# generated using pymatgen
data_InSi216
_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   InSi216
_chemical_formula_sum   'In1 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
  In  In1  1  0.083331  0.250002  0.083322  1
  Si  Si2  1  0.255700  0.249988  0.083365  1
  Si  Si3  1  0.250603  0.250110  0.417553  1
  Si  Si4  1  0.250604  0.249791  0.749013  1
  Si  Si5  1  0.250543  0.584170  0.083553  1
  Si  Si6  1  0.250438  0.584513  0.417916  1
  Si  Si7  1  0.250220  0.583376  0.749793  1
  Si  Si8  1  0.250621  0.915687  0.083180  1
  Si  Si9  1  0.250086  0.916502  0.416856  1
  Si  Si10  1  0.250438  0.915318  0.748813  1
  Si  Si11  1  0.583284  0.249925  0.083255  1
  Si  Si12  1  0.583386  0.249998  0.417150  1
  Si  Si13  1  0.583362  0.249924  0.749553  1
  Si  Si14  1  0.583371  0.583746  0.083350  1
  Si  Si15  1  0.583468  0.583555  0.416754  1
  Si  Si16  1  0.583236  0.583476  0.749978  1
  Si  Si17  1  0.583336  0.916229  0.083363  1
  Si  Si18  1  0.583231  0.916443  0.416949  1
  Si  Si19  1  0.583571  0.916527  0.749932  1
  Si  Si20  1  0.910995  0.250008  0.083303  1
  Si  Si21  1  0.916014  0.249806  0.417534  1
  Si  Si22  1  0.916211  0.250167  0.749133  1
  Si  Si23  1  0.916134  0.584259  0.083119  1
  Si  Si24  1  0.916578  0.583412  0.416921  1
  Si  Si25  1  0.916265  0.584534  0.748719  1
  Si  Si26  1  0.916135  0.915713  0.083573  1
  Si  Si27  1  0.916265  0.915435  0.417922  1
  Si  Si28  1  0.916730  0.916479  0.749863  1
  Si  Si29  1  0.998801  0.997867  0.998787  1
  Si  Si30  1  0.000283  0.997672  0.335628  1
  Si  Si31  1  0.999962  0.999538  0.666356  1
  Si  Si32  1  0.992409  0.340959  0.992370  1
  Si  Si33  1  0.998702  0.334525  0.335350  1
  Si  Si34  1  0.999974  0.333351  0.666329  1
  Si  Si35  1  0.999964  0.666952  0.999875  1
  Si  Si36  1  0.999844  0.666962  0.333915  1
  Si  Si37  1  0.000017  0.667176  0.666002  1
  Si  Si38  1  0.335683  0.997664  0.000327  1
  Si  Si39  1  0.333685  0.999673  0.333714  1
  Si  Si40  1  0.333552  0.999707  0.666439  1
  Si  Si41  1  0.335390  0.334549  0.998740  1
  Si  Si42  1  0.335678  0.333032  0.335674  1
  Si  Si43  1  0.333883  0.333429  0.666293  1
  Si  Si44  1  0.333792  0.666952  0.999929  1
  Si  Si45  1  0.333529  0.666895  0.333553  1
  Si  Si46  1  0.333605  0.666679  0.666647  1
  Si  Si47  1  0.666361  0.999534  0.999895  1
  Si  Si48  1  0.666350  0.999749  0.333617  1
  Si  Si49  1  0.666773  0.999825  0.666676  1
  Si  Si50  1  0.666370  0.333392  0.999877  1
  Si  Si51  1  0.666333  0.333496  0.333811  1
  Si  Si52  1  0.666104  0.333311  0.666089  1
  Si  Si53  1  0.666134  0.667223  0.000018  1
  Si  Si54  1  0.666682  0.666716  0.333402  1
  Si  Si55  1  0.666661  0.666699  0.666768  1
  Si  Si56  1  0.250377  0.082949  0.250363  1
  Si  Si57  1  0.250201  0.083049  0.583306  1
  Si  Si58  1  0.256975  0.076360  0.909753  1
  Si  Si59  1  0.256940  0.423565  0.256964  1
  Si  Si60  1  0.250273  0.416727  0.583280  1
  Si  Si61  1  0.250350  0.416985  0.916295  1
  Si  Si62  1  0.250147  0.750013  0.250241  1
  Si  Si63  1  0.250269  0.749885  0.583372  1
  Si  Si64  1  0.250191  0.749830  0.916500  1
  Si  Si65  1  0.583258  0.083135  0.250265  1
  Si  Si66  1  0.583446  0.083026  0.583408  1
  Si  Si67  1  0.583446  0.083129  0.916492  1
  Si  Si68  1  0.583445  0.416855  0.250128  1
  Si  Si69  1  0.583371  0.416872  0.583381  1
  Si  Si70  1  0.583274  0.416779  0.916464  1
  Si  Si71  1  0.583340  0.749987  0.250212  1
  Si  Si72  1  0.583448  0.749969  0.583443  1
  Si  Si73  1  0.583427  0.750015  0.916551  1
  Si  Si74  1  0.909711  0.076375  0.256923  1
  Si  Si75  1  0.916570  0.083139  0.583430  1
  Si  Si76  1  0.916398  0.082953  0.916377  1
  Si  Si77  1  0.916278  0.416993  0.250322  1
  Si  Si78  1  0.916482  0.416729  0.583248  1
  Si  Si79  1  0.909763  0.423621  0.909680  1
  Si  Si80  1  0.916547  0.749921  0.250251  1
  Si  Si81  1  0.916480  0.749944  0.583337  1
  Si  Si82  1  0.916555  0.750049  0.916458  1
  Si  Si83  1  0.992376  0.159016  0.174238  1
  Si  Si84  1  0.999848  0.166560  0.500228  1
  Si  Si85  1  0.998834  0.165390  0.831324  1
  Si  Si86  1  0.998723  0.502068  0.167926  1
  Si  Si87  1  0.999881  0.500361  0.500353  1
  Si  Si88  1  0.000339  0.502300  0.830951  1
  Si  Si89  1  0.999950  0.832985  0.166800  1
  Si  Si90  1  0.999964  0.832734  0.500634  1
  Si  Si91  1  0.999966  0.832941  0.832840  1
  Si  Si92  1  0.335431  0.165424  0.167963  1
  Si  Si93  1  0.333802  0.166465  0.500376  1
  Si  Si94  1  0.335643  0.166907  0.830978  1
  Si  Si95  1  0.335646  0.502263  0.166390  1
  Si  Si96  1  0.333621  0.500191  0.500277  1
  Si  Si97  1  0.333734  0.500271  0.833056  1
  Si  Si98  1  0.333821  0.832957  0.166915  1
  Si  Si99  1  0.333429  0.833247  0.500104  1
  Si  Si100  1  0.333569  0.832993  0.833200  1
  Si  Si101  1  0.666315  0.166558  0.166775  1
  Si  Si102  1  0.666098  0.166595  0.500639  1
  Si  Si103  1  0.666406  0.166470  0.832851  1
  Si  Si104  1  0.666420  0.500473  0.166793  1
  Si  Si105  1  0.666558  0.500190  0.500074  1
  Si  Si106  1  0.666443  0.500140  0.833168  1
  Si  Si107  1  0.666070  0.832730  0.166696  1
  Si  Si108  1  0.666732  0.833236  0.500122  1
  Si  Si109  1  0.666696  0.833308  0.833304  1
  Si  Si110  1  0.083310  0.249927  0.255669  1
  Si  Si111  1  0.083369  0.249873  0.583258  1
  Si  Si112  1  0.083400  0.250023  0.910979  1
  Si  Si113  1  0.083473  0.584203  0.250639  1
  Si  Si114  1  0.083408  0.583695  0.583295  1
  Si  Si115  1  0.083185  0.584207  0.916070  1
  Si  Si116  1  0.083166  0.915751  0.250566  1
  Si  Si117  1  0.083380  0.916173  0.583377  1
  Si  Si118  1  0.083573  0.915676  0.916147  1
  Si  Si119  1  0.417632  0.250186  0.250609  1
  Si  Si120  1  0.417182  0.249930  0.583311  1
  Si  Si121  1  0.417545  0.249753  0.916082  1
  Si  Si122  1  0.417904  0.584553  0.250399  1
  Si  Si123  1  0.416954  0.583431  0.583472  1
  Si  Si124  1  0.416866  0.583455  0.916689  1
  Si  Si125  1  0.416853  0.916466  0.250185  1
  Si  Si126  1  0.416831  0.916385  0.583335  1
  Si  Si127  1  0.417939  0.915415  0.916264  1
  Si  Si128  1  0.749046  0.249837  0.250516  1
  Si  Si129  1  0.749584  0.249932  0.583391  1
  Si  Si130  1  0.749132  0.250164  0.916089  1
  Si  Si131  1  0.749946  0.583503  0.250065  1
  Si  Si132  1  0.749834  0.583480  0.583283  1
  Si  Si133  1  0.748796  0.584585  0.916217  1
  Si  Si134  1  0.748728  0.915418  0.250456  1
  Si  Si135  1  0.750002  0.916493  0.583484  1
  Si  Si136  1  0.749935  0.916487  0.916685  1
  Si  Si137  1  0.167963  0.997906  0.167905  1
  Si  Si138  1  0.166796  0.999498  0.500349  1
  Si  Si139  1  0.166429  0.997615  0.831071  1
  Si  Si140  1  0.174252  0.340910  0.174301  1
  Si  Si141  1  0.166773  0.333344  0.500228  1
  Si  Si142  1  0.167958  0.334568  0.831186  1
  Si  Si143  1  0.166770  0.666863  0.166836  1
  Si  Si144  1  0.166729  0.667230  0.500587  1
  Si  Si145  1  0.166892  0.666877  0.832804  1
  Si  Si146  1  0.500340  0.999500  0.166883  1
  Si  Si147  1  0.500073  0.999795  0.500190  1
  Si  Si148  1  0.500322  0.999784  0.833144  1
  Si  Si149  1  0.500329  0.333399  0.166744  1
  Si  Si150  1  0.500645  0.333371  0.500616  1
  Si  Si151  1  0.500346  0.333387  0.832862  1
  Si  Si152  1  0.500619  0.667242  0.166698  1
  Si  Si153  1  0.500102  0.666750  0.500074  1
  Si  Si154  1  0.500125  0.666703  0.833367  1
  Si  Si155  1  0.831000  0.997654  0.166391  1
  Si  Si156  1  0.833194  0.999837  0.500295  1
  Si  Si157  1  0.833137  0.999609  0.833078  1
  Si  Si158  1  0.831248  0.334589  0.167859  1
  Si  Si159  1  0.832776  0.333447  0.500323  1
  Si  Si160  1  0.831065  0.333023  0.831006  1
  Si  Si161  1  0.832951  0.667022  0.166813  1
  Si  Si162  1  0.833186  0.666672  0.500089  1
  Si  Si163  1  0.833193  0.666947  0.833118  1
  Si  Si164  1  0.083374  0.077621  0.083329  1
  Si  Si165  1  0.083128  0.082745  0.417574  1
  Si  Si166  1  0.083603  0.082736  0.749149  1
  Si  Si167  1  0.083324  0.422338  0.083362  1
  Si  Si168  1  0.083494  0.417142  0.417537  1
  Si  Si169  1  0.083211  0.417231  0.748999  1
  Si  Si170  1  0.083402  0.749900  0.083404  1
  Si  Si171  1  0.083343  0.749997  0.417154  1
  Si  Si172  1  0.083383  0.749874  0.749534  1
  Si  Si173  1  0.417581  0.082736  0.083208  1
  Si  Si174  1  0.416864  0.083192  0.416929  1
  Si  Si175  1  0.417938  0.082856  0.748760  1
  Si  Si176  1  0.417573  0.417187  0.083521  1
  Si  Si177  1  0.417982  0.417095  0.417886  1
  Si  Si178  1  0.416869  0.416691  0.749861  1
  Si  Si179  1  0.417097  0.749989  0.083385  1
  Si  Si180  1  0.416770  0.750081  0.416882  1
  Si  Si181  1  0.416930  0.749846  0.749970  1
  Si  Si182  1  0.749092  0.082783  0.083544  1
  Si  Si183  1  0.748765  0.082890  0.417908  1
  Si  Si184  1  0.750013  0.083181  0.749914  1
  Si  Si185  1  0.749100  0.417244  0.083064  1
  Si  Si186  1  0.749781  0.416800  0.416861  1
  Si  Si187  1  0.748797  0.417045  0.748757  1
  Si  Si188  1  0.749595  0.749983  0.083365  1
  Si  Si189  1  0.749898  0.749845  0.416805  1
  Si  Si190  1  0.749920  0.750187  0.749913  1
  Si  Si191  1  0.174321  0.159056  0.992397  1
  Si  Si192  1  0.167911  0.165368  0.335388  1
  Si  Si193  1  0.166797  0.166497  0.666359  1
  Si  Si194  1  0.167909  0.502011  0.998747  1
  Si  Si195  1  0.166366  0.502260  0.335676  1
  Si  Si196  1  0.166944  0.500390  0.666237  1
  Si  Si197  1  0.166811  0.832948  0.999939  1
  Si  Si198  1  0.166794  0.832992  0.333831  1
  Si  Si199  1  0.166734  0.832630  0.666086  1
  Si  Si200  1  0.500248  0.166493  0.999863  1
  Si  Si201  1  0.500347  0.166513  0.333896  1
  Si  Si202  1  0.500656  0.166565  0.666060  1
  Si  Si203  1  0.500381  0.500404  0.999898  1
  Si  Si204  1  0.500326  0.500213  0.333490  1
  Si  Si205  1  0.500125  0.500097  0.666704  1
  Si  Si206  1  0.500602  0.832723  0.000023  1
  Si  Si207  1  0.500076  0.833225  0.333551  1
  Si  Si208  1  0.500159  0.833242  0.666733  1
  Si  Si209  1  0.831289  0.165392  0.998752  1
  Si  Si210  1  0.830956  0.166939  0.335583  1
  Si  Si211  1  0.832966  0.166507  0.666387  1
  Si  Si212  1  0.831060  0.502330  0.000240  1
  Si  Si213  1  0.833020  0.500300  0.333688  1
  Si  Si214  1  0.833160  0.500141  0.666356  1
  Si  Si215  1  0.832939  0.832942  0.999897  1
  Si  Si216  1  0.833158  0.833064  0.333545  1
  Si  Si217  1  0.833328  0.833268  0.666657  1