# 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  0.083305  0.249996  0.083317  1
  Si  Si2  1  0.255673  0.249980  0.083297  1
  Si  Si3  1  0.250530  0.250224  0.417558  1
  Si  Si4  1  0.250521  0.249754  0.749106  1
  Si  Si5  1  0.250528  0.584296  0.083503  1
  Si  Si6  1  0.250484  0.584566  0.417892  1
  Si  Si7  1  0.250166  0.583471  0.749864  1
  Si  Si8  1  0.250613  0.915755  0.083174  1
  Si  Si9  1  0.250246  0.916511  0.416820  1
  Si  Si10  1  0.250467  0.915411  0.748708  1
  Si  Si11  1  0.583220  0.250015  0.083293  1
  Si  Si12  1  0.583307  0.250039  0.417104  1
  Si  Si13  1  0.583351  0.250025  0.749515  1
  Si  Si14  1  0.583367  0.583823  0.083332  1
  Si  Si15  1  0.583512  0.583511  0.416693  1
  Si  Si16  1  0.583180  0.583399  0.749855  1
  Si  Si17  1  0.583397  0.916257  0.083263  1
  Si  Si18  1  0.583251  0.916592  0.416875  1
  Si  Si19  1  0.583536  0.916486  0.749894  1
  Si  Si20  1  0.910927  0.249991  0.083324  1
  Si  Si21  1  0.916118  0.249803  0.417586  1
  Si  Si22  1  0.916080  0.250235  0.749063  1
  Si  Si23  1  0.916127  0.584276  0.083141  1
  Si  Si24  1  0.916591  0.583577  0.416775  1
  Si  Si25  1  0.916266  0.584556  0.748700  1
  Si  Si26  1  0.916131  0.915824  0.083521  1
  Si  Si27  1  0.916250  0.915472  0.417956  1
  Si  Si28  1  0.916645  0.916420  0.749820  1
  Si  Si29  1  0.998793  0.997943  0.998706  1
  Si  Si30  1  0.000270  0.997733  0.335678  1
  Si  Si31  1  0.999928  0.999433  0.666315  1
  Si  Si32  1  0.992353  0.340913  0.992374  1
  Si  Si33  1  0.998755  0.334600  0.335424  1
  Si  Si34  1  0.999873  0.333508  0.666369  1
  Si  Si35  1  0.999965  0.666986  0.999917  1
  Si  Si36  1  0.999912  0.667060  0.333771  1
  Si  Si37  1  0.000022  0.667273  0.666064  1
  Si  Si38  1  0.335689  0.997664  0.000309  1
  Si  Si39  1  0.333749  0.999676  0.333604  1
  Si  Si40  1  0.333551  0.999796  0.666345  1
  Si  Si41  1  0.335395  0.334579  0.998734  1
  Si  Si42  1  0.335601  0.333078  0.335609  1
  Si  Si43  1  0.333760  0.333411  0.666342  1
  Si  Si44  1  0.333840  0.666995  0.999861  1
  Si  Si45  1  0.333572  0.666978  0.333540  1
  Si  Si46  1  0.333586  0.666677  0.666632  1
  Si  Si47  1  0.666394  0.999509  0.999750  1
  Si  Si48  1  0.666435  0.999867  0.333578  1
  Si  Si49  1  0.666612  0.999892  0.666634  1
  Si  Si50  1  0.666330  0.333429  0.999895  1
  Si  Si51  1  0.666273  0.333515  0.333760  1
  Si  Si52  1  0.666049  0.333416  0.666008  1
  Si  Si53  1  0.666146  0.667308  0.999996  1
  Si  Si54  1  0.666695  0.666779  0.333404  1
  Si  Si55  1  0.666605  0.666579  0.666597  1
  Si  Si56  1  0.250396  0.082993  0.250331  1
  Si  Si57  1  0.250139  0.083149  0.583235  1
  Si  Si58  1  0.256936  0.076363  0.909762  1
  Si  Si59  1  0.256895  0.423615  0.256859  1
  Si  Si60  1  0.250189  0.416853  0.583437  1
  Si  Si61  1  0.250346  0.417020  0.916309  1
  Si  Si62  1  0.250143  0.750080  0.250236  1
  Si  Si63  1  0.250383  0.749938  0.583292  1
  Si  Si64  1  0.250272  0.749983  0.916505  1
  Si  Si65  1  0.583269  0.083187  0.250217  1
  Si  Si66  1  0.583321  0.083177  0.583385  1
  Si  Si67  1  0.583471  0.083191  0.916410  1
  Si  Si68  1  0.583372  0.416916  0.250106  1
  Si  Si69  1  0.583316  0.416880  0.583218  1
  Si  Si70  1  0.583240  0.416832  0.916487  1
  Si  Si71  1  0.583477  0.750086  0.250145  1
  Si  Si72  1  0.583409  0.749903  0.583342  1
  Si  Si73  1  0.583414  0.750028  0.916496  1
  Si  Si74  1  0.909699  0.076448  0.256950  1
  Si  Si75  1  0.916576  0.083136  0.583448  1
  Si  Si76  1  0.916331  0.083009  0.916298  1
  Si  Si77  1  0.916296  0.417003  0.250353  1
  Si  Si78  1  0.916510  0.416911  0.583207  1
  Si  Si79  1  0.909733  0.423643  0.909721  1
  Si  Si80  1  0.916574  0.750071  0.250187  1
  Si  Si81  1  0.916455  0.750014  0.583372  1
  Si  Si82  1  0.916583  0.750028  0.916427  1
  Si  Si83  1  0.992377  0.159082  0.174246  1
  Si  Si84  1  0.999951  0.166583  0.500310  1
  Si  Si85  1  0.998729  0.165420  0.831211  1
  Si  Si86  1  0.998733  0.502059  0.167908  1
  Si  Si87  1  0.999880  0.500556  0.500295  1
  Si  Si88  1  0.000301  0.502357  0.831004  1
  Si  Si89  1  0.999961  0.833157  0.166768  1
  Si  Si90  1  0.999963  0.832716  0.500604  1
  Si  Si91  1  0.999953  0.832951  0.832809  1
  Si  Si92  1  0.335432  0.165414  0.167877  1
  Si  Si93  1  0.333747  0.166539  0.500300  1
  Si  Si94  1  0.335631  0.166914  0.831025  1
  Si  Si95  1  0.335623  0.502362  0.166342  1
  Si  Si96  1  0.333555  0.500189  0.500302  1
  Si  Si97  1  0.333709  0.500286  0.833010  1
  Si  Si98  1  0.333805  0.832960  0.166840  1
  Si  Si99  1  0.333640  0.833264  0.500056  1
  Si  Si100  1  0.333606  0.833088  0.833117  1
  Si  Si101  1  0.666300  0.166587  0.166727  1
  Si  Si102  1  0.666045  0.166685  0.500632  1
  Si  Si103  1  0.666395  0.166541  0.832772  1
  Si  Si104  1  0.666375  0.500540  0.166798  1
  Si  Si105  1  0.666612  0.500123  0.499946  1
  Si  Si106  1  0.666401  0.500179  0.833155  1
  Si  Si107  1  0.666170  0.832833  0.166630  1
  Si  Si108  1  0.666629  0.833293  0.500059  1
  Si  Si109  1  0.666701  0.833251  0.833217  1
  Si  Si110  1  0.083317  0.250017  0.255665  1
  Si  Si111  1  0.083322  0.250120  0.583329  1
  Si  Si112  1  0.083291  0.249989  0.910953  1
  Si  Si113  1  0.083521  0.584260  0.250524  1
  Si  Si114  1  0.083396  0.583803  0.583321  1
  Si  Si115  1  0.083173  0.584305  0.916053  1
  Si  Si116  1  0.083175  0.915816  0.250635  1
  Si  Si117  1  0.083414  0.916173  0.583273  1
  Si  Si118  1  0.083562  0.915758  0.916056  1
  Si  Si119  1  0.417552  0.250224  0.250546  1
  Si  Si120  1  0.417078  0.249984  0.583303  1
  Si  Si121  1  0.417557  0.249782  0.916094  1
  Si  Si122  1  0.417891  0.584626  0.250377  1
  Si  Si123  1  0.416919  0.583430  0.583435  1
  Si  Si124  1  0.416861  0.583480  0.916586  1
  Si  Si125  1  0.416896  0.916496  0.250023  1
  Si  Si126  1  0.416951  0.916530  0.583260  1
  Si  Si127  1  0.417971  0.915454  0.916256  1
  Si  Si128  1  0.749012  0.249798  0.250561  1
  Si  Si129  1  0.749574  0.250028  0.583351  1
  Si  Si130  1  0.749066  0.250247  0.916043  1
  Si  Si131  1  0.749936  0.583557  0.250051  1
  Si  Si132  1  0.749854  0.583488  0.583090  1
  Si  Si133  1  0.748773  0.584574  0.916253  1
  Si  Si134  1  0.748781  0.915535  0.250399  1
  Si  Si135  1  0.749844  0.916530  0.583498  1
  Si  Si136  1  0.749997  0.916459  0.916559  1
  Si  Si137  1  0.167948  0.997932  0.167932  1
  Si  Si138  1  0.166867  0.999501  0.500263  1
  Si  Si139  1  0.166416  0.997667  0.830974  1
  Si  Si140  1  0.174233  0.340938  0.174211  1
  Si  Si141  1  0.166774  0.333498  0.500282  1
  Si  Si142  1  0.167906  0.334576  0.831265  1
  Si  Si143  1  0.166745  0.667024  0.166748  1
  Si  Si144  1  0.166792  0.667252  0.500589  1
  Si  Si145  1  0.166918  0.667031  0.832865  1
  Si  Si146  1  0.500411  0.999529  0.166794  1
  Si  Si147  1  0.500068  0.999954  0.500070  1
  Si  Si148  1  0.500323  0.999814  0.833103  1
  Si  Si149  1  0.500239  0.333475  0.166740  1
  Si  Si150  1  0.500533  0.333369  0.500547  1
  Si  Si151  1  0.500329  0.333439  0.832865  1
  Si  Si152  1  0.500662  0.667303  0.166724  1
  Si  Si153  1  0.500129  0.666666  0.500020  1
  Si  Si154  1  0.500137  0.666725  0.833257  1
  Si  Si155  1  0.831014  0.997766  0.166336  1
  Si  Si156  1  0.833157  0.999828  0.500352  1
  Si  Si157  1  0.833109  0.999632  0.832975  1
  Si  Si158  1  0.831211  0.334575  0.167934  1
  Si  Si159  1  0.832893  0.333477  0.500331  1
  Si  Si160  1  0.831003  0.333120  0.830961  1
  Si  Si161  1  0.832959  0.667090  0.166819  1
  Si  Si162  1  0.833219  0.666798  0.500015  1
  Si  Si163  1  0.833169  0.666903  0.833118  1
  Si  Si164  1  0.083336  0.077640  0.083342  1
  Si  Si165  1  0.083173  0.082785  0.417570  1
  Si  Si166  1  0.083524  0.082737  0.749067  1
  Si  Si167  1  0.083294  0.422362  0.083277  1
  Si  Si168  1  0.083532  0.417290  0.417564  1
  Si  Si169  1  0.083144  0.417248  0.749100  1
  Si  Si170  1  0.083372  0.750133  0.083301  1
  Si  Si171  1  0.083387  0.749995  0.417147  1
  Si  Si172  1  0.083471  0.749994  0.749498  1
  Si  Si173  1  0.417629  0.082747  0.083134  1
  Si  Si174  1  0.416822  0.083306  0.416808  1
  Si  Si175  1  0.417896  0.082900  0.748749  1
  Si  Si176  1  0.417541  0.417271  0.083492  1
  Si  Si177  1  0.417875  0.417110  0.417859  1
  Si  Si178  1  0.416799  0.416660  0.749821  1
  Si  Si179  1  0.417137  0.749984  0.083367  1
  Si  Si180  1  0.416974  0.750116  0.416760  1
  Si  Si181  1  0.416919  0.749880  0.749893  1
  Si  Si182  1  0.749036  0.082801  0.083469  1
  Si  Si183  1  0.748791  0.082960  0.417985  1
  Si  Si184  1  0.749932  0.083213  0.749827  1
  Si  Si185  1  0.749065  0.417241  0.083129  1
  Si  Si186  1  0.749849  0.416706  0.416774  1
  Si  Si187  1  0.748745  0.417146  0.748695  1
  Si  Si188  1  0.749645  0.750051  0.083332  1
  Si  Si189  1  0.749851  0.749986  0.416801  1
  Si  Si190  1  0.749804  0.749992  0.749836  1
  Si  Si191  1  0.174241  0.159042  0.992382  1
  Si  Si192  1  0.167924  0.165427  0.335364  1
  Si  Si193  1  0.166716  0.166575  0.666339  1
  Si  Si194  1  0.167899  0.502095  0.998713  1
  Si  Si195  1  0.166388  0.502348  0.335617  1
  Si  Si196  1  0.166829  0.500494  0.666360  1
  Si  Si197  1  0.166838  0.833101  0.999870  1
  Si  Si198  1  0.166844  0.833047  0.333886  1
  Si  Si199  1  0.166827  0.832686  0.665966  1
  Si  Si200  1  0.500294  0.166536  0.999846  1
  Si  Si201  1  0.500310  0.166575  0.333793  1
  Si  Si202  1  0.500555  0.166667  0.666096  1
  Si  Si203  1  0.500353  0.500491  0.999877  1
  Si  Si204  1  0.500237  0.500227  0.333474  1
  Si  Si205  1  0.500061  0.500032  0.666603  1
  Si  Si206  1  0.500620  0.832736  0.999987  1
  Si  Si207  1  0.500191  0.833327  0.333428  1
  Si  Si208  1  0.500161  0.833242  0.666639  1
  Si  Si209  1  0.831219  0.165439  0.998692  1
  Si  Si210  1  0.830986  0.166998  0.335669  1
  Si  Si211  1  0.832896  0.166518  0.666320  1
  Si  Si212  1  0.831022  0.502333  0.000304  1
  Si  Si213  1  0.833022  0.500342  0.333663  1
  Si  Si214  1  0.833126  0.500239  0.666302  1
  Si  Si215  1  0.833002  0.832980  0.999843  1
  Si  Si216  1  0.833171  0.833166  0.333505  1
  Si  Si217  1  0.833148  0.833224  0.666657  1
