# generated using pymatgen
data_CoSi216
_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   CoSi216
_chemical_formula_sum   'Co1 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
  Co  Co1  1  0.041608  0.291723  0.125058  1
  Si  Si2  1  0.251844  0.249545  0.082879  1
  Si  Si3  1  0.249769  0.249870  0.416145  1
  Si  Si4  1  0.250620  0.249660  0.749361  1
  Si  Si5  1  0.249770  0.582812  0.083203  1
  Si  Si6  1  0.249877  0.583609  0.416934  1
  Si  Si7  1  0.249874  0.583163  0.750079  1
  Si  Si8  1  0.250620  0.916028  0.082993  1
  Si  Si9  1  0.249874  0.916746  0.416496  1
  Si  Si10  1  0.250082  0.916732  0.750064  1
  Si  Si11  1  0.583339  0.249871  0.083205  1
  Si  Si12  1  0.582991  0.250049  0.416952  1
  Si  Si13  1  0.583592  0.249950  0.749883  1
  Si  Si14  1  0.582991  0.583619  0.083381  1
  Si  Si15  1  0.583191  0.583557  0.416890  1
  Si  Si16  1  0.583278  0.583331  0.750192  1
  Si  Si17  1  0.583592  0.916550  0.083283  1
  Si  Si18  1  0.583279  0.916859  0.416664  1
  Si  Si19  1  0.583434  0.916727  0.750060  1
  Si  Si20  1  0.913264  0.250395  0.083719  1
  Si  Si21  1  0.916045  0.250382  0.417818  1
  Si  Si22  1  0.916750  0.250184  0.750023  1
  Si  Si23  1  0.916045  0.584485  0.083715  1
  Si  Si24  1  0.916330  0.583274  0.416608  1
  Si  Si25  1  0.916624  0.583161  0.750188  1
  Si  Si26  1  0.916749  0.916689  0.083519  1
  Si  Si27  1  0.916624  0.916856  0.416493  1
  Si  Si28  1  0.916785  0.916419  0.749752  1
  Si  Si29  1  0.000398  0.998799  0.999389  1
  Si  Si30  1  0.999872  0.000404  0.333060  1
  Si  Si31  1  0.000106  0.999670  0.666311  1
  Si  Si32  1  0.000436  0.332893  0.996555  1
  Si  Si33  1  0.999597  0.333736  0.335124  1
  Si  Si34  1  0.999959  0.333374  0.666510  1
  Si  Si35  1  0.000162  0.666538  0.000015  1
  Si  Si36  1  0.999652  0.667283  0.333941  1
  Si  Si37  1  0.999840  0.666677  0.666789  1
  Si  Si38  1  0.333267  0.000066  0.999732  1
  Si  Si39  1  0.333571  0.999762  0.333179  1
  Si  Si40  1  0.333405  0.999928  0.666633  1
  Si  Si41  1  0.334535  0.332933  0.999389  1
  Si  Si42  1  0.332930  0.333461  0.333060  1
  Si  Si43  1  0.333663  0.333227  0.666311  1
  Si  Si44  1  0.333205  0.666446  0.000033  1
  Si  Si45  1  0.333207  0.666619  0.333249  1
  Si  Si46  1  0.333183  0.666631  0.666734  1
  Si  Si47  1  0.666888  0.000128  0.000034  1
  Si  Si48  1  0.666712  0.000127  0.333251  1
  Si  Si49  1  0.666702  0.000150  0.666734  1
  Si  Si50  1  0.666794  0.333170  0.000016  1
  Si  Si51  1  0.666055  0.333679  0.333946  1
  Si  Si52  1  0.666656  0.333493  0.666789  1
  Si  Si53  1  0.666425  0.666908  0.000101  1
  Si  Si54  1  0.666704  0.666629  0.333522  1
  Si  Si55  1  0.666551  0.666783  0.666873  1
  Si  Si56  1  0.250718  0.082616  0.248866  1
  Si  Si57  1  0.250155  0.083178  0.583094  1
  Si  Si58  1  0.249439  0.083894  0.917227  1
  Si  Si59  1  0.248680  0.417504  0.250835  1
  Si  Si60  1  0.249961  0.416470  0.583284  1
  Si  Si61  1  0.250718  0.415533  0.915949  1
  Si  Si62  1  0.249961  0.749951  0.249802  1
  Si  Si63  1  0.249965  0.750180  0.583513  1
  Si  Si64  1  0.250155  0.749761  0.916511  1
  Si  Si65  1  0.583382  0.083372  0.249802  1
  Si  Si66  1  0.583153  0.083369  0.583513  1
  Si  Si67  1  0.583572  0.083178  0.916511  1
  Si  Si68  1  0.583077  0.416923  0.250256  1
  Si  Si69  1  0.583374  0.416868  0.583292  1
  Si  Si70  1  0.583382  0.416469  0.916705  1
  Si  Si71  1  0.583375  0.749959  0.250202  1
  Si  Si72  1  0.583187  0.750146  0.583479  1
  Si  Si73  1  0.583153  0.750180  0.916702  1
  Si  Si74  1  0.915829  0.084654  0.250835  1
  Si  Si75  1  0.916863  0.083372  0.583284  1
  Si  Si76  1  0.917800  0.082615  0.915949  1
  Si  Si77  1  0.917599  0.415734  0.249067  1
  Si  Si78  1  0.916420  0.416914  0.583606  1
  Si  Si79  1  0.915829  0.417505  0.917984  1
  Si  Si80  1  0.916419  0.750271  0.250248  1
  Si  Si81  1  0.916465  0.749959  0.583292  1
  Si  Si82  1  0.916863  0.749951  0.916705  1
  Si  Si83  1  0.000443  0.163226  0.166229  1
  Si  Si84  1  0.000162  0.166681  0.499872  1
  Si  Si85  1  0.000398  0.166055  0.832133  1
  Si  Si86  1  0.999597  0.501790  0.167070  1
  Si  Si87  1  0.999652  0.500608  0.500617  1
  Si  Si88  1  0.999871  0.499728  0.833736  1
  Si  Si89  1  0.999958  0.833176  0.166709  1
  Si  Si90  1  0.999840  0.833458  0.500010  1
  Si  Si91  1  0.000106  0.832978  0.833004  1
  Si  Si92  1  0.334535  0.166055  0.166267  1
  Si  Si93  1  0.333206  0.166700  0.499779  1
  Si  Si94  1  0.333267  0.166399  0.833400  1
  Si  Si95  1  0.332931  0.499727  0.166794  1
  Si  Si96  1  0.333203  0.499919  0.499949  1
  Si  Si97  1  0.333571  0.499846  0.833096  1
  Si  Si98  1  0.333663  0.832978  0.166560  1
  Si  Si99  1  0.333183  0.833400  0.499964  1
  Si  Si100  1  0.333405  0.833300  0.833261  1
  Si  Si101  1  0.666795  0.166683  0.166504  1
  Si  Si102  1  0.666425  0.166768  0.500241  1
  Si  Si103  1  0.666888  0.166700  0.833461  1
  Si  Si104  1  0.666056  0.500613  0.167011  1
  Si  Si105  1  0.666704  0.500188  0.499963  1
  Si  Si106  1  0.666712  0.499918  0.833460  1
  Si  Si107  1  0.666656  0.833456  0.166826  1
  Si  Si108  1  0.666551  0.833539  0.500116  1
  Si  Si109  1  0.666702  0.833401  0.833484  1
  Si  Si110  1  0.082946  0.250391  0.253405  1
  Si  Si111  1  0.083465  0.249868  0.583326  1
  Si  Si112  1  0.083787  0.249546  0.914822  1
  Si  Si113  1  0.082952  0.584485  0.250621  1
  Si  Si114  1  0.083285  0.583618  0.583675  1
  Si  Si115  1  0.083463  0.582811  0.916898  1
  Si  Si116  1  0.083148  0.916689  0.249917  1
  Si  Si117  1  0.083384  0.916550  0.583074  1
  Si  Si118  1  0.083673  0.916028  0.916046  1
  Si  Si119  1  0.416647  0.250188  0.249914  1
  Si  Si120  1  0.416783  0.249949  0.583074  1
  Si  Si121  1  0.417305  0.249659  0.916046  1
  Si  Si122  1  0.416480  0.583160  0.250041  1
  Si  Si123  1  0.416474  0.583331  0.583387  1
  Si  Si124  1  0.416585  0.583165  0.916793  1
  Si  Si125  1  0.416915  0.916419  0.249882  1
  Si  Si126  1  0.416606  0.916727  0.583233  1
  Si  Si127  1  0.416602  0.916731  0.916583  1
  Si  Si128  1  0.748849  0.250381  0.250621  1
  Si  Si129  1  0.749715  0.250049  0.583675  1
  Si  Si130  1  0.750522  0.249870  0.916898  1
  Si  Si131  1  0.750061  0.583276  0.250338  1
  Si  Si132  1  0.749777  0.583556  0.583475  1
  Si  Si133  1  0.749724  0.583601  0.916790  1
  Si  Si134  1  0.750173  0.916854  0.250042  1
  Si  Si135  1  0.750002  0.916859  0.583387  1
  Si  Si136  1  0.750169  0.916747  0.916793  1
  Si  Si137  1  0.167278  0.998799  0.166268  1
  Si  Si138  1  0.166633  0.000127  0.499779  1
  Si  Si139  1  0.166934  0.000066  0.833400  1
  Si  Si140  1  0.170109  0.332889  0.166232  1
  Si  Si141  1  0.166651  0.333170  0.499872  1
  Si  Si142  1  0.167278  0.332935  0.832134  1
  Si  Si143  1  0.166650  0.666539  0.166503  1
  Si  Si144  1  0.166565  0.666908  0.500241  1
  Si  Si145  1  0.166633  0.666445  0.833461  1
  Si  Si146  1  0.500355  0.999670  0.166561  1
  Si  Si147  1  0.499933  0.000150  0.499965  1
  Si  Si148  1  0.500033  0.999928  0.833261  1
  Si  Si149  1  0.500166  0.333383  0.166717  1
  Si  Si150  1  0.499875  0.333493  0.500010  1
  Si  Si151  1  0.500355  0.333227  0.833004  1
  Si  Si152  1  0.499877  0.666677  0.166826  1
  Si  Si153  1  0.499794  0.666783  0.500117  1
  Si  Si154  1  0.499932  0.666631  0.833484  1
  Si  Si155  1  0.833605  0.000403  0.166795  1
  Si  Si156  1  0.833413  0.000130  0.499950  1
  Si  Si157  1  0.833487  0.999762  0.833095  1
  Si  Si158  1  0.831543  0.333736  0.167070  1
  Si  Si159  1  0.832727  0.333680  0.500618  1
  Si  Si160  1  0.833606  0.333462  0.833736  1
  Si  Si161  1  0.832726  0.667284  0.167014  1
  Si  Si162  1  0.833145  0.666629  0.499963  1
  Si  Si163  1  0.833412  0.666617  0.833464  1
  Si  Si164  1  0.083787  0.081488  0.082879  1
  Si  Si165  1  0.083464  0.083564  0.416145  1
  Si  Si166  1  0.083673  0.082713  0.749361  1
  Si  Si167  1  0.082938  0.420068  0.083721  1
  Si  Si168  1  0.082951  0.417288  0.417818  1
  Si  Si169  1  0.083149  0.416583  0.750023  1
  Si  Si170  1  0.083464  0.749994  0.083202  1
  Si  Si171  1  0.083284  0.750341  0.416952  1
  Si  Si172  1  0.083384  0.749740  0.749884  1
  Si  Si173  1  0.417305  0.082712  0.082992  1
  Si  Si174  1  0.416587  0.083459  0.416497  1
  Si  Si175  1  0.416602  0.083250  0.750064  1
  Si  Si176  1  0.416648  0.416581  0.083521  1
  Si  Si177  1  0.416478  0.416710  0.416492  1
  Si  Si178  1  0.416914  0.416548  0.749752  1
  Si  Si179  1  0.416783  0.749741  0.083283  1
  Si  Si180  1  0.416474  0.750054  0.416664  1
  Si  Si181  1  0.416606  0.749899  0.750060  1
  Si  Si182  1  0.750521  0.083563  0.083204  1
  Si  Si183  1  0.749724  0.083457  0.416934  1
  Si  Si184  1  0.750169  0.083459  0.750080  1
  Si  Si185  1  0.748850  0.417287  0.083714  1
  Si  Si186  1  0.750062  0.417005  0.416612  1
  Si  Si187  1  0.750173  0.416709  0.750188  1
  Si  Si188  1  0.749715  0.750341  0.083382  1
  Si  Si189  1  0.749777  0.750141  0.416889  1
  Si  Si190  1  0.750002  0.750054  0.750193  1
  Si  Si191  1  0.165792  0.167541  0.000874  1
  Si  Si192  1  0.167548  0.165784  0.331917  1
  Si  Si193  1  0.166930  0.166403  0.666365  1
  Si  Si194  1  0.167547  0.498581  0.999122  1
  Si  Si195  1  0.165623  0.500691  0.334024  1
  Si  Si196  1  0.166565  0.499882  0.666666  1
  Si  Si197  1  0.166930  0.833032  0.999736  1
  Si  Si198  1  0.166565  0.833332  0.333216  1
  Si  Si199  1  0.166665  0.833383  0.666717  1
  Si  Si200  1  0.500302  0.166404  0.999737  1
  Si  Si201  1  0.500000  0.166769  0.333215  1
  Si  Si202  1  0.499950  0.166668  0.666716  1
  Si  Si203  1  0.500000  0.499881  0.000102  1
  Si  Si204  1  0.499856  0.500191  0.333524  1
  Si  Si205  1  0.500081  0.500108  0.666586  1
  Si  Si206  1  0.499950  0.833383  0.000002  1
  Si  Si207  1  0.500081  0.833252  0.333441  1
  Si  Si208  1  0.499915  0.833418  0.666752  1
  Si  Si209  1  0.834750  0.165784  0.999121  1
  Si  Si210  1  0.832642  0.167709  0.334024  1
  Si  Si211  1  0.833451  0.166768  0.666667  1
  Si  Si212  1  0.832642  0.500690  0.001043  1
  Si  Si213  1  0.833929  0.499405  0.332739  1
  Si  Si214  1  0.833143  0.500190  0.666813  1
  Si  Si215  1  0.833451  0.833333  0.000102  1
  Si  Si216  1  0.833143  0.833479  0.333524  1
  Si  Si217  1  0.833225  0.833252  0.666586  1