# generated using pymatgen
data_MgSi216
_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   MgSi216
_chemical_formula_sum   'Mg1 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
  Mg  Mg1  1  0.083308  0.249993  0.083402  1
  Si  Si2  1  0.253398  0.250046  0.083331  1
  Si  Si3  1  0.250222  0.250125  0.417444  1
  Si  Si4  1  0.250220  0.249924  0.749254  1
  Si  Si5  1  0.250240  0.584122  0.083511  1
  Si  Si6  1  0.250385  0.584121  0.417477  1
  Si  Si7  1  0.250144  0.583607  0.749775  1
  Si  Si8  1  0.250240  0.915928  0.083190  1
  Si  Si9  1  0.250172  0.916592  0.416966  1
  Si  Si10  1  0.250392  0.915901  0.749318  1
  Si  Si11  1  0.583246  0.250024  0.083422  1
  Si  Si12  1  0.583414  0.249910  0.416768  1
  Si  Si13  1  0.583306  0.249911  0.749834  1
  Si  Si14  1  0.583235  0.583457  0.083407  1
  Si  Si15  1  0.583462  0.583556  0.416905  1
  Si  Si16  1  0.583233  0.583411  0.749772  1
  Si  Si17  1  0.583260  0.916494  0.083374  1
  Si  Si18  1  0.583232  0.916444  0.416942  1
  Si  Si19  1  0.583534  0.916495  0.749927  1
  Si  Si20  1  0.913234  0.250019  0.083386  1
  Si  Si21  1  0.916404  0.249938  0.417479  1
  Si  Si22  1  0.916455  0.250144  0.749222  1
  Si  Si23  1  0.916446  0.584110  0.083179  1
  Si  Si24  1  0.916581  0.583615  0.416917  1
  Si  Si25  1  0.916213  0.584114  0.749391  1
  Si  Si26  1  0.916446  0.915952  0.083579  1
  Si  Si27  1  0.916279  0.915846  0.417434  1
  Si  Si28  1  0.916560  0.916550  0.749811  1
  Si  Si29  1  0.998886  0.998909  0.999001  1
  Si  Si30  1  0.000746  0.998487  0.334921  1
  Si  Si31  1  0.999736  0.999820  0.666451  1
  Si  Si32  1  0.994798  0.338558  0.994809  1
  Si  Si33  1  0.998824  0.334511  0.334508  1
  Si  Si34  1  0.999879  0.333509  0.666283  1
  Si  Si35  1  0.999936  0.667134  0.999957  1
  Si  Si36  1  0.999840  0.666921  0.333655  1
  Si  Si37  1  0.000035  0.667016  0.666541  1
  Si  Si38  1  0.334866  0.998460  0.000621  1
  Si  Si39  1  0.333883  0.999534  0.333845  1
  Si  Si40  1  0.333505  0.999832  0.666567  1
  Si  Si41  1  0.334402  0.334454  0.998904  1
  Si  Si42  1  0.334859  0.332648  0.334857  1
  Si  Si43  1  0.333670  0.333515  0.666358  1
  Si  Si44  1  0.333711  0.666835  0.999761  1
  Si  Si45  1  0.333501  0.666950  0.333627  1
  Si  Si46  1  0.333477  0.666825  0.666528  1
  Si  Si47  1  0.666439  0.999755  0.999931  1
  Si  Si48  1  0.666375  0.999744  0.333611  1
  Si  Si49  1  0.666674  0.999796  0.666623  1
  Si  Si50  1  0.666237  0.333393  0.999932  1
  Si  Si51  1  0.666445  0.333615  0.333647  1
  Si  Si52  1  0.666298  0.333293  0.666364  1
  Si  Si53  1  0.666294  0.666946  0.000100  1
  Si  Si54  1  0.666579  0.666822  0.333533  1
  Si  Si55  1  0.666663  0.666784  0.666760  1
  Si  Si56  1  0.250530  0.082823  0.250558  1
  Si  Si57  1  0.250251  0.083202  0.583412  1
  Si  Si58  1  0.254539  0.078783  0.912097  1
  Si  Si59  1  0.254537  0.421238  0.254622  1
  Si  Si60  1  0.250262  0.416926  0.583340  1
  Si  Si61  1  0.250583  0.417332  0.916095  1
  Si  Si62  1  0.250314  0.750128  0.250226  1
  Si  Si63  1  0.250109  0.750127  0.583438  1
  Si  Si64  1  0.250295  0.749946  0.916473  1
  Si  Si65  1  0.583346  0.083106  0.250224  1
  Si  Si66  1  0.583413  0.083022  0.583364  1
  Si  Si67  1  0.583390  0.083148  0.916564  1
  Si  Si68  1  0.583343  0.416934  0.250233  1
  Si  Si69  1  0.583332  0.416807  0.583235  1
  Si  Si70  1  0.583266  0.416778  0.916431  1
  Si  Si71  1  0.583222  0.750004  0.250308  1
  Si  Si72  1  0.583455  0.750068  0.583451  1
  Si  Si73  1  0.583442  0.749956  0.916424  1
  Si  Si74  1  0.912110  0.078774  0.254686  1
  Si  Si75  1  0.916415  0.083216  0.583330  1
  Si  Si76  1  0.916155  0.082834  0.916149  1
  Si  Si77  1  0.916096  0.417331  0.250556  1
  Si  Si78  1  0.916405  0.416954  0.583362  1
  Si  Si79  1  0.912107  0.421215  0.912117  1
  Si  Si80  1  0.916501  0.749930  0.250179  1
  Si  Si81  1  0.916587  0.749983  0.583445  1
  Si  Si82  1  0.916408  0.750125  0.916627  1
  Si  Si83  1  0.994761  0.161463  0.171982  1
  Si  Si84  1  0.999917  0.166663  0.500415  1
  Si  Si85  1  0.998925  0.165638  0.832218  1
  Si  Si86  1  0.998908  0.501176  0.167729  1
  Si  Si87  1  0.999757  0.500362  0.500292  1
  Si  Si88  1  0.000725  0.501524  0.831883  1
  Si  Si89  1  0.999955  0.832945  0.166781  1
  Si  Si90  1  0.000105  0.832997  0.500321  1
  Si  Si91  1  0.999687  0.833216  0.833159  1
  Si  Si92  1  0.334405  0.165608  0.167731  1
  Si  Si93  1  0.333668  0.166409  0.500212  1
  Si  Si94  1  0.334846  0.167348  0.831823  1
  Si  Si95  1  0.334842  0.501527  0.166053  1
  Si  Si96  1  0.333579  0.500225  0.500195  1
  Si  Si97  1  0.333910  0.500554  0.832746  1
  Si  Si98  1  0.333734  0.833140  0.166834  1
  Si  Si99  1  0.333451  0.833336  0.500222  1
  Si  Si100  1  0.333574  0.833056  0.833096  1
  Si  Si101  1  0.666268  0.166622  0.166815  1
  Si  Si102  1  0.666356  0.166605  0.500328  1
  Si  Si103  1  0.666447  0.166448  0.833095  1
  Si  Si104  1  0.666456  0.500313  0.166912  1
  Si  Si105  1  0.666611  0.500197  0.500173  1
  Si  Si106  1  0.666375  0.500162  0.833151  1
  Si  Si107  1  0.666225  0.833022  0.166753  1
  Si  Si108  1  0.666720  0.833291  0.500126  1
  Si  Si109  1  0.666702  0.833286  0.833268  1
  Si  Si110  1  0.083273  0.250053  0.253540  1
  Si  Si111  1  0.083336  0.250157  0.583330  1
  Si  Si112  1  0.083362  0.250039  0.913243  1
  Si  Si113  1  0.083477  0.584121  0.250179  1
  Si  Si114  1  0.083302  0.583545  0.583478  1
  Si  Si115  1  0.083225  0.584130  0.916527  1
  Si  Si116  1  0.083250  0.915927  0.250238  1
  Si  Si117  1  0.083267  0.916568  0.583403  1
  Si  Si118  1  0.083438  0.915945  0.916563  1
  Si  Si119  1  0.417408  0.250120  0.250178  1
  Si  Si120  1  0.416912  0.249913  0.583298  1
  Si  Si121  1  0.417378  0.249904  0.916461  1
  Si  Si122  1  0.417387  0.584124  0.250541  1
  Si  Si123  1  0.416847  0.583572  0.583343  1
  Si  Si124  1  0.416961  0.583513  0.916520  1
  Si  Si125  1  0.416912  0.916504  0.250109  1
  Si  Si126  1  0.416834  0.916522  0.583428  1
  Si  Si127  1  0.417490  0.915873  0.916189  1
  Si  Si128  1  0.749260  0.249920  0.250233  1
  Si  Si129  1  0.749761  0.250017  0.583325  1
  Si  Si130  1  0.749271  0.250109  0.916534  1
  Si  Si131  1  0.749764  0.583624  0.250118  1
  Si  Si132  1  0.749844  0.583537  0.583412  1
  Si  Si133  1  0.749165  0.584065  0.916292  1
  Si  Si134  1  0.749174  0.915835  0.250537  1
  Si  Si135  1  0.749980  0.916475  0.583497  1
  Si  Si136  1  0.749780  0.916569  0.916675  1
  Si  Si137  1  0.167776  0.998873  0.167760  1
  Si  Si138  1  0.166913  0.999769  0.500348  1
  Si  Si139  1  0.165923  0.998503  0.831862  1
  Si  Si140  1  0.171848  0.338582  0.171948  1
  Si  Si141  1  0.166800  0.333508  0.500370  1
  Si  Si142  1  0.167783  0.334468  0.832244  1
  Si  Si143  1  0.166846  0.667127  0.166821  1
  Si  Si144  1  0.166647  0.667002  0.500428  1
  Si  Si145  1  0.166903  0.666917  0.833066  1
  Si  Si146  1  0.500198  0.999777  0.166877  1
  Si  Si147  1  0.500080  0.999803  0.500173  1
  Si  Si148  1  0.500342  0.999810  0.833194  1
  Si  Si149  1  0.500357  0.333489  0.166803  1
  Si  Si150  1  0.500370  0.333215  0.500230  1
  Si  Si151  1  0.500172  0.333516  0.832960  1
  Si  Si152  1  0.500263  0.666971  0.166718  1
  Si  Si153  1  0.500147  0.666840  0.500121  1
  Si  Si154  1  0.500158  0.666731  0.833143  1
  Si  Si155  1  0.831787  0.998483  0.166147  1
  Si  Si156  1  0.833194  0.999765  0.500230  1
  Si  Si157  1  0.832812  0.999533  0.832865  1
  Si  Si158  1  0.832224  0.334460  0.167773  1
  Si  Si159  1  0.832972  0.333628  0.500271  1
  Si  Si160  1  0.831828  0.332621  0.831838  1
  Si  Si161  1  0.833005  0.666911  0.166862  1
  Si  Si162  1  0.833238  0.666754  0.500230  1
  Si  Si163  1  0.833151  0.666912  0.833314  1
  Si  Si164  1  0.083317  0.079898  0.083400  1
  Si  Si165  1  0.083238  0.083174  0.417502  1
  Si  Si166  1  0.083465  0.083204  0.749257  1
  Si  Si167  1  0.083343  0.420153  0.083344  1
  Si  Si168  1  0.083406  0.416929  0.417465  1
  Si  Si169  1  0.083221  0.416899  0.749269  1
  Si  Si170  1  0.083454  0.750041  0.083369  1
  Si  Si171  1  0.083471  0.750016  0.416832  1
  Si  Si172  1  0.083258  0.750116  0.750044  1
  Si  Si173  1  0.417358  0.083155  0.083166  1
  Si  Si174  1  0.416944  0.083196  0.416894  1
  Si  Si175  1  0.417489  0.082881  0.749304  1
  Si  Si176  1  0.417364  0.416866  0.083482  1
  Si  Si177  1  0.417481  0.417081  0.417418  1
  Si  Si178  1  0.416868  0.416768  0.749690  1
  Si  Si179  1  0.416903  0.749989  0.083280  1
  Si  Si180  1  0.416767  0.750131  0.416968  1
  Si  Si181  1  0.416890  0.749891  0.749808  1
  Si  Si182  1  0.749292  0.083171  0.083584  1
  Si  Si183  1  0.749226  0.082823  0.417458  1
  Si  Si184  1  0.749772  0.083254  0.749840  1
  Si  Si185  1  0.749222  0.416851  0.083211  1
  Si  Si186  1  0.749784  0.416877  0.416895  1
  Si  Si187  1  0.749187  0.417053  0.749294  1
  Si  Si188  1  0.749719  0.750036  0.083401  1
  Si  Si189  1  0.749914  0.749891  0.416917  1
  Si  Si190  1  0.749982  0.750140  0.749948  1
  Si  Si191  1  0.171858  0.161447  0.994812  1
  Si  Si192  1  0.167740  0.165614  0.334488  1
  Si  Si193  1  0.166749  0.166682  0.666293  1
  Si  Si194  1  0.167777  0.501171  0.998959  1
  Si  Si195  1  0.165943  0.501548  0.334878  1
  Si  Si196  1  0.166927  0.500308  0.666468  1
  Si  Si197  1  0.166838  0.832930  0.999883  1
  Si  Si198  1  0.167007  0.833199  0.333680  1
  Si  Si199  1  0.166524  0.833096  0.666464  1
  Si  Si200  1  0.500343  0.166615  0.999928  1
  Si  Si201  1  0.500233  0.166428  0.333597  1
  Si  Si202  1  0.500360  0.166574  0.666324  1
  Si  Si203  1  0.500218  0.500229  0.999775  1
  Si  Si204  1  0.500271  0.500268  0.333597  1
  Si  Si205  1  0.500072  0.500109  0.666447  1
  Si  Si206  1  0.500388  0.832983  0.999950  1
  Si  Si207  1  0.500009  0.833269  0.333581  1
  Si  Si208  1  0.500122  0.833318  0.666696  1
  Si  Si209  1  0.832247  0.165571  0.998976  1
  Si  Si210  1  0.831781  0.167371  0.334921  1
  Si  Si211  1  0.832976  0.166476  0.666436  1
  Si  Si212  1  0.831804  0.501493  0.000671  1
  Si  Si213  1  0.832802  0.500626  0.333871  1
  Si  Si214  1  0.833113  0.500209  0.666572  1
  Si  Si215  1  0.832952  0.833194  0.999916  1
  Si  Si216  1  0.833184  0.833027  0.333540  1
  Si  Si217  1  0.833318  0.833214  0.666623  1
