# 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  0.041595  0.291739  0.125072  1
  Si  Si2  1  0.251286  0.250129  0.083462  1
  Si  Si3  1  0.249704  0.249674  0.416060  1
  Si  Si4  1  0.250499  0.249757  0.749502  1
  Si  Si5  1  0.249704  0.582727  0.083007  1
  Si  Si6  1  0.249675  0.583589  0.416922  1
  Si  Si7  1  0.249875  0.583099  0.750100  1
  Si  Si8  1  0.250499  0.916169  0.083090  1
  Si  Si9  1  0.249875  0.916768  0.416432  1
  Si  Si10  1  0.250099  0.916866  0.750199  1
  Si  Si11  1  0.583344  0.249913  0.083246  1
  Si  Si12  1  0.582956  0.250087  0.416886  1
  Si  Si13  1  0.583556  0.249821  0.749939  1
  Si  Si14  1  0.582957  0.583550  0.083423  1
  Si  Si15  1  0.583188  0.583412  0.416745  1
  Si  Si16  1  0.583389  0.583167  0.750142  1
  Si  Si17  1  0.583556  0.916606  0.083154  1
  Si  Si18  1  0.583388  0.916810  0.416501  1
  Si  Si19  1  0.583552  0.916632  0.749966  1
  Si  Si20  1  0.913794  0.249772  0.083105  1
  Si  Si21  1  0.916259  0.250501  0.417474  1
  Si  Si22  1  0.916747  0.250189  0.750303  1
  Si  Si23  1  0.916258  0.584142  0.083835  1
  Si  Si24  1  0.916425  0.583070  0.416406  1
  Si  Si25  1  0.916825  0.583110  0.750245  1
  Si  Si26  1  0.916747  0.916969  0.083523  1
  Si  Si27  1  0.916825  0.916912  0.416443  1
  Si  Si28  1  0.916825  0.916350  0.749683  1
  Si  Si29  1  0.000505  0.999174  0.999568  1
  Si  Si30  1  0.999691  0.000677  0.333042  1
  Si  Si31  1  0.000114  0.999769  0.666301  1
  Si  Si32  1  0.999805  0.333529  0.997108  1
  Si  Si33  1  0.000131  0.333203  0.334574  1
  Si  Si34  1  0.999945  0.333387  0.666682  1
  Si  Si35  1  0.000163  0.666411  0.000074  1
  Si  Si36  1  0.999772  0.667169  0.333801  1
  Si  Si37  1  0.999860  0.666714  0.666868  1
  Si  Si38  1  0.333073  0.000261  0.999730  1
  Si  Si39  1  0.333564  0.999770  0.333035  1
  Si  Si40  1  0.333407  0.999927  0.666553  1
  Si  Si41  1  0.334160  0.332829  0.999568  1
  Si  Si42  1  0.332657  0.333642  0.333042  1
  Si  Si43  1  0.333565  0.333220  0.666301  1
  Si  Si44  1  0.333147  0.666455  0.000100  1
  Si  Si45  1  0.333120  0.666563  0.333203  1
  Si  Si46  1  0.333182  0.666534  0.666705  1
  Si  Si47  1  0.666878  0.000187  0.000100  1
  Si  Si48  1  0.666770  0.000213  0.333203  1
  Si  Si49  1  0.666800  0.000152  0.666706  1
  Si  Si50  1  0.666922  0.333171  0.000074  1
  Si  Si51  1  0.666166  0.333558  0.333804  1
  Si  Si52  1  0.666620  0.333474  0.666868  1
  Si  Si53  1  0.666329  0.667005  0.000149  1
  Si  Si54  1  0.666841  0.666492  0.333404  1
  Si  Si55  1  0.666608  0.666726  0.666840  1
  Si  Si56  1  0.250662  0.082671  0.248957  1
  Si  Si57  1  0.250133  0.083201  0.583090  1
  Si  Si58  1  0.248927  0.084406  0.917739  1
  Si  Si59  1  0.248418  0.417402  0.250736  1
  Si  Si60  1  0.249797  0.416444  0.583228  1
  Si  Si61  1  0.250662  0.415624  0.916004  1
  Si  Si62  1  0.249797  0.749895  0.249777  1
  Si  Si63  1  0.249969  0.750242  0.583575  1
  Si  Si64  1  0.250133  0.749756  0.916534  1
  Si  Si65  1  0.583439  0.083537  0.249777  1
  Si  Si66  1  0.583094  0.083363  0.583577  1
  Si  Si67  1  0.583577  0.083201  0.916534  1
  Si  Si68  1  0.583065  0.416877  0.250219  1
  Si  Si69  1  0.583509  0.416651  0.583158  1
  Si  Si70  1  0.583438  0.416444  0.916870  1
  Si  Si71  1  0.583510  0.749826  0.249984  1
  Si  Si72  1  0.583266  0.750067  0.583400  1
  Si  Si73  1  0.583093  0.750243  0.916697  1
  Si  Si74  1  0.915931  0.084916  0.250736  1
  Si  Si75  1  0.916889  0.083537  0.583228  1
  Si  Si76  1  0.917710  0.082671  0.916005  1
  Si  Si77  1  0.918165  0.415169  0.248502  1
  Si  Si78  1  0.916448  0.416877  0.583602  1
  Si  Si79  1  0.915931  0.417402  0.918249  1
  Si  Si80  1  0.916451  0.750267  0.250215  1
  Si  Si81  1  0.916682  0.749826  0.583157  1
  Si  Si82  1  0.916889  0.749895  0.916870  1
  Si  Si83  1  0.999805  0.163775  0.166862  1
  Si  Si84  1  0.000163  0.166741  0.499744  1
  Si  Si85  1  0.000505  0.166234  0.832507  1
  Si  Si86  1  0.000131  0.501241  0.166535  1
  Si  Si87  1  0.999767  0.500462  0.500506  1
  Si  Si88  1  0.999691  0.499709  0.834010  1
  Si  Si89  1  0.999944  0.833348  0.166722  1
  Si  Si90  1  0.999860  0.833535  0.500047  1
  Si  Si91  1  0.000114  0.832968  0.833102  1
  Si  Si92  1  0.334159  0.166234  0.166162  1
  Si  Si93  1  0.333147  0.166767  0.499788  1
  Si  Si94  1  0.333073  0.166397  0.833594  1
  Si  Si95  1  0.332656  0.499709  0.166976  1
  Si  Si96  1  0.333120  0.499870  0.499896  1
  Si  Si97  1  0.333564  0.499702  0.833103  1
  Si  Si98  1  0.333565  0.832968  0.166553  1
  Si  Si99  1  0.333182  0.833372  0.499867  1
  Si  Si100  1  0.333407  0.833220  0.833260  1
  Si  Si101  1  0.666922  0.166741  0.166504  1
  Si  Si102  1  0.666328  0.166814  0.500339  1
  Si  Si103  1  0.666878  0.166767  0.833520  1
  Si  Si104  1  0.666160  0.500462  0.166899  1
  Si  Si105  1  0.666841  0.500071  0.499826  1
  Si  Si106  1  0.666770  0.499870  0.833547  1
  Si  Si107  1  0.666620  0.833535  0.166807  1
  Si  Si108  1  0.666608  0.833507  0.500059  1
  Si  Si109  1  0.666800  0.833373  0.833486  1
  Si  Si110  1  0.083561  0.249772  0.252872  1
  Si  Si111  1  0.083421  0.249913  0.583323  1
  Si  Si112  1  0.083204  0.250129  0.915381  1
  Si  Si113  1  0.082832  0.584142  0.250408  1
  Si  Si114  1  0.083244  0.583550  0.583710  1
  Si  Si115  1  0.083660  0.582727  0.916962  1
  Si  Si116  1  0.083144  0.916969  0.249920  1
  Si  Si117  1  0.083513  0.916606  0.583111  1
  Si  Si118  1  0.083576  0.916169  0.916167  1
  Si  Si119  1  0.416364  0.250189  0.249919  1
  Si  Si120  1  0.416728  0.249821  0.583110  1
  Si  Si121  1  0.417165  0.249757  0.916167  1
  Si  Si122  1  0.416422  0.583109  0.249842  1
  Si  Si123  1  0.416525  0.583167  0.583278  1
  Si  Si124  1  0.416566  0.583099  0.916792  1
  Si  Si125  1  0.416984  0.916350  0.249841  1
  Si  Si126  1  0.416702  0.916632  0.583115  1
  Si  Si127  1  0.416468  0.916866  0.916567  1
  Si  Si128  1  0.749192  0.250501  0.250408  1
  Si  Si129  1  0.749780  0.250087  0.583711  1
  Si  Si130  1  0.750607  0.249674  0.916963  1
  Si  Si131  1  0.750261  0.583070  0.250241  1
  Si  Si132  1  0.749922  0.583412  0.583478  1
  Si  Si133  1  0.749744  0.583589  0.916991  1
  Si  Si134  1  0.750224  0.916912  0.249842  1
  Si  Si135  1  0.750166  0.916810  0.583281  1
  Si  Si136  1  0.750236  0.916768  0.916793  1
  Si  Si137  1  0.167099  0.999174  0.166162  1
  Si  Si138  1  0.166567  0.000187  0.499788  1
  Si  Si139  1  0.166936  0.000261  0.833594  1
  Si  Si140  1  0.169558  0.333529  0.166862  1
  Si  Si141  1  0.166592  0.333171  0.499744  1
  Si  Si142  1  0.167099  0.332829  0.832507  1
  Si  Si143  1  0.166593  0.666411  0.166504  1
  Si  Si144  1  0.166518  0.667004  0.500338  1
  Si  Si145  1  0.166567  0.666455  0.833520  1
  Si  Si146  1  0.500365  0.999769  0.166553  1
  Si  Si147  1  0.499962  0.000152  0.499867  1
  Si  Si148  1  0.500113  0.999927  0.833260  1
  Si  Si149  1  0.499984  0.333387  0.166722  1
  Si  Si150  1  0.499798  0.333474  0.500047  1
  Si  Si151  1  0.500366  0.333220  0.833102  1
  Si  Si152  1  0.499798  0.666714  0.166807  1
  Si  Si153  1  0.499827  0.666726  0.500059  1
  Si  Si154  1  0.499962  0.666534  0.833485  1
  Si  Si155  1  0.833625  0.000677  0.166976  1
  Si  Si156  1  0.833463  0.000213  0.499897  1
  Si  Si157  1  0.833632  0.999770  0.833103  1
  Si  Si158  1  0.832093  0.333203  0.166535  1
  Si  Si159  1  0.832862  0.333558  0.500500  1
  Si  Si160  1  0.833625  0.333642  0.834010  1
  Si  Si161  1  0.832865  0.667169  0.166895  1
  Si  Si162  1  0.833263  0.666492  0.499825  1
  Si  Si163  1  0.833463  0.666563  0.833546  1
  Si  Si164  1  0.083204  0.082048  0.083462  1
  Si  Si165  1  0.083660  0.083629  0.416060  1
  Si  Si166  1  0.083576  0.082834  0.749502  1
  Si  Si167  1  0.083562  0.419539  0.083105  1
  Si  Si168  1  0.082830  0.417076  0.417476  1
  Si  Si169  1  0.083144  0.416587  0.750302  1
  Si  Si170  1  0.083421  0.749990  0.083246  1
  Si  Si171  1  0.083246  0.750377  0.416885  1
  Si  Si172  1  0.083513  0.749778  0.749939  1
  Si  Si173  1  0.417165  0.082834  0.083090  1
  Si  Si174  1  0.416566  0.083459  0.416432  1
  Si  Si175  1  0.416468  0.083234  0.750199  1
  Si  Si176  1  0.416365  0.416587  0.083523  1
  Si  Si177  1  0.416421  0.416509  0.416443  1
  Si  Si178  1  0.416984  0.416508  0.749683  1
  Si  Si179  1  0.416728  0.749777  0.083154  1
  Si  Si180  1  0.416524  0.749946  0.416501  1
  Si  Si181  1  0.416701  0.749782  0.749965  1
  Si  Si182  1  0.750607  0.083630  0.083007  1
  Si  Si183  1  0.749744  0.083658  0.416922  1
  Si  Si184  1  0.750236  0.083460  0.750101  1
  Si  Si185  1  0.749191  0.417076  0.083836  1
  Si  Si186  1  0.750262  0.416910  0.416405  1
  Si  Si187  1  0.750223  0.416509  0.750246  1
  Si  Si188  1  0.749782  0.750377  0.083421  1
  Si  Si189  1  0.749921  0.750145  0.416745  1
  Si  Si190  1  0.750166  0.749947  0.750143  1
  Si  Si191  1  0.165097  0.168236  0.001569  1
  Si  Si192  1  0.167407  0.165926  0.331805  1
  Si  Si193  1  0.166884  0.166450  0.666425  1
  Si  Si194  1  0.167407  0.498472  0.999259  1
  Si  Si195  1  0.165622  0.500666  0.333999  1
  Si  Si196  1  0.166463  0.499782  0.666783  1
  Si  Si197  1  0.166884  0.833092  0.999783  1
  Si  Si198  1  0.166463  0.833451  0.333115  1
  Si  Si199  1  0.166672  0.833525  0.666858  1
  Si  Si200  1  0.500242  0.166450  0.999783  1
  Si  Si201  1  0.499883  0.166870  0.333115  1
  Si  Si202  1  0.499808  0.166661  0.666858  1
  Si  Si203  1  0.499883  0.499782  0.000203  1
  Si  Si204  1  0.499735  0.500109  0.333444  1
  Si  Si205  1  0.500201  0.499970  0.666465  1
  Si  Si206  1  0.499808  0.833525  0.999994  1
  Si  Si207  1  0.500201  0.833132  0.333303  1
  Si  Si208  1  0.499972  0.833362  0.666695  1
  Si  Si209  1  0.834862  0.165926  0.999259  1
  Si  Si210  1  0.832668  0.167711  0.333999  1
  Si  Si211  1  0.833552  0.166871  0.666783  1
  Si  Si212  1  0.832668  0.500666  0.001045  1
  Si  Si213  1  0.834348  0.498986  0.332318  1
  Si  Si214  1  0.833223  0.500109  0.666931  1
  Si  Si215  1  0.833552  0.833450  0.000204  1
  Si  Si216  1  0.833224  0.833598  0.333443  1
  Si  Si217  1  0.833363  0.833132  0.666465  1