0.417264  0.083217  0.749411  1
  Si  Si176  1  0.416987  0.417058  0.083713  1
  Si  Si177  1  0.417335  0.417159  0.417604  1
  Si  Si178  1  0.416504  0.416946  0.750131  1
  Si  Si179  1  0.416580  0.750287  0.083532  1
  Si  Si180  1  0.416591  0.750298  0.416936  1
  Si  Si181  1  0.416480  0.750139  0.750186  1
  Si  Si182  1  0.749314  0.083301  0.083727  1
  Si  Si183  1  0.749132  0.083125  0.417540  1
  Si  Si184  1  0.749674  0.083530  0.750154  1
  Si  Si185  1  0.749372  0.417051  0.083313  1
  Si  Si186  1  0.749706  0.416852  0.416960  1
  Si  Si187  1  0.749066  0.417164  0.749332  1
  Si  Si188  1  0.749593  0.750211  0.083436  1
  Si  Si189  1  0.749750  0.750062  0.416902  1
  Si  Si190  1  0.749726  0.750293  0.750074  1
  Si  Si191  1  0.170915  0.162421  0.995752  1
  Si  Si192  1  0.167221  0.166114  0.334616  1
  Si  Si193  1  0.166469  0.166859  0.666773  1
  Si  Si194  1  0.167220  0.501286  0.999445  1
  Si  Si195  1  0.166228  0.501688  0.335021  1
  Si  Si196  1  0.166603  0.500412  0.666787  1
  Si  Si197  1  0.166476  0.833443  0.000204  1
  Si  Si198  1  0.166597  0.833450  0.333744  1
  Si  Si199  1  0.166461  0.833144  0.666468  1
  Si  Si200  1  0.499894  0.166870  0.000191  1
  Si  Si201  1  0.499881  0.166734  0.333750  1
  Si  Si202  1  0.500195  0.166868  0.666473  1
  Si  Si203  1  0.499881  0.500409  0.000069  1
  Si  Si204  1  0.500102  0.500251  0.333588  1
  Si  Si205  1  0.499877  0.500192  0.666793  1
  Si  Si206  1  0.500193  0.833142  0.000207  1
  Si  Si207  1  0.499885  0.833446  0.333521  1
  Si  Si208  1  0.499802  0.833524  0.666875  1
  Si  Si209  1  0.832049  0.166113  0.999448  1
  Si  Si210  1  0.831647  0.167104  0.335019  1
  Si  Si211  1  0.832923  0.166733  0.666786  1
  Si  Si212  1  0.831646  0.501685  0.000442  1
  Si  Si213  1  0.832855  0.500472  0.333821  1
  Si  Si214  1  0.833081  0.500253  0.666564  1
  Si  Si215  1  0.832924  0.833451  0.000069  1
  Si  Si216  1  0.833077  0.833228  0.333583  1
  Si  Si217  1  0.833142  0.833445  0.666792  1