# generated using pymatgen
data_Si215B
_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   Si215B
_chemical_formula_sum   'Si215 B1'
_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  0.250015  0.250023  0.415784  1
  Si  Si2  1  0.250037  0.249959  0.750824  1
  Si  Si3  1  0.249954  0.582504  0.083305  1
  Si  Si4  1  0.249877  0.582131  0.415491  1
  Si  Si5  1  0.250195  0.582114  0.751124  1
  Si  Si6  1  0.249958  0.917518  0.083267  1
  Si  Si7  1  0.250186  0.917822  0.415481  1
  Si  Si8  1  0.249868  0.917789  0.751087  1
  Si  Si9  1  0.582481  0.250022  0.083311  1
  Si  Si10  1  0.582219  0.249836  0.415516  1
  Si  Si11  1  0.582193  0.250110  0.751143  1
  Si  Si12  1  0.582233  0.582213  0.083168  1
  Si  Si13  1  0.583242  0.583264  0.416464  1
  Si  Si14  1  0.583208  0.583201  0.750200  1
  Si  Si15  1  0.582225  0.917812  0.083486  1
  Si  Si16  1  0.583144  0.916790  0.416392  1
  Si  Si17  1  0.583229  0.916694  0.750138  1
  Si  Si18  1  0.917497  0.249999  0.083315  1
  Si  Si19  1  0.917790  0.250188  0.415464  1
  Si  Si20  1  0.917823  0.249826  0.751130  1
  Si  Si21  1  0.917869  0.582217  0.083463  1
  Si  Si22  1  0.916864  0.583264  0.416578  1
  Si  Si23  1  0.916803  0.583138  0.750057  1
  Si  Si24  1  0.917848  0.917849  0.083142  1
  Si  Si25  1  0.916859  0.916802  0.416568  1
  Si  Si26  1  0.916837  0.916819  0.749949  1
  Si  Si27  1  0.002053  0.002095  0.000451  1
  Si  Si28  1  0.000151  0.000125  0.333190  1
  Si  Si29  1  0.000353  0.000315  0.666807  1
  Si  Si30  1  0.001133  0.333309  0.999982  1
  Si  Si31  1  0.002064  0.332812  0.331210  1
  Si  Si32  1  0.000224  0.333237  0.666845  1
  Si  Si33  1  0.000257  0.666442  0.999961  1
  Si  Si34  1  0.000352  0.666453  0.333077  1
  Si  Si35  1  0.000262  0.666537  0.666680  1
  Si  Si36  1  0.333359  0.001087  0.999962  1
  Si  Si37  1  0.332824  0.002067  0.331210  1
  Si  Si38  1  0.333269  0.000244  0.666845  1
  Si  Si39  1  0.323515  0.323497  0.009808  1
  Si  Si40  1  0.333369  0.333362  0.332206  1
  Si  Si41  1  0.333210  0.333086  0.667009  1
  Si  Si42  1  0.333082  0.666334  0.000150  1
  Si  Si43  1  0.333214  0.666405  0.332992  1
  Si  Si44  1  0.333201  0.666045  0.667174  1
  Si  Si45  1  0.666474  0.000218  0.000025  1
  Si  Si46  1  0.666416  0.000351  0.333044  1
  Si  Si47  1  0.666636  0.000088  0.666653  1
  Si  Si48  1  0.666280  0.333175  0.000157  1
  Si  Si49  1  0.666434  0.333248  0.333021  1
  Si  Si50  1  0.666183  0.333134  0.667270  1
  Si  Si51  1  0.666294  0.666211  0.000315  1
  Si  Si52  1  0.666714  0.666663  0.333100  1
  Si  Si53  1  0.666483  0.666589  0.666649  1
  Si  Si54  1  0.250936  0.086866  0.246431  1
  Si  Si55  1  0.250052  0.083614  0.583269  1
  Si  Si56  1  0.249115  0.086837  0.920154  1
  Si  Si57  1  0.249087  0.413150  0.246462  1
  Si  Si58  1  0.250088  0.416364  0.583314  1
  Si  Si59  1  0.250933  0.413129  0.920159  1
  Si  Si60  1  0.249961  0.750004  0.249677  1
  Si  Si61  1  0.250078  0.749835  0.583305  1
  Si  Si62  1  0.249930  0.750004  0.916874  1
  Si  Si63  1  0.582733  0.083607  0.249700  1
  Si  Si64  1  0.583098  0.083456  0.583233  1
  Si  Si65  1  0.582942  0.083612  0.916960  1
  Si  Si66  1  0.582946  0.416384  0.249654  1
  Si  Si67  1  0.583200  0.416386  0.583362  1
  Si  Si68  1  0.582698  0.416469  0.916903  1
  Si  Si69  1  0.583157  0.750005  0.249707  1
  Si  Si70  1  0.583106  0.750042  0.583235  1
  Si  Si71  1  0.583233  0.749945  0.916964  1
  Si  Si72  1  0.917092  0.083645  0.249673  1
  Si  Si73  1  0.916924  0.083590  0.583282  1
  Si  Si74  1  0.917287  0.083610  0.916829  1
  Si  Si75  1  0.917298  0.416457  0.249707  1
  Si  Si76  1  0.916776  0.416390  0.583260  1
  Si  Si77  1  0.917101  0.416312  0.916979  1
  Si  Si78  1  0.916982  0.750029  0.249800  1
  Si  Si79  1  0.916922  0.749953  0.583332  1
  Si  Si80  1  0.916934  0.750099  0.916749  1
  Si  Si81  1  0.001109  0.166649  0.166642  1
  Si  Si82  1  0.000284  0.166790  0.499679  1
  Si  Si83  1  0.002107  0.167185  0.835342  1
  Si  Si84  1  0.002102  0.497952  0.166103  1
  Si  Si85  1  0.000258  0.499666  0.499756  1
  Si  Si86  1  0.000129  0.499805  0.833410  1
  Si  Si87  1  0.000304  0.833600  0.166540  1
  Si  Si88  1  0.000266  0.833358  0.499957  1
  Si  Si89  1  0.000330  0.833614  0.833439  1
  Si  Si90  1  0.323523  0.176524  0.156798  1
  Si  Si91  1  0.333188  0.166861  0.499576  1
  Si  Si92  1  0.333388  0.166628  0.834416  1
  Si  Si93  1  0.333315  0.498900  0.166637  1
  Si  Si94  1  0.333321  0.499703  0.499746  1
  Si  Si95  1  0.332848  0.497895  0.835380  1
  Si  Si96  1  0.333111  0.833693  0.166415  1
  Si  Si97  1  0.333087  0.833761  0.499432  1
  Si  Si98  1  0.333254  0.833528  0.833559  1
  Si  Si99  1  0.666328  0.166844  0.166400  1
  Si  Si100  1  0.666151  0.166885  0.499545  1
  Si  Si101  1  0.666450  0.166674  0.833541  1
  Si  Si102  1  0.666484  0.499782  0.166589  1
  Si  Si103  1  0.666607  0.499788  0.499872  1
  Si  Si104  1  0.666466  0.499777  0.833703  1
  Si  Si105  1  0.666208  0.833892  0.166486  1
  Si  Si106  1  0.666535  0.833402  0.499803  1
  Si  Si107  1  0.666713  0.833291  0.833492  1
  Si  Si108  1  0.086853  0.250915  0.246436  1
  Si  Si109  1  0.083607  0.250038  0.583261  1
  Si  Si110  1  0.086874  0.249039  0.920169  1
  Si  Si111  1  0.083580  0.582731  0.249738  1
  Si  Si112  1  0.083604  0.583002  0.583288  1
  Si  Si113  1  0.083644  0.582882  0.916908  1
  Si  Si114  1  0.083678  0.917086  0.249665  1
  Si  Si115  1  0.083660  0.916877  0.583314  1
  Si  Si116  1  0.083546  0.917339  0.916782  1
  Si  Si117  1  0.413168  0.249111  0.246455  1
  Si  Si118  1  0.416457  0.249920  0.583328  1
  Si  Si119  1  0.413171  0.250911  0.920169  1
  Si  Si120  1  0.416349  0.582904  0.249645  1
  Si  Si121  1  0.416544  0.583037  0.583353  1
  Si  Si122  1  0.416387  0.582731  0.916924  1
  Si  Si123  1  0.416410  0.917279  0.249668  1
  Si  Si124  1  0.416385  0.916809  0.583236  1
  Si  Si125  1  0.416362  0.917018  0.916979  1
  Si  Si126  1  0.749991  0.249971  0.249698  1
  Si  Si127  1  0.749975  0.249997  0.583439  1
  Si  Si128  1  0.749933  0.249995  0.916887  1
  Si  Si129  1  0.750148  0.583162  0.249752  1
  Si  Si130  1  0.749908  0.583184  0.583253  1
  Si  Si131  1  0.750070  0.583175  0.916963  1
  Si  Si132  1  0.749994  0.916964  0.249786  1
  Si  Si133  1  0.749980  0.916735  0.583201  1
  Si  Si134  1  0.750125  0.916862  0.916829  1
  Si  Si135  1  0.166659  0.001127  0.166641  1
  Si  Si136  1  0.166792  0.000295  0.499708  1
  Si  Si137  1  0.167233  0.002080  0.835321  1
  Si  Si138  1  0.176517  0.323501  0.156804  1
  Si  Si139  1  0.166875  0.333192  0.499598  1
  Si  Si140  1  0.166679  0.333294  0.834428  1
  Si  Si141  1  0.166784  0.666343  0.166415  1
  Si  Si142  1  0.166919  0.666041  0.499489  1
  Si  Si143  1  0.166759  0.666385  0.833533  1
  Si  Si144  1  0.497956  0.002070  0.166102  1
  Si  Si145  1  0.499664  0.000215  0.499667  1
  Si  Si146  1  0.499899  0.000054  0.833468  1
  Si  Si147  1  0.498898  0.333382  0.166651  1
  Si  Si148  1  0.499777  0.333223  0.499784  1
  Si  Si149  1  0.497968  0.332789  0.835389  1
  Si  Si150  1  0.499730  0.666424  0.166544  1
  Si  Si151  1  0.499790  0.666615  0.499890  1
  Si  Si152  1  0.499754  0.666420  0.833693  1
  Si  Si153  1  0.833583  0.000293  0.166549  1
  Si  Si154  1  0.833382  0.000185  0.499943  1
  Si  Si155  1  0.833644  0.000266  0.833519  1
  Si  Si156  1  0.833676  0.333161  0.166466  1
  Si  Si157  1  0.833760  0.333075  0.499460  1
  Si  Si158  1  0.833566  0.333227  0.833603  1
  Si  Si159  1  0.833974  0.666215  0.166474  1
  Si  Si160  1  0.833399  0.666643  0.499951  1
  Si  Si161  1  0.833420  0.666609  0.833460  1
  Si  Si162  1  0.086846  0.086845  0.082360  1
  Si  Si163  1  0.083677  0.083669  0.416200  1
  Si  Si164  1  0.083625  0.083596  0.750539  1
  Si  Si165  1  0.086872  0.413143  0.084222  1
  Si  Si166  1  0.083558  0.416428  0.416007  1
  Si  Si167  1  0.083654  0.416273  0.750376  1
  Si  Si168  1  0.083560  0.750031  0.083210  1
  Si  Si169  1  0.083665  0.749945  0.416485  1
  Si  Si170  1  0.083643  0.750001  0.750107  1
  Si  Si171  1  0.413161  0.086848  0.084218  1
  Si  Si172  1  0.416442  0.083585  0.415975  1
  Si  Si173  1  0.416387  0.083576  0.750406  1
  Si  Si174  1  0.413142  0.413172  0.082382  1
  Si  Si175  1  0.416417  0.416334  0.416241  1
  Si  Si176  1  0.416471  0.416382  0.750594  1
  Si  Si177  1  0.416382  0.749985  0.083286  1
  Si  Si178  1  0.416401  0.749995  0.416369  1
  Si  Si179  1  0.416461  0.749890  0.750221  1
  Si  Si180  1  0.750026  0.083594  0.083251  1
  Si  Si181  1  0.749963  0.083612  0.416490  1
  Si  Si182  1  0.750065  0.083518  0.750116  1
  Si  Si183  1  0.749989  0.416408  0.083314  1
  Si  Si184  1  0.750053  0.416451  0.416376  1
  Si  Si185  1  0.749984  0.416485  0.750284  1
  Si  Si186  1  0.750149  0.750108  0.083410  1
  Si  Si187  1  0.750072  0.750070  0.416457  1
  Si  Si188  1  0.750003  0.749872  0.750039  1
  Si  Si189  1  0.176538  0.176488  0.009819  1
  Si  Si190  1  0.166686  0.166677  0.332170  1
  Si  Si191  1  0.166878  0.166877  0.666945  1
  Si  Si192  1  0.166663  0.498881  0.999944  1
  Si  Si193  1  0.167192  0.497929  0.331238  1
  Si  Si194  1  0.166797  0.499641  0.666894  1
  Si  Si195  1  0.166791  0.833741  0.000079  1
  Si  Si196  1  0.166773  0.833572  0.333054  1
  Si  Si197  1  0.166975  0.833786  0.667084  1
  Si  Si198  1  0.498917  0.166647  0.999965  1
  Si  Si199  1  0.497968  0.167220  0.331227  1
  Si  Si200  1  0.499774  0.166660  0.666886  1
  Si  Si201  1  0.497939  0.497980  0.000528  1
  Si  Si202  1  0.499893  0.499891  0.333180  1
  Si  Si203  1  0.499808  0.499671  0.666939  1
  Si  Si204  1  0.499780  0.833541  0.000088  1
  Si  Si205  1  0.499683  0.833537  0.332943  1
  Si  Si206  1  0.499769  0.833353  0.666692  1
  Si  Si207  1  0.833685  0.166877  0.000108  1
  Si  Si208  1  0.833562  0.166741  0.333045  1
  Si  Si209  1  0.833899  0.166860  0.667139  1
  Si  Si210  1  0.833624  0.499716  0.000103  1
  Si  Si211  1  0.833675  0.499767  0.333059  1
  Si  Si212  1  0.833299  0.499820  0.666648  1
  Si  Si213  1  0.833934  0.833867  0.000162  1
  Si  Si214  1  0.833446  0.833453  0.333118  1
  Si  Si215  1  0.833406  0.833337  0.666643  1
  B  B216  1  0.250007  0.249991  0.083325  1
