# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.84720135
_cell_length_b   21.65212129
_cell_length_c   46.35998213
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   76.38432133
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg264
_cell_volume   13509.0805033
_cell_formula_units_Z   264
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  0.350613  0.383197  0.299760  1
  Mg  Mg2  1  0.746958  0.390169  0.286349  1
  Mg  Mg3  1  0.960157  0.376722  0.311563  1
  Mg  Mg4  1  0.350613  0.883197  0.299760  1
  Mg  Mg5  1  0.746958  0.890169  0.286349  1
  Mg  Mg6  1  0.960157  0.876722  0.311563  1
  Mg  Mg7  1  0.349228  0.746795  0.323921  1
  Mg  Mg8  1  0.745928  0.752551  0.310536  1
  Mg  Mg9  1  0.136198  0.755982  0.298221  1
  Mg  Mg10  1  0.349228  0.246795  0.323921  1
  Mg  Mg11  1  0.745928  0.252551  0.310536  1
  Mg  Mg12  1  0.136198  0.255982  0.298221  1
  Mg  Mg13  1  0.262082  0.623242  0.318256  1
  Mg  Mg14  1  0.660886  0.627076  0.305699  1
  Mg  Mg15  1  0.048042  0.634988  0.292581  1
  Mg  Mg16  1  0.262082  0.123242  0.318256  1
  Mg  Mg17  1  0.660886  0.127076  0.305699  1
  Mg  Mg18  1  0.048042  0.134988  0.292581  1
  Mg  Mg19  1  0.572416  0.505588  0.300419  1
  Mg  Mg20  1  0.960151  0.513181  0.287549  1
  Mg  Mg21  1  0.173815  0.501629  0.312701  1
  Mg  Mg22  1  0.572416  0.005588  0.300419  1
  Mg  Mg23  1  0.960151  0.013181  0.287549  1
  Mg  Mg24  1  0.173815  0.001629  0.312701  1
  Mg  Mg25  1  0.173488  0.365801  0.337433  1
  Mg  Mg26  1  0.567929  0.370868  0.324181  1
  Mg  Mg27  1  0.781258  0.360735  0.350978  1
  Mg  Mg28  1  0.173488  0.865801  0.337433  1
  Mg  Mg29  1  0.567929  0.870868  0.324181  1
  Mg  Mg30  1  0.781258  0.860735  0.350978  1
  Mg  Mg31  1  0.171766  0.730263  0.362873  1
  Mg  Mg32  1  0.565487  0.735909  0.349113  1
  Mg  Mg33  1  0.957647  0.741984  0.336483  1
  Mg  Mg34  1  0.171766  0.230263  0.362873  1
  Mg  Mg35  1  0.565487  0.235909  0.349113  1
  Mg  Mg36  1  0.957647  0.241984  0.336483  1
  Mg  Mg37  1  0.084893  0.607902  0.357345  1
  Mg  Mg38  1  0.478460  0.612853  0.344113  1
  Mg  Mg39  1  0.871452  0.618703  0.331558  1
  Mg  Mg40  1  0.084893  0.107902  0.357345  1
  Mg  Mg41  1  0.478460  0.112853  0.344113  1
  Mg  Mg42  1  0.871452  0.118703  0.331558  1
  Mg  Mg43  1  0.391060  0.490135  0.338748  1
  Mg  Mg44  1  0.784778  0.495532  0.326308  1
  Mg  Mg45  1  0.998088  0.485251  0.352217  1
  Mg  Mg46  1  0.391060  0.990135  0.338748  1
  Mg  Mg47  1  0.784778  0.995532  0.326308  1
  Mg  Mg48  1  0.998088  0.985251  0.352217  1
  Mg  Mg49  1  0.995716  0.349860  0.377188  1
  Mg  Mg50  1  0.388569  0.355028  0.364210  1
  Mg  Mg51  1  0.602765  0.344262  0.390322  1
  Mg  Mg52  1  0.995716  0.849860  0.377188  1
  Mg  Mg53  1  0.388569  0.855028  0.364210  1
  Mg  Mg54  1  0.602765  0.844262  0.390322  1
  Mg  Mg55  1  0.992979  0.714476  0.402686  1
  Mg  Mg56  1  0.386447  0.719678  0.389285  1
  Mg  Mg57  1  0.778477  0.725330  0.376053  1
  Mg  Mg58  1  0.992979  0.214476  0.402686  1
  Mg  Mg59  1  0.386447  0.219678  0.389285  1
  Mg  Mg60  1  0.778477  0.225330  0.376053  1
  Mg  Mg61  1  0.906396  0.591766  0.397392  1
  Mg  Mg62  1  0.299634  0.597053  0.383780  1
  Mg  Mg63  1  0.692004  0.602459  0.370792  1
  Mg  Mg64  1  0.906396  0.091766  0.397392  1
  Mg  Mg65  1  0.299634  0.097053  0.383780  1
  Mg  Mg66  1  0.692004  0.102459  0.370792  1
  Mg  Mg67  1  0.213010  0.474225  0.378110  1
  Mg  Mg68  1  0.605541  0.479259  0.365079  1
  Mg  Mg69  1  0.819932  0.468909  0.391924  1
  Mg  Mg70  1  0.213010  0.974225  0.378110  1
  Mg  Mg71  1  0.605541  0.979259  0.365079  1
  Mg  Mg72  1  0.819932  0.968909  0.391924  1
  Mg  Mg73  1  0.817438  0.333471  0.417471  1
  Mg  Mg74  1  0.210324  0.338869  0.403717  1
  Mg  Mg75  1  0.424853  0.328020  0.430832  1
  Mg  Mg76  1  0.817438  0.833471  0.417471  1
  Mg  Mg77  1  0.210324  0.838869  0.403717  1
  Mg  Mg78  1  0.424853  0.828020  0.430832  1
  Mg  Mg79  1  0.814824  0.698197  0.443081  1
  Mg  Mg80  1  0.207965  0.703566  0.429605  1
  Mg  Mg81  1  0.600282  0.709099  0.415992  1
  Mg  Mg82  1  0.814824  0.198197  0.443081  1
  Mg  Mg83  1  0.207965  0.203566  0.429605  1
  Mg  Mg84  1  0.600282  0.209099  0.415992  1
  Mg  Mg85  1  0.728240  0.575410  0.437612  1
  Mg  Mg86  1  0.121333  0.580777  0.424015  1
  Mg  Mg87  1  0.513852  0.586157  0.410495  1
  Mg  Mg88  1  0.728240  0.075410  0.437612  1
  Mg  Mg89  1  0.121333  0.080777  0.424015  1
  Mg  Mg90  1  0.513852  0.086157  0.410495  1
  Mg  Mg91  1  0.034804  0.458021  0.418607  1
  Mg  Mg92  1  0.427331  0.463463  0.404977  1
  Mg  Mg93  1  0.641679  0.452539  0.431953  1
  Mg  Mg94  1  0.034804  0.958021  0.418607  1
  Mg  Mg95  1  0.427331  0.963463  0.404977  1
  Mg  Mg96  1  0.641679  0.952539  0.431953  1
  Mg  Mg97  1  0.639177  0.317275  0.457602  1
  Mg  Mg98  1  0.032099  0.322670  0.444169  1
  Mg  Mg99  1  0.246597  0.311905  0.471018  1
  Mg  Mg100  1  0.639177  0.817275  0.457602  1
  Mg  Mg101  1  0.032099  0.822670  0.444169  1
  Mg  Mg102  1  0.246597  0.811905  0.471018  1
  Mg  Mg103  1  0.636656  0.682035  0.483319  1
  Mg  Mg104  1  0.029525  0.687362  0.469849  1
  Mg  Mg105  1  0.422363  0.692711  0.456428  1
  Mg  Mg106  1  0.636656  0.182035  0.483319  1
  Mg  Mg107  1  0.029525  0.187362  0.469849  1
  Mg  Mg108  1  0.422363  0.192711  0.456428  1
  Mg  Mg109  1  0.550127  0.559207  0.477745  1
  Mg  Mg110  1  0.943001  0.564597  0.464410  1
  Mg  Mg111  1  0.335775  0.569960  0.450873  1
  Mg  Mg112  1  0.550127  0.059207  0.477745  1
  Mg  Mg113  1  0.943001  0.064597  0.464410  1
  Mg  Mg114  1  0.335775  0.069960  0.450873  1
  Mg  Mg115  1  0.856450  0.441827  0.458901  1
  Mg  Mg116  1  0.249204  0.447186  0.445252  1
  Mg  Mg117  1  0.463553  0.436451  0.472199  1
  Mg  Mg118  1  0.856450  0.941827  0.458901  1
  Mg  Mg119  1  0.249204  0.947186  0.445252  1
  Mg  Mg120  1  0.463553  0.936451  0.472199  1
  Mg  Mg121  1  0.461027  0.301138  0.497962  1
  Mg  Mg122  1  0.853851  0.306513  0.484568  1
  Mg  Mg123  1  0.068268  0.295761  0.511326  1
  Mg  Mg124  1  0.461027  0.801138  0.497962  1
  Mg  Mg125  1  0.853851  0.806513  0.484568  1
  Mg  Mg126  1  0.068268  0.795761  0.511326  1
  Mg  Mg127  1  0.458446  0.665876  0.523584  1
  Mg  Mg128  1  0.851230  0.671275  0.510196  1
  Mg  Mg129  1  0.244027  0.676609  0.496766  1
  Mg  Mg130  1  0.458446  0.165876  0.523584  1
  Mg  Mg131  1  0.851230  0.171275  0.510196  1
  Mg  Mg132  1  0.244027  0.176609  0.496766  1
  Mg  Mg133  1  0.371889  0.543108  0.518062  1
  Mg  Mg134  1  0.764696  0.548481  0.504693  1
  Mg  Mg135  1  0.157519  0.553814  0.491187  1
  Mg  Mg136  1  0.371889  0.043108  0.518062  1
  Mg  Mg137  1  0.764696  0.048481  0.504693  1
  Mg  Mg138  1  0.157519  0.053814  0.491187  1
  Mg  Mg139  1  0.678130  0.425652  0.499054  1
  Mg  Mg140  1  0.070988  0.431028  0.485679  1
  Mg  Mg141  1  0.285334  0.420310  0.512469  1
  Mg  Mg142  1  0.678130  0.925652  0.499054  1
  Mg  Mg143  1  0.070988  0.931028  0.485679  1
  Mg  Mg144  1  0.285334  0.920310  0.512469  1
  Mg  Mg145  1  0.282783  0.284975  0.538254  1
  Mg  Mg146  1  0.675548  0.290352  0.524842  1
  Mg  Mg147  1  0.890024  0.279648  0.551752  1
  Mg  Mg148  1  0.282783  0.784975  0.538254  1
  Mg  Mg149  1  0.675548  0.790352  0.524842  1
  Mg  Mg150  1  0.890024  0.779648  0.551752  1
  Mg  Mg151  1  0.280204  0.649741  0.563963  1
  Mg  Mg152  1  0.673025  0.655125  0.550536  1
  Mg  Mg153  1  0.065727  0.660476  0.537025  1
  Mg  Mg154  1  0.280204  0.149741  0.563963  1
  Mg  Mg155  1  0.673025  0.155125  0.550536  1
  Mg  Mg156  1  0.065727  0.160476  0.537025  1
  Mg  Mg157  1  0.193680  0.526932  0.558368  1
  Mg  Mg158  1  0.586462  0.532324  0.544873  1
  Mg  Mg159  1  0.979264  0.537696  0.531531  1
  Mg  Mg160  1  0.193680  0.026932  0.558368  1
  Mg  Mg161  1  0.586462  0.032324  0.544873  1
  Mg  Mg162  1  0.979264  0.037696  0.531531  1
  Mg  Mg163  1  0.499849  0.409578  0.539343  1
  Mg  Mg164  1  0.892703  0.414926  0.526032  1
  Mg  Mg165  1  0.107092  0.404127  0.552810  1
  Mg  Mg166  1  0.499849  0.909578  0.539343  1
  Mg  Mg167  1  0.892703  0.914926  0.526032  1
  Mg  Mg168  1  0.107092  0.904127  0.552810  1
  Mg  Mg169  1  0.104352  0.268879  0.578453  1
  Mg  Mg170  1  0.497358  0.274258  0.565110  1
  Mg  Mg171  1  0.711913  0.263343  0.592193  1
  Mg  Mg172  1  0.104352  0.768879  0.578453  1
  Mg  Mg173  1  0.497358  0.774258  0.565110  1
  Mg  Mg174  1  0.711913  0.763343  0.592193  1
  Mg  Mg175  1  0.101982  0.633433  0.604172  1
  Mg  Mg176  1  0.494753  0.638908  0.590647  1
  Mg  Mg177  1  0.887524  0.644368  0.577291  1
  Mg  Mg178  1  0.101982  0.133433  0.604172  1
  Mg  Mg179  1  0.494753  0.138908  0.590647  1
  Mg  Mg180  1  0.887524  0.144368  0.577291  1
  Mg  Mg181  1  0.015694  0.510599  0.598700  1
  Mg  Mg182  1  0.408226  0.516134  0.585213  1
  Mg  Mg183  1  0.801062  0.521586  0.571825  1
  Mg  Mg184  1  0.015694  0.010599  0.598700  1
  Mg  Mg185  1  0.408226  0.016134  0.585213  1
  Mg  Mg186  1  0.801062  0.021586  0.571825  1
  Mg  Mg187  1  0.321569  0.393327  0.579602  1
  Mg  Mg188  1  0.714427  0.398725  0.566147  1
  Mg  Mg189  1  0.928974  0.387981  0.593312  1
  Mg  Mg190  1  0.321569  0.893327  0.579602  1
  Mg  Mg191  1  0.714427  0.898725  0.566147  1
  Mg  Mg192  1  0.928974  0.887981  0.593312  1
  Mg  Mg193  1  0.926167  0.252658  0.618902  1
  Mg  Mg194  1  0.319224  0.257960  0.605514  1
  Mg  Mg195  1  0.533471  0.247096  0.632106  1
  Mg  Mg196  1  0.926167  0.752658  0.618902  1
  Mg  Mg197  1  0.319224  0.757960  0.605514  1
  Mg  Mg198  1  0.533471  0.747096  0.632106  1
  Mg  Mg199  1  0.924131  0.617362  0.643871  1
  Mg  Mg200  1  0.316487  0.622634  0.631011  1
  Mg  Mg201  1  0.709432  0.628182  0.617736  1
  Mg  Mg202  1  0.924131  0.117362  0.643871  1
  Mg  Mg203  1  0.316487  0.122634  0.631011  1
  Mg  Mg204  1  0.709432  0.128182  0.617736  1
  Mg  Mg205  1  0.837321  0.494942  0.638740  1
  Mg  Mg206  1  0.230027  0.499746  0.625416  1
  Mg  Mg207  1  0.623046  0.505239  0.611942  1
  Mg  Mg208  1  0.837321  0.994942  0.638740  1
  Mg  Mg209  1  0.230027  0.999746  0.625416  1
  Mg  Mg210  1  0.623046  0.005239  0.611942  1
  Mg  Mg211  1  0.143302  0.377081  0.619886  1
  Mg  Mg212  1  0.536262  0.382513  0.606492  1
  Mg  Mg213  1  0.750711  0.371912  0.633015  1
  Mg  Mg214  1  0.143302  0.877081  0.619886  1
  Mg  Mg215  1  0.536262  0.882513  0.606492  1
  Mg  Mg216  1  0.750711  0.871912  0.633015  1
  Mg  Mg217  1  0.748150  0.236407  0.658836  1
  Mg  Mg218  1  0.140751  0.241717  0.644959  1
  Mg  Mg219  1  0.355063  0.230748  0.671826  1
  Mg  Mg220  1  0.748150  0.736407  0.658836  1
  Mg  Mg221  1  0.140751  0.741717  0.644959  1
  Mg  Mg222  1  0.355063  0.730748  0.671826  1
  Mg  Mg223  1  0.744879  0.601531  0.683610  1
  Mg  Mg224  1  0.138331  0.606689  0.670203  1
  Mg  Mg225  1  0.530982  0.611719  0.657040  1
  Mg  Mg226  1  0.744879  0.101531  0.683610  1
  Mg  Mg227  1  0.138331  0.106689  0.670203  1
  Mg  Mg228  1  0.530982  0.111719  0.657040  1
  Mg  Mg229  1  0.658061  0.478998  0.677816  1
  Mg  Mg230  1  0.051312  0.483900  0.664963  1
  Mg  Mg231  1  0.444507  0.489018  0.651913  1
  Mg  Mg232  1  0.658061  0.978998  0.677816  1
  Mg  Mg233  1  0.051312  0.983900  0.664963  1
  Mg  Mg234  1  0.444507  0.989018  0.651913  1
  Mg  Mg235  1  0.964489  0.361068  0.659816  1
  Mg  Mg236  1  0.357442  0.366439  0.646386  1
  Mg  Mg237  1  0.571158  0.355421  0.672455  1
  Mg  Mg238  1  0.964489  0.861068  0.659816  1
  Mg  Mg239  1  0.357442  0.866439  0.646386  1
  Mg  Mg240  1  0.571158  0.855421  0.672455  1
  Mg  Mg241  1  0.566787  0.220002  0.697460  1
  Mg  Mg242  1  0.962607  0.226359  0.684537  1
  Mg  Mg243  1  0.177752  0.213259  0.709576  1
  Mg  Mg244  1  0.566787  0.720002  0.697460  1
  Mg  Mg245  1  0.962607  0.726359  0.684537  1
  Mg  Mg246  1  0.177752  0.713259  0.709576  1
  Mg  Mg247  1  0.565631  0.583231  0.721625  1
  Mg  Mg248  1  0.959854  0.590581  0.708415  1
  Mg  Mg249  1  0.354153  0.594787  0.696410  1
  Mg  Mg250  1  0.565631  0.083231  0.721625  1
  Mg  Mg251  1  0.959854  0.090581  0.708415  1
  Mg  Mg252  1  0.354153  0.094787  0.696410  1
  Mg  Mg253  1  0.481440  0.460782  0.716632  1
  Mg  Mg254  1  0.870526  0.469204  0.703597  1
  Mg  Mg255  1  0.267123  0.473187  0.690978  1
  Mg  Mg256  1  0.481440  0.960782  0.716632  1
  Mg  Mg257  1  0.870526  0.969204  0.703597  1
  Mg  Mg258  1  0.267123  0.973187  0.690978  1
  Mg  Mg259  1  0.784049  0.347258  0.697868  1
  Mg  Mg260  1  0.179802  0.349717  0.685373  1
  Mg  Mg261  1  0.393236  0.340240  0.710983  1
  Mg  Mg262  1  0.784049  0.847258  0.697868  1
  Mg  Mg263  1  0.179802  0.849717  0.685373  1
  Mg  Mg264  1  0.393236  0.840240  0.710983  1
