# generated using pymatgen
data_MnSi216
_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   MnSi216
_chemical_formula_sum   'Mn1 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
  Mn  Mn1  1  0.125033  0.208291  0.125048  1
  Si  Si2  1  0.256641  0.252354  0.083291  1
  Si  Si3  1  0.250988  0.250051  0.418540  1
  Si  Si4  1  0.250119  0.249865  0.749607  1
  Si  Si5  1  0.249979  0.583579  0.083473  1
  Si  Si6  1  0.250220  0.583892  0.417527  1
  Si  Si7  1  0.249914  0.583736  0.749644  1
  Si  Si8  1  0.250305  0.915974  0.083346  1
  Si  Si9  1  0.249997  0.916673  0.416491  1
  Si  Si10  1  0.250258  0.916486  0.750029  1
  Si  Si11  1  0.583510  0.250102  0.083206  1
  Si  Si12  1  0.583667  0.250027  0.417108  1
  Si  Si13  1  0.583540  0.250030  0.749613  1
  Si  Si14  1  0.583228  0.583432  0.083338  1
  Si  Si15  1  0.583453  0.583424  0.416827  1
  Si  Si16  1  0.583395  0.583518  0.750012  1
  Si  Si17  1  0.583434  0.916443  0.083349  1
  Si  Si18  1  0.583215  0.916445  0.416759  1
  Si  Si19  1  0.583289  0.916491  0.749890  1
  Si  Si20  1  0.914355  0.249895  0.082200  1
  Si  Si21  1  0.916013  0.249864  0.417418  1
  Si  Si22  1  0.915869  0.250445  0.749110  1
  Si  Si23  1  0.916416  0.583776  0.083077  1
  Si  Si24  1  0.916466  0.583445  0.416562  1
  Si  Si25  1  0.916526  0.583216  0.750225  1
  Si  Si26  1  0.915684  0.915890  0.083508  1
  Si  Si27  1  0.916508  0.916168  0.417326  1
  Si  Si28  1  0.916570  0.916616  0.749622  1
  Si  Si29  1  0.996467  0.997498  0.996184  1
  Si  Si30  1  0.000821  0.999084  0.334606  1
  Si  Si31  1  0.000038  0.999900  0.666506  1
  Si  Si32  1  0.000532  0.332431  0.000429  1
  Si  Si33  1  0.997461  0.335019  0.334031  1
  Si  Si34  1  0.999676  0.333642  0.666326  1
  Si  Si35  1  0.999760  0.666953  0.999791  1
  Si  Si36  1  0.999892  0.666722  0.333406  1
  Si  Si37  1  0.999795  0.666304  0.666684  1
  Si  Si38  1  0.334384  0.999217  0.000895  1
  Si  Si39  1  0.332959  0.000174  0.332956  1
  Si  Si40  1  0.333596  0.999694  0.666767  1
  Si  Si41  1  0.334459  0.335220  0.996935  1
  Si  Si42  1  0.334774  0.332453  0.334917  1
  Si  Si43  1  0.333439  0.333369  0.666494  1
  Si  Si44  1  0.333319  0.666681  0.999942  1
  Si  Si45  1  0.333460  0.666540  0.333523  1
  Si  Si46  1  0.333443  0.666945  0.666510  1
  Si  Si47  1  0.666523  0.999845  0.000000  1
  Si  Si48  1  0.666737  0.999724  0.333593  1
  Si  Si49  1  0.666317  0.999812  0.666367  1
  Si  Si50  1  0.666301  0.333599  0.999692  1
  Si  Si51  1  0.666459  0.333361  0.333329  1
  Si  Si52  1  0.666957  0.333546  0.666834  1
  Si  Si53  1  0.666690  0.666374  0.999920  1
  Si  Si54  1  0.666430  0.666886  0.333379  1
  Si  Si55  1  0.666598  0.666697  0.666558  1
  Si  Si56  1  0.249443  0.084231  0.249689  1
  Si  Si57  1  0.250301  0.083038  0.583708  1
  Si  Si58  1  0.252531  0.081722  0.916017  1
  Si  Si59  1  0.253490  0.419175  0.253833  1
  Si  Si60  1  0.249950  0.416885  0.583563  1
  Si  Si61  1  0.249130  0.417560  0.915403  1
  Si  Si62  1  0.250155  0.749679  0.250194  1
  Si  Si63  1  0.250159  0.750395  0.583388  1
  Si  Si64  1  0.249993  0.749977  0.916602  1
  Si  Si65  1  0.583671  0.083086  0.250290  1
  Si  Si66  1  0.583019  0.083148  0.583164  1
  Si  Si67  1  0.583447  0.083253  0.916534  1
  Si  Si68  1  0.583406  0.416855  0.249910  1
  Si  Si69  1  0.583669  0.416870  0.583660  1
  Si  Si70  1  0.583216  0.417004  0.916417  1
  Si  Si71  1  0.583249  0.750345  0.250160  1
  Si  Si72  1  0.583305  0.749875  0.583440  1
  Si  Si73  1  0.583540  0.749751  0.916609  1
  Si  Si74  1  0.915528  0.081465  0.253073  1
  Si  Si75  1  0.916508  0.083329  0.583537  1
  Si  Si76  1  0.915202  0.084200  0.915104  1
  Si  Si77  1  0.915584  0.417492  0.249118  1
  Si  Si78  1  0.916375  0.417006  0.583213  1
  Si  Si79  1  0.916998  0.416411  0.917060  1
  Si  Si80  1  0.916523  0.749973  0.250088  1
  Si  Si81  1  0.916539  0.749718  0.583539  1
  Si  Si82  1  0.916462  0.750171  0.916453  1
  Si  Si83  1  0.993394  0.164296  0.166785  1
  Si  Si84  1  0.999867  0.166811  0.500396  1
  Si  Si85  1  0.998956  0.166652  0.831515  1
  Si  Si86  1  0.999643  0.500741  0.166670  1
  Si  Si87  1  0.999729  0.500245  0.499979  1
  Si  Si88  1  0.999976  0.499904  0.833462  1
  Si  Si89  1  0.999876  0.833155  0.166596  1
  Si  Si90  1  0.000027  0.832958  0.500369  1
  Si  Si91  1  0.999764  0.832802  0.832464  1
  Si  Si92  1  0.335638  0.166731  0.167888  1
  Si  Si93  1  0.334110  0.166250  0.500925  1
  Si  Si94  1  0.333988  0.166805  0.832570  1
  Si  Si95  1  0.334237  0.500794  0.166471  1
  Si  Si96  1  0.333433  0.500085  0.500348  1
  Si  Si97  1  0.333434  0.500443  0.832615  1
  Si  Si98  1  0.333529  0.832824  0.166846  1
  Si  Si99  1  0.333442  0.833387  0.499825  1
  Si  Si100  1  0.333420  0.833247  0.833432  1
  Si  Si101  1  0.666440  0.166586  0.166700  1
  Si  Si102  1  0.666502  0.166640  0.500356  1
  Si  Si103  1  0.666334  0.166634  0.832915  1
  Si  Si104  1  0.666524  0.500201  0.166586  1
  Si  Si105  1  0.666688  0.500070  0.500042  1
  Si  Si106  1  0.666723  0.500263  0.833290  1
  Si  Si107  1  0.666657  0.833314  0.166706  1
  Si  Si108  1  0.666501  0.833174  0.500045  1
  Si  Si109  1  0.666529  0.833197  0.833149  1
  Si  Si110  1  0.083519  0.251625  0.256366  1
  Si  Si111  1  0.083209  0.250125  0.583573  1
  Si  Si112  1  0.082245  0.250122  0.914018  1
  Si  Si113  1  0.083399  0.583590  0.250110  1
  Si  Si114  1  0.083239  0.583410  0.583222  1
  Si  Si115  1  0.083021  0.583852  0.916328  1
  Si  Si116  1  0.083276  0.915783  0.250568  1
  Si  Si117  1  0.083341  0.916369  0.583520  1
  Si  Si118  1  0.083585  0.915751  0.915532  1
  Si  Si119  1  0.418346  0.250045  0.251076  1
  Si  Si120  1  0.417133  0.250003  0.583696  1
  Si  Si121  1  0.417604  0.249787  0.915728  1
  Si  Si122  1  0.417332  0.583782  0.250258  1
  Si  Si123  1  0.416856  0.583485  0.583489  1
  Si  Si124  1  0.416500  0.583410  0.916534  1
  Si  Si125  1  0.416437  0.916749  0.249885  1
  Si  Si126  1  0.416776  0.916405  0.583304  1
  Si  Si127  1  0.417166  0.916240  0.916636  1
  Si  Si128  1  0.749611  0.249851  0.250052  1
  Si  Si129  1  0.749704  0.250054  0.583352  1
  Si  Si130  1  0.749107  0.250387  0.915902  1
  Si  Si131  1  0.749621  0.583659  0.249911  1
  Si  Si132  1  0.749934  0.583476  0.583328  1
  Si  Si133  1  0.750239  0.583269  0.916657  1
  Si  Si134  1  0.749920  0.916402  0.250273  1
  Si  Si135  1  0.749802  0.916515  0.583309  1
  Si  Si136  1  0.749674  0.916600  0.916527  1
  Si  Si137  1  0.166835  0.998615  0.167183  1
  Si  Si138  1  0.167068  0.999540  0.500577  1
  Si  Si139  1  0.166723  0.999954  0.833069  1
  Si  Si140  1  0.169688  0.340969  0.169165  1
  Si  Si141  1  0.166524  0.333477  0.500408  1
  Si  Si142  1  0.166607  0.333708  0.832075  1
  Si  Si143  1  0.166643  0.666819  0.166735  1
  Si  Si144  1  0.166629  0.667016  0.500465  1
  Si  Si145  1  0.166666  0.666847  0.833166  1
  Si  Si146  1  0.500438  0.999735  0.166992  1
  Si  Si147  1  0.499802  0.999758  0.499847  1
  Si  Si148  1  0.500134  0.999868  0.833323  1
  Si  Si149  1  0.500266  0.333380  0.166528  1
  Si  Si150  1  0.500514  0.333327  0.500536  1
  Si  Si151  1  0.500477  0.333592  0.832701  1
  Si  Si152  1  0.500295  0.666947  0.166665  1
  Si  Si153  1  0.500047  0.666633  0.500033  1
  Si  Si154  1  0.500020  0.666666  0.833319  1
  Si  Si155  1  0.833004  0.999851  0.166723  1
  Si  Si156  1  0.833284  0.999930  0.500242  1
  Si  Si157  1  0.832538  0.999641  0.832484  1
  Si  Si158  1  0.832339  0.333532  0.166596  1
  Si  Si159  1  0.832879  0.333574  0.500269  1
  Si  Si160  1  0.833386  0.333457  0.833412  1
  Si  Si161  1  0.833183  0.666791  0.166712  1
  Si  Si162  1  0.833192  0.666709  0.499985  1
  Si  Si163  1  0.833189  0.666747  0.833205  1
  Si  Si164  1  0.080288  0.075638  0.080882  1
  Si  Si165  1  0.083357  0.082910  0.417996  1
  Si  Si166  1  0.083489  0.083273  0.749646  1
  Si  Si167  1  0.083165  0.418074  0.082909  1
  Si  Si168  1  0.083268  0.416769  0.417021  1
  Si  Si169  1  0.082957  0.417060  0.749456  1
  Si  Si170  1  0.083144  0.749886  0.083293  1
  Si  Si171  1  0.083253  0.749775  0.416906  1
  Si  Si172  1  0.083385  0.749657  0.749539  1
  Si  Si173  1  0.417649  0.083127  0.083426  1
  Si  Si174  1  0.416523  0.083162  0.416566  1
  Si  Si175  1  0.417098  0.083064  0.749711  1
  Si  Si176  1  0.416978  0.416831  0.083300  1
  Si  Si177  1  0.417436  0.416969  0.417538  1
  Si  Si178  1  0.416735  0.416740  0.749705  1
  Si  Si179  1  0.416810  0.749789  0.083236  1
  Si  Si180  1  0.416783  0.749916  0.416780  1
  Si  Si181  1  0.416771  0.749973  0.750088  1
  Si  Si182  1  0.749658  0.083246  0.083451  1
  Si  Si183  1  0.749559  0.083095  0.417271  1
  Si  Si184  1  0.749482  0.083336  0.749501  1
  Si  Si185  1  0.749543  0.416906  0.082996  1
  Si  Si186  1  0.749763  0.416665  0.416587  1
  Si  Si187  1  0.750151  0.416958  0.750195  1
  Si  Si188  1  0.749601  0.749730  0.083443  1
  Si  Si189  1  0.749840  0.749973  0.416769  1
  Si  Si190  1  0.749896  0.750014  0.749860  1
  Si  Si191  1  0.166488  0.165035  0.993717  1
  Si  Si192  1  0.167725  0.166532  0.336079  1
  Si  Si193  1  0.166748  0.166605  0.666440  1
  Si  Si194  1  0.166692  0.500865  0.999458  1
  Si  Si195  1  0.166378  0.500950  0.334503  1
  Si  Si196  1  0.166574  0.500314  0.666531  1
  Si  Si197  1  0.166487  0.833128  0.999977  1
  Si  Si198  1  0.166879  0.832744  0.333676  1
  Si  Si199  1  0.166700  0.833336  0.666781  1
  Si  Si200  1  0.500321  0.166786  0.999891  1
  Si  Si201  1  0.500859  0.166259  0.334126  1
  Si  Si202  1  0.500247  0.166632  0.666677  1
  Si  Si203  1  0.500007  0.500287  0.999769  1
  Si  Si204  1  0.500227  0.500043  0.333452  1
  Si  Si205  1  0.500156  0.500174  0.666669  1
  Si  Si206  1  0.500305  0.833005  0.000041  1
  Si  Si207  1  0.499725  0.833465  0.333373  1
  Si  Si208  1  0.499982  0.833162  0.666670  1
  Si  Si209  1  0.831642  0.166611  0.998950  1
  Si  Si210  1  0.832383  0.166910  0.334244  1
  Si  Si211  1  0.832852  0.166697  0.666347  1
  Si  Si212  1  0.833452  0.499909  0.000052  1
  Si  Si213  1  0.832722  0.500415  0.333368  1
  Si  Si214  1  0.833191  0.500239  0.666697  1
  Si  Si215  1  0.832545  0.832863  0.999767  1
  Si  Si216  1  0.833320  0.833212  0.333492  1
  Si  Si217  1  0.833158  0.833240  0.666500  1
