# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.43193438
_cell_length_b   31.26184234
_cell_length_c   45.85357262
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   85.95073217
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg324
_cell_volume   16346.3948441
_cell_formula_units_Z   324
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  0.093085  0.632167  0.325387  1
  Mg  Mg2  1  0.607698  0.304393  0.278176  1
  Mg  Mg3  1  0.544311  0.634403  0.292880  1
  Mg  Mg4  1  0.941168  0.971045  0.278198  1
  Mg  Mg5  1  0.879659  0.301882  0.292375  1
  Mg  Mg6  1  0.822309  0.635107  0.308367  1
  Mg  Mg7  1  0.212966  0.968342  0.292377  1
  Mg  Mg8  1  0.156430  0.301960  0.308186  1
  Mg  Mg9  1  0.489841  0.968636  0.308219  1
  Mg  Mg10  1  0.384637  0.887967  0.278942  1
  Mg  Mg11  1  0.717108  0.554260  0.279301  1
  Mg  Mg12  1  0.661509  0.886551  0.293329  1
  Mg  Mg13  1  0.050849  0.221190  0.278902  1
  Mg  Mg14  1  0.991439  0.552416  0.294032  1
  Mg  Mg15  1  0.934941  0.882602  0.309664  1
  Mg  Mg16  1  0.328315  0.220129  0.293284  1
  Mg  Mg17  1  0.269250  0.550661  0.308947  1
  Mg  Mg18  1  0.601440  0.216094  0.309701  1
  Mg  Mg19  1  0.240384  0.805778  0.285374  1
  Mg  Mg20  1  0.574019  0.471548  0.285115  1
  Mg  Mg21  1  0.516966  0.802048  0.300400  1
  Mg  Mg22  1  0.907916  0.137999  0.285049  1
  Mg  Mg23  1  0.850440  0.468652  0.300584  1
  Mg  Mg24  1  0.791752  0.798738  0.316332  1
  Mg  Mg25  1  0.184488  0.135769  0.300442  1
  Mg  Mg26  1  0.125770  0.465923  0.316309  1
  Mg  Mg27  1  0.458516  0.132234  0.316375  1
  Mg  Mg28  1  0.374915  0.717849  0.307593  1
  Mg  Mg29  1  0.709298  0.384871  0.307744  1
  Mg  Mg30  1  0.647201  0.715464  0.323973  1
  Mg  Mg31  1  0.043050  0.051598  0.307725  1
  Mg  Mg32  1  0.981039  0.382400  0.324023  1
  Mg  Mg33  1  0.102610  0.720366  0.292832  1
  Mg  Mg34  1  0.314064  0.048959  0.324008  1
  Mg  Mg35  1  0.434483  0.386437  0.292024  1
  Mg  Mg36  1  0.767984  0.053012  0.292030  1
  Mg  Mg37  1  0.899474  0.626802  0.375043  1
  Mg  Mg38  1  0.423338  0.298678  0.326739  1
  Mg  Mg39  1  0.357915  0.631356  0.342536  1
  Mg  Mg40  1  0.756721  0.965225  0.326726  1
  Mg  Mg41  1  0.691758  0.297919  0.342945  1
  Mg  Mg42  1  0.629723  0.629174  0.358498  1
  Mg  Mg43  1  0.025077  0.964572  0.342949  1
  Mg  Mg44  1  0.962964  0.295939  0.358326  1
  Mg  Mg45  1  0.296330  0.962648  0.358368  1
  Mg  Mg46  1  0.197490  0.883301  0.327893  1
  Mg  Mg47  1  0.532779  0.549001  0.328538  1
  Mg  Mg48  1  0.468033  0.880875  0.343216  1
  Mg  Mg49  1  0.864182  0.216500  0.327709  1
  Mg  Mg50  1  0.801285  0.547450  0.343599  1
  Mg  Mg51  1  0.737842  0.878202  0.359243  1
  Mg  Mg52  1  0.134741  0.214321  0.343207  1
  Mg  Mg53  1  0.071851  0.545176  0.359211  1
  Mg  Mg54  1  0.404482  0.211639  0.359247  1
  Mg  Mg55  1  0.058182  0.798056  0.335442  1
  Mg  Mg56  1  0.391261  0.464933  0.335139  1
  Mg  Mg57  1  0.327524  0.796660  0.350310  1
  Mg  Mg58  1  0.725129  0.131264  0.335240  1
  Mg  Mg59  1  0.661285  0.463145  0.350489  1
  Mg  Mg60  1  0.597702  0.794613  0.366375  1
  Mg  Mg61  1  0.994356  0.130153  0.350317  1
  Mg  Mg62  1  0.931566  0.461406  0.366449  1
  Mg  Mg63  1  0.264521  0.128037  0.366432  1
  Mg  Mg64  1  0.187066  0.712863  0.358385  1
  Mg  Mg65  1  0.520782  0.379186  0.357625  1
  Mg  Mg66  1  0.457579  0.710774  0.373875  1
  Mg  Mg67  1  0.854388  0.045741  0.357633  1
  Mg  Mg68  1  0.791399  0.377375  0.373949  1
  Mg  Mg69  1  0.916530  0.713649  0.342158  1
  Mg  Mg70  1  0.124488  0.044134  0.373924  1
  Mg  Mg71  1  0.249894  0.380510  0.342156  1
  Mg  Mg72  1  0.583311  0.047079  0.342177  1
  Mg  Mg73  1  0.708283  0.621716  0.425346  1
  Mg  Mg74  1  0.231537  0.293476  0.375402  1
  Mg  Mg75  1  0.167898  0.625323  0.392082  1
  Mg  Mg76  1  0.564879  0.960056  0.375406  1
  Mg  Mg77  1  0.501410  0.291880  0.392339  1
  Mg  Mg78  1  0.438481  0.623665  0.408704  1
  Mg  Mg79  1  0.834683  0.958508  0.392346  1
  Mg  Mg80  1  0.771996  0.290290  0.408872  1
  Mg  Mg81  1  0.105340  0.956971  0.408871  1
  Mg  Mg82  1  0.005315  0.877256  0.376690  1
  Mg  Mg83  1  0.338710  0.543983  0.376573  1
  Mg  Mg84  1  0.276030  0.875276  0.393278  1
  Mg  Mg85  1  0.672102  0.210543  0.376646  1
  Mg  Mg86  1  0.609493  0.541923  0.393609  1
  Mg  Mg87  1  0.545674  0.873158  0.409759  1
  Mg  Mg88  1  0.942648  0.208664  0.393257  1
  Mg  Mg89  1  0.879435  0.539932  0.409778  1
  Mg  Mg90  1  0.212320  0.206554  0.409761  1
  Mg  Mg91  1  0.866153  0.792806  0.383802  1
  Mg  Mg92  1  0.199629  0.459664  0.383790  1
  Mg  Mg93  1  0.136770  0.791329  0.400855  1
  Mg  Mg94  1  0.532929  0.126235  0.383828  1
  Mg  Mg95  1  0.470160  0.457877  0.400725  1
  Mg  Mg96  1  0.406667  0.789264  0.416949  1
  Mg  Mg97  1  0.803618  0.124502  0.400737  1
  Mg  Mg98  1  0.740266  0.455954  0.416995  1
  Mg  Mg99  1  0.073353  0.122635  0.416954  1
  Mg  Mg100  1  0.997426  0.706937  0.407923  1
  Mg  Mg101  1  0.331089  0.373618  0.407868  1
  Mg  Mg102  1  0.267749  0.705186  0.424416  1
  Mg  Mg103  1  0.664451  0.040238  0.407869  1
  Mg  Mg104  1  0.601064  0.371870  0.424251  1
  Mg  Mg105  1  0.726911  0.708701  0.390924  1
  Mg  Mg106  1  0.934357  0.038505  0.424259  1
  Mg  Mg107  1  0.060401  0.375469  0.390999  1
  Mg  Mg108  1  0.393669  0.042125  0.390991  1
  Mg  Mg109  1  0.516825  0.616311  0.475625  1
  Mg  Mg110  1  0.041099  0.288373  0.425442  1
  Mg  Mg111  1  0.977267  0.619887  0.442174  1
  Mg  Mg112  1  0.374440  0.955019  0.425446  1
  Mg  Mg113  1  0.310417  0.286519  0.442267  1
  Mg  Mg114  1  0.246999  0.618135  0.458904  1
  Mg  Mg115  1  0.643731  0.953152  0.442270  1
  Mg  Mg116  1  0.580356  0.284790  0.459032  1
  Mg  Mg117  1  0.913630  0.951448  0.459038  1
  Mg  Mg118  1  0.814254  0.871540  0.426627  1
  Mg  Mg119  1  0.147781  0.538303  0.426599  1
  Mg  Mg120  1  0.083990  0.869932  0.443465  1
  Mg  Mg121  1  0.480940  0.204922  0.426621  1
  Mg  Mg122  1  0.417305  0.536564  0.443411  1
  Mg  Mg123  1  0.353849  0.867955  0.460111  1
  Mg  Mg124  1  0.750700  0.203196  0.443420  1
  Mg  Mg125  1  0.687401  0.534634  0.460185  1
  Mg  Mg126  1  0.020484  0.201294  0.460100  1
  Mg  Mg127  1  0.675658  0.787395  0.433750  1
  Mg  Mg128  1  0.009144  0.454133  0.433787  1
  Mg  Mg129  1  0.945324  0.785729  0.450636  1
  Mg  Mg130  1  0.342343  0.120784  0.433779  1
  Mg  Mg131  1  0.278703  0.452406  0.450608  1
  Mg  Mg132  1  0.215317  0.783902  0.467395  1
  Mg  Mg133  1  0.612022  0.119054  0.450617  1
  Mg  Mg134  1  0.548693  0.450569  0.467356  1
  Mg  Mg135  1  0.881973  0.117204  0.467361  1
  Mg  Mg136  1  0.806750  0.701576  0.457787  1
  Mg  Mg137  1  0.140154  0.368238  0.457790  1
  Mg  Mg138  1  0.076679  0.699793  0.474578  1
  Mg  Mg139  1  0.473466  0.034896  0.457778  1
  Mg  Mg140  1  0.410029  0.366450  0.474535  1
  Mg  Mg141  1  0.537086  0.703346  0.440965  1
  Mg  Mg142  1  0.743307  0.033107  0.474540  1
  Mg  Mg143  1  0.870452  0.370052  0.441040  1
  Mg  Mg144  1  0.203724  0.036728  0.441018  1
  Mg  Mg145  1  0.325297  0.610882  0.525813  1
  Mg  Mg146  1  0.850023  0.282974  0.475762  1
  Mg  Mg147  1  0.786326  0.614523  0.492394  1
  Mg  Mg148  1  0.183382  0.949656  0.475767  1
  Mg  Mg149  1  0.119480  0.281154  0.492448  1
  Mg  Mg150  1  0.055851  0.612720  0.509133  1
  Mg  Mg151  1  0.452841  0.947825  0.492452  1
  Mg  Mg152  1  0.389026  0.279357  0.509188  1
  Mg  Mg153  1  0.722345  0.946018  0.509192  1
  Mg  Mg154  1  0.623199  0.866115  0.476862  1
  Mg  Mg155  1  0.956646  0.532828  0.476870  1
  Mg  Mg156  1  0.892740  0.864388  0.493634  1
  Mg  Mg157  1  0.289840  0.199473  0.476861  1
  Mg  Mg158  1  0.226097  0.531060  0.493595  1
  Mg  Mg159  1  0.162338  0.862615  0.510334  1
  Mg  Mg160  1  0.559411  0.197732  0.493613  1
  Mg  Mg161  1  0.495747  0.529253  0.510339  1
  Mg  Mg162  1  0.828987  0.195924  0.510318  1
  Mg  Mg163  1  0.484779  0.782018  0.484012  1
  Mg  Mg164  1  0.818152  0.448708  0.484054  1
  Mg  Mg165  1  0.754341  0.780268  0.500795  1
  Mg  Mg166  1  0.151399  0.115369  0.484028  1
  Mg  Mg167  1  0.087669  0.446935  0.500793  1
  Mg  Mg168  1  0.023907  0.778523  0.517577  1
  Mg  Mg169  1  0.420992  0.113603  0.500787  1
  Mg  Mg170  1  0.357191  0.445166  0.517531  1
  Mg  Mg171  1  0.690490  0.111851  0.517551  1
  Mg  Mg172  1  0.615938  0.696144  0.507952  1
  Mg  Mg173  1  0.949238  0.362805  0.507987  1
  Mg  Mg174  1  0.885488  0.694422  0.524725  1
  Mg  Mg175  1  0.282583  0.029481  0.507968  1
  Mg  Mg176  1  0.218698  0.361043  0.524713  1
  Mg  Mg177  1  0.346348  0.697928  0.491254  1
  Mg  Mg178  1  0.552018  0.027734  0.524715  1
  Mg  Mg179  1  0.679596  0.364623  0.491245  1
  Mg  Mg180  1  0.012913  0.031264  0.491232  1
  Mg  Mg181  1  0.134221  0.605523  0.576139  1
  Mg  Mg182  1  0.658516  0.277562  0.525951  1
  Mg  Mg183  1  0.595033  0.609079  0.542546  1
  Mg  Mg184  1  0.991834  0.944211  0.525953  1
  Mg  Mg185  1  0.928330  0.275725  0.542677  1
  Mg  Mg186  1  0.864947  0.607379  0.559316  1
  Mg  Mg187  1  0.261734  0.942400  0.542679  1
  Mg  Mg188  1  0.198074  0.273978  0.559409  1
  Mg  Mg189  1  0.531442  0.940677  0.559413  1
  Mg  Mg190  1  0.432026  0.860751  0.527011  1
  Mg  Mg191  1  0.765331  0.527427  0.527050  1
  Mg  Mg192  1  0.701942  0.858971  0.543800  1
  Mg  Mg193  1  0.098634  0.194075  0.527011  1
  Mg  Mg194  1  0.035191  0.525642  0.543793  1
  Mg  Mg195  1  0.971587  0.857194  0.560624  1
  Mg  Mg196  1  0.368588  0.192295  0.543783  1
  Mg  Mg197  1  0.304875  0.523820  0.560546  1
  Mg  Mg198  1  0.638204  0.190537  0.560599  1
  Mg  Mg199  1  0.293370  0.776646  0.534194  1
  Mg  Mg200  1  0.626649  0.443312  0.534230  1
  Mg  Mg201  1  0.563369  0.774813  0.550953  1
  Mg  Mg202  1  0.959983  0.109948  0.534198  1
  Mg  Mg203  1  0.896647  0.441467  0.550977  1
  Mg  Mg204  1  0.833025  0.773139  0.567838  1
  Mg  Mg205  1  0.230027  0.108126  0.550958  1
  Mg  Mg206  1  0.166194  0.439733  0.567797  1
  Mg  Mg207  1  0.499575  0.106455  0.567828  1
  Mg  Mg208  1  0.424692  0.690617  0.558118  1
  Mg  Mg209  1  0.758035  0.357318  0.558169  1
  Mg  Mg210  1  0.694429  0.688988  0.574958  1
  Mg  Mg211  1  0.091424  0.023915  0.558123  1
  Mg  Mg212  1  0.027559  0.355558  0.574984  1
  Mg  Mg213  1  0.154840  0.692588  0.541478  1
  Mg  Mg214  1  0.360935  0.022273  0.574978  1
  Mg  Mg215  1  0.487944  0.359242  0.541400  1
  Mg  Mg216  1  0.821258  0.025914  0.541392  1
  Mg  Mg217  1  0.943794  0.600458  0.626183  1
  Mg  Mg218  1  0.467037  0.272161  0.576235  1
  Mg  Mg219  1  0.403326  0.603587  0.592702  1
  Mg  Mg220  1  0.800381  0.938848  0.576240  1
  Mg  Mg221  1  0.736847  0.270230  0.592862  1
  Mg  Mg222  1  0.674022  0.602003  0.609239  1
  Mg  Mg223  1  0.070188  0.936879  0.592875  1
  Mg  Mg224  1  0.007471  0.268521  0.609503  1
  Mg  Mg225  1  0.340883  0.935229  0.609505  1
  Mg  Mg226  1  0.240942  0.855365  0.577174  1
  Mg  Mg227  1  0.574279  0.522013  0.577335  1
  Mg  Mg228  1  0.511281  0.853620  0.593661  1
  Mg  Mg229  1  0.907577  0.188666  0.577181  1
  Mg  Mg230  1  0.844272  0.520269  0.593712  1
  Mg  Mg231  1  0.781739  0.851837  0.610657  1
  Mg  Mg232  1  0.177990  0.186906  0.593653  1
  Mg  Mg233  1  0.114901  0.518399  0.610578  1
  Mg  Mg234  1  0.448378  0.185160  0.610640  1
  Mg  Mg235  1  0.102020  0.771281  0.584641  1
  Mg  Mg236  1  0.435074  0.437923  0.584591  1
  Mg  Mg237  1  0.371922  0.769223  0.600734  1
  Mg  Mg238  1  0.768459  0.104629  0.584603  1
  Mg  Mg239  1  0.705187  0.436007  0.600861  1
  Mg  Mg240  1  0.642531  0.767734  0.617784  1
  Mg  Mg241  1  0.038730  0.102513  0.600742  1
  Mg  Mg242  1  0.975712  0.434206  0.617793  1
  Mg  Mg243  1  0.309202  0.100970  0.617815  1
  Mg  Mg244  1  0.232660  0.685266  0.608312  1
  Mg  Mg245  1  0.565849  0.351957  0.607978  1
  Mg  Mg246  1  0.503384  0.683283  0.624889  1
  Mg  Mg247  1  0.899156  0.018678  0.607955  1
  Mg  Mg248  1  0.836643  0.349895  0.625004  1
  Mg  Mg249  1  0.963007  0.687378  0.591831  1
  Mg  Mg250  1  0.170129  0.016508  0.624951  1
  Mg  Mg251  1  0.295898  0.353939  0.591809  1
  Mg  Mg252  1  0.629239  0.020668  0.591814  1
  Mg  Mg253  1  0.752027  0.595306  0.674855  1
  Mg  Mg254  1  0.275845  0.267051  0.626546  1
  Mg  Mg255  1  0.212281  0.597891  0.643222  1
  Mg  Mg256  1  0.609198  0.933805  0.626551  1
  Mg  Mg257  1  0.545541  0.264704  0.643084  1
  Mg  Mg258  1  0.483708  0.595953  0.658619  1
  Mg  Mg259  1  0.878879  0.931328  0.643059  1
  Mg  Mg260  1  0.817500  0.262517  0.659019  1
  Mg  Mg261  1  0.150907  0.929198  0.659045  1
  Mg  Mg262  1  0.051123  0.849779  0.627718  1
  Mg  Mg263  1  0.383950  0.516505  0.627638  1
  Mg  Mg264  1  0.321661  0.847705  0.643205  1
  Mg  Mg265  1  0.717577  0.183202  0.627691  1
  Mg  Mg266  1  0.654603  0.514708  0.643961  1
  Mg  Mg267  1  0.592109  0.846915  0.659414  1
  Mg  Mg268  1  0.988645  0.180923  0.643213  1
  Mg  Mg269  1  0.925400  0.513379  0.659415  1
  Mg  Mg270  1  0.258934  0.180150  0.659416  1
  Mg  Mg271  1  0.910982  0.765946  0.635215  1
  Mg  Mg272  1  0.243767  0.432482  0.635138  1
  Mg  Mg273  1  0.181183  0.763888  0.651278  1
  Mg  Mg274  1  0.577312  0.099248  0.635201  1
  Mg  Mg275  1  0.514072  0.430741  0.651099  1
  Mg  Mg276  1  0.450505  0.762486  0.666141  1
  Mg  Mg277  1  0.847644  0.097569  0.651121  1
  Mg  Mg278  1  0.784085  0.428937  0.666447  1
  Mg  Mg279  1  0.117762  0.095478  0.666230  1
  Mg  Mg280  1  0.040652  0.679672  0.658366  1
  Mg  Mg281  1  0.374048  0.346434  0.657981  1
  Mg  Mg282  1  0.311242  0.677216  0.673694  1
  Mg  Mg283  1  0.707475  0.013220  0.657975  1
  Mg  Mg284  1  0.642589  0.344856  0.673045  1
  Mg  Mg285  1  0.770856  0.682335  0.642340  1
  Mg  Mg286  1  0.976005  0.011393  0.672868  1
  Mg  Mg287  1  0.103491  0.348688  0.642373  1
  Mg  Mg288  1  0.436853  0.015470  0.642376  1
  Mg  Mg289  1  0.567663  0.589569  0.723384  1
  Mg  Mg290  1  0.082292  0.261680  0.676210  1
  Mg  Mg291  1  0.018793  0.591910  0.693364  1
  Mg  Mg292  1  0.415608  0.928497  0.676232  1
  Mg  Mg293  1  0.352974  0.258772  0.693210  1
  Mg  Mg294  1  0.295725  0.592110  0.709186  1
  Mg  Mg295  1  0.686254  0.925442  0.693188  1
  Mg  Mg296  1  0.630947  0.259396  0.708678  1
  Mg  Mg297  1  0.964453  0.926254  0.708696  1
  Mg  Mg298  1  0.861479  0.845109  0.677629  1
  Mg  Mg299  1  0.194297  0.511501  0.677574  1
  Mg  Mg300  1  0.133741  0.842713  0.693995  1
  Mg  Mg301  1  0.527918  0.178341  0.677610  1
  Mg  Mg302  1  0.466019  0.509041  0.693845  1
  Mg  Mg303  1  0.406063  0.840202  0.708735  1
  Mg  Mg304  1  0.800977  0.176171  0.693992  1
  Mg  Mg305  1  0.740814  0.507478  0.709545  1
  Mg  Mg306  1  0.073177  0.173382  0.708737  1
  Mg  Mg307  1  0.716937  0.761828  0.685248  1
  Mg  Mg308  1  0.049565  0.427967  0.685272  1
  Mg  Mg309  1  0.991742  0.758488  0.701185  1
  Mg  Mg310  1  0.383071  0.094834  0.685311  1
  Mg  Mg311  1  0.324917  0.425227  0.700999  1
  Mg  Mg312  1  0.268307  0.754776  0.716204  1
  Mg  Mg313  1  0.659224  0.092304  0.701052  1
  Mg  Mg314  1  0.601314  0.422344  0.716462  1
  Mg  Mg315  1  0.935609  0.087926  0.716150  1
  Mg  Mg316  1  0.847187  0.674003  0.708253  1
  Mg  Mg317  1  0.183907  0.341472  0.707548  1
  Mg  Mg318  1  0.124124  0.672552  0.722632  1
  Mg  Mg319  1  0.517443  0.008427  0.707508  1
  Mg  Mg320  1  0.458271  0.339604  0.722272  1
  Mg  Mg321  1  0.573788  0.677955  0.691904  1
  Mg  Mg322  1  0.791241  0.006152  0.722234  1
  Mg  Mg323  1  0.906115  0.343202  0.692630  1
  Mg  Mg324  1  0.239360  0.010105  0.692637  1
