# generated using pymatgen
data_Si215I
_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   Si215I
_chemical_formula_sum   'Si215 I1'
_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
  Si  Si1  1  0.250055  0.250085  0.418103  1
  Si  Si2  1  0.250012  0.250028  0.748625  1
  Si  Si3  1  0.249925  0.584723  0.083400  1
  Si  Si4  1  0.250289  0.584565  0.417842  1
  Si  Si5  1  0.249725  0.584453  0.748954  1
  Si  Si6  1  0.249970  0.915350  0.083361  1
  Si  Si7  1  0.249680  0.915546  0.417791  1
  Si  Si8  1  0.250365  0.915575  0.748950  1
  Si  Si9  1  0.584715  0.250027  0.083357  1
  Si  Si10  1  0.584451  0.250384  0.417786  1
  Si  Si11  1  0.584520  0.249738  0.748953  1
  Si  Si12  1  0.584360  0.584441  0.083680  1
  Si  Si13  1  0.583581  0.583521  0.416869  1
  Si  Si14  1  0.583448  0.583464  0.750062  1
  Si  Si15  1  0.584412  0.915566  0.083101  1
  Si  Si16  1  0.583408  0.916715  0.416827  1
  Si  Si17  1  0.583435  0.916544  0.749782  1
  Si  Si18  1  0.915310  0.249982  0.083351  1
  Si  Si19  1  0.915608  0.249764  0.417768  1
  Si  Si20  1  0.915606  0.250283  0.748861  1
  Si  Si21  1  0.915580  0.584484  0.083003  1
  Si  Si22  1  0.916435  0.583532  0.416873  1
  Si  Si23  1  0.916502  0.583588  0.749895  1
  Si  Si24  1  0.915444  0.915528  0.083601  1
  Si  Si25  1  0.916496  0.916554  0.416884  1
  Si  Si26  1  0.916587  0.916634  0.749829  1
  Si  Si27  1  0.998054  0.998101  0.999067  1
  Si  Si28  1  0.999889  0.999895  0.333475  1
  Si  Si29  1  0.999734  0.999777  0.666288  1
  Si  Si30  1  0.998349  0.333198  0.000133  1
  Si  Si31  1  0.998155  0.334376  0.335221  1
  Si  Si32  1  0.999739  0.333450  0.666377  1
  Si  Si33  1  0.999690  0.666976  0.999845  1
  Si  Si34  1  0.999584  0.667028  0.333687  1
  Si  Si35  1  0.999806  0.666820  0.666677  1
  Si  Si36  1  0.333221  0.998353  0.000132  1
  Si  Si37  1  0.334302  0.998143  0.335281  1
  Si  Si38  1  0.333450  0.999776  0.666446  1
  Si  Si39  1  0.349413  0.349414  0.983973  1
  Si  Si40  1  0.333279  0.333325  0.335098  1
  Si  Si41  1  0.333618  0.333643  0.666086  1
  Si  Si42  1  0.333533  0.667308  0.999830  1
  Si  Si43  1  0.333390  0.667028  0.333643  1
  Si  Si44  1  0.333677  0.667120  0.666264  1
  Si  Si45  1  0.666923  0.999704  0.999942  1
  Si  Si46  1  0.666993  0.999794  0.333657  1
  Si  Si47  1  0.666728  0.999877  0.666621  1
  Si  Si48  1  0.667302  0.333591  0.999755  1
  Si  Si49  1  0.666984  0.333463  0.333623  1
  Si  Si50  1  0.667219  0.333696  0.666307  1
  Si  Si51  1  0.667026  0.667098  0.999720  1
  Si  Si52  1  0.666793  0.666755  0.333557  1
  Si  Si53  1  0.666591  0.666805  0.666653  1
  Si  Si54  1  0.248051  0.080030  0.253381  1
  Si  Si55  1  0.250019  0.083015  0.583385  1
  Si  Si56  1  0.251991  0.080014  0.913323  1
  Si  Si57  1  0.251942  0.420065  0.253451  1
  Si  Si58  1  0.250073  0.417110  0.583359  1
  Si  Si59  1  0.247995  0.419975  0.913381  1
  Si  Si60  1  0.249903  0.750049  0.250390  1
  Si  Si61  1  0.250069  0.750015  0.583443  1
  Si  Si62  1  0.250000  0.750054  0.916369  1
  Si  Si63  1  0.584061  0.083241  0.250189  1
  Si  Si64  1  0.583630  0.083207  0.583384  1
  Si  Si65  1  0.583920  0.082880  0.916228  1
  Si  Si66  1  0.583947  0.417184  0.250476  1
  Si  Si67  1  0.583654  0.416922  0.583398  1
  Si  Si68  1  0.584065  0.416835  0.916582  1
  Si  Si69  1  0.583578  0.749938  0.250286  1
  Si  Si70  1  0.583508  0.750155  0.583307  1
  Si  Si71  1  0.583473  0.750081  0.916533  1
  Si  Si72  1  0.916110  0.082857  0.250472  1
  Si  Si73  1  0.916483  0.083215  0.583219  1
  Si  Si74  1  0.915912  0.083163  0.916525  1
  Si  Si75  1  0.915952  0.416863  0.250152  1
  Si  Si76  1  0.916420  0.416980  0.583427  1
  Si  Si77  1  0.916191  0.417126  0.916217  1
  Si  Si78  1  0.916354  0.750068  0.250198  1
  Si  Si79  1  0.916411  0.750070  0.583470  1
  Si  Si80  1  0.916365  0.750005  0.916386  1
  Si  Si81  1  0.998327  0.166766  0.166593  1
  Si  Si82  1  0.999814  0.166649  0.500224  1
  Si  Si83  1  0.998113  0.165661  0.831440  1
  Si  Si84  1  0.998126  0.501933  0.167644  1
  Si  Si85  1  0.999656  0.500404  0.500373  1
  Si  Si86  1  0.999905  0.500141  0.833197  1
  Si  Si87  1  0.999651  0.833069  0.166713  1
  Si  Si88  1  0.999729  0.833306  0.500166  1
  Si  Si89  1  0.999689  0.833074  0.833011  1
  Si  Si90  1  0.349479  0.150606  0.182831  1
  Si  Si91  1  0.333617  0.166467  0.500676  1
  Si  Si92  1  0.333241  0.166816  0.831658  1
  Si  Si93  1  0.333174  0.501721  0.166641  1
  Si  Si94  1  0.333470  0.500399  0.500305  1
  Si  Si95  1  0.334281  0.501860  0.831510  1
  Si  Si96  1  0.333514  0.832802  0.167013  1
  Si  Si97  1  0.333619  0.832874  0.500494  1
  Si  Si98  1  0.333466  0.833060  0.833099  1
  Si  Si99  1  0.667277  0.166435  0.166948  1
  Si  Si100  1  0.667158  0.166505  0.500488  1
  Si  Si101  1  0.667004  0.166574  0.833076  1
  Si  Si102  1  0.666972  0.500311  0.166730  1
  Si  Si103  1  0.666771  0.500214  0.500130  1
  Si  Si104  1  0.667014  0.500286  0.833138  1
  Si  Si105  1  0.667090  0.832846  0.166980  1
  Si  Si106  1  0.666743  0.833455  0.500075  1
  Si  Si107  1  0.666569  0.833295  0.833147  1
  Si  Si108  1  0.080017  0.248023  0.253389  1
  Si  Si109  1  0.083035  0.250085  0.583310  1
  Si  Si110  1  0.079982  0.251957  0.913298  1
  Si  Si111  1  0.083116  0.584131  0.250222  1
  Si  Si112  1  0.083100  0.583675  0.583413  1
  Si  Si113  1  0.082886  0.583897  0.916201  1
  Si  Si114  1  0.082816  0.916125  0.250432  1
  Si  Si115  1  0.083150  0.916423  0.583333  1
  Si  Si116  1  0.083152  0.915959  0.916533  1
  Si  Si117  1  0.420014  0.252053  0.253384  1
  Si  Si118  1  0.417068  0.250073  0.583376  1
  Si  Si119  1  0.420010  0.248040  0.913383  1
  Si  Si120  1  0.417095  0.583931  0.250526  1
  Si  Si121  1  0.416992  0.583627  0.583355  1
  Si  Si122  1  0.416746  0.584072  0.916602  1
  Si  Si123  1  0.416817  0.915950  0.250217  1
  Si  Si124  1  0.416857  0.916469  0.583375  1
  Si  Si125  1  0.417127  0.916150  0.916246  1
  Si  Si126  1  0.750032  0.250047  0.250344  1
  Si  Si127  1  0.750039  0.250167  0.583331  1
  Si  Si128  1  0.750053  0.249993  0.916337  1
  Si  Si129  1  0.750001  0.583626  0.250186  1
  Si  Si130  1  0.749913  0.583591  0.583446  1
  Si  Si131  1  0.750038  0.583610  0.916505  1
  Si  Si132  1  0.749982  0.916436  0.250255  1
  Si  Si133  1  0.750057  0.916682  0.583342  1
  Si  Si134  1  0.749869  0.916438  0.916355  1
  Si  Si135  1  0.166759  0.998367  0.166600  1
  Si  Si136  1  0.166620  0.999729  0.500314  1
  Si  Si137  1  0.165716  0.998108  0.831473  1
  Si  Si138  1  0.150552  0.349484  0.182869  1
  Si  Si139  1  0.166456  0.333716  0.500626  1
  Si  Si140  1  0.166765  0.333235  0.831640  1
  Si  Si141  1  0.166326  0.667321  0.166959  1
  Si  Si142  1  0.166347  0.667259  0.500528  1
  Si  Si143  1  0.166612  0.666976  0.833096  1
  Si  Si144  1  0.501869  0.998150  0.167696  1
  Si  Si145  1  0.500279  0.999800  0.500383  1
  Si  Si146  1  0.500131  0.999910  0.833235  1
  Si  Si147  1  0.501707  0.333278  0.166600  1
  Si  Si148  1  0.500333  0.333504  0.500335  1
  Si  Si149  1  0.501906  0.334299  0.831505  1
  Si  Si150  1  0.500234  0.666966  0.166807  1
  Si  Si151  1  0.500263  0.666783  0.500077  1
  Si  Si152  1  0.500251  0.666973  0.833148  1
  Si  Si153  1  0.833015  0.999707  0.166776  1
  Si  Si154  1  0.833294  0.999930  0.500040  1
  Si  Si155  1  0.833010  0.999718  0.833006  1
  Si  Si156  1  0.832755  0.333616  0.166920  1
  Si  Si157  1  0.832940  0.333703  0.500468  1
  Si  Si158  1  0.833151  0.333400  0.833087  1
  Si  Si159  1  0.832827  0.667190  0.166864  1
  Si  Si160  1  0.833147  0.666853  0.500174  1
  Si  Si161  1  0.833172  0.666788  0.833126  1
  Si  Si162  1  0.079968  0.079990  0.085322  1
  Si  Si163  1  0.082946  0.082873  0.417219  1
  Si  Si164  1  0.083216  0.083174  0.749257  1
  Si  Si165  1  0.080000  0.419993  0.081402  1
  Si  Si166  1  0.083154  0.416922  0.417464  1
  Si  Si167  1  0.082903  0.417155  0.749416  1
  Si  Si168  1  0.082937  0.750022  0.083293  1
  Si  Si169  1  0.082991  0.750097  0.416961  1
  Si  Si170  1  0.083164  0.750020  0.749789  1
  Si  Si171  1  0.420011  0.080028  0.081398  1
  Si  Si172  1  0.416814  0.083246  0.417455  1
  Si  Si173  1  0.417177  0.082933  0.749470  1
  Si  Si174  1  0.419942  0.420018  0.085403  1
  Si  Si175  1  0.417201  0.417234  0.417288  1
  Si  Si176  1  0.416851  0.416829  0.749319  1
  Si  Si177  1  0.416925  0.750041  0.083456  1
  Si  Si178  1  0.416921  0.749995  0.416947  1
  Si  Si179  1  0.416934  0.750030  0.749805  1
  Si  Si180  1  0.749971  0.082972  0.083360  1
  Si  Si181  1  0.750063  0.083230  0.416927  1
  Si  Si182  1  0.750027  0.083159  0.749714  1
  Si  Si183  1  0.750042  0.417035  0.083313  1
  Si  Si184  1  0.750005  0.416944  0.416919  1
  Si  Si185  1  0.750149  0.416946  0.749877  1
  Si  Si186  1  0.749878  0.750009  0.083261  1
  Si  Si187  1  0.749978  0.750142  0.416871  1
  Si  Si188  1  0.749835  0.750067  0.749866  1
  Si  Si189  1  0.150492  0.150482  0.983813  1
  Si  Si190  1  0.166843  0.166827  0.335070  1
  Si  Si191  1  0.166403  0.166448  0.666058  1
  Si  Si192  1  0.166754  0.501674  0.000143  1
  Si  Si193  1  0.165686  0.501995  0.335301  1
  Si  Si194  1  0.166602  0.500341  0.666387  1
  Si  Si195  1  0.166381  0.832776  0.999770  1
  Si  Si196  1  0.166479  0.833092  0.333643  1
  Si  Si197  1  0.166456  0.832918  0.666253  1
  Si  Si198  1  0.501700  0.166776  0.000138  1
  Si  Si199  1  0.501877  0.165769  0.335261  1
  Si  Si200  1  0.500332  0.166663  0.666424  1
  Si  Si201  1  0.501808  0.501868  0.999091  1
  Si  Si202  1  0.500166  0.500187  0.333463  1
  Si  Si203  1  0.500345  0.500321  0.666450  1
  Si  Si204  1  0.500202  0.833082  0.000016  1
  Si  Si205  1  0.500335  0.833054  0.333681  1
  Si  Si206  1  0.500137  0.833309  0.666593  1
  Si  Si207  1  0.832717  0.166385  0.999778  1
  Si  Si208  1  0.833100  0.166642  0.333601  1
  Si  Si209  1  0.832886  0.166453  0.666125  1
  Si  Si210  1  0.833101  0.500289  0.999906  1
  Si  Si211  1  0.833024  0.500342  0.333626  1
  Si  Si212  1  0.833269  0.500294  0.666661  1
  Si  Si213  1  0.832741  0.832861  0.999625  1
  Si  Si214  1  0.833273  0.833339  0.333542  1
  Si  Si215  1  0.833159  0.833351  0.666677  1
  I  I216  1  0.249959  0.249976  0.083356  1
