# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.51721537
_cell_length_b   22.78959449
_cell_length_c   46.20209835
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   111.21710334
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg312
_cell_volume   16212.5599255
_cell_formula_units_Z   312
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  0.579042  0.348252  0.306643  1
  Mg  Mg2  1  0.245709  0.348252  0.306643  1
  Mg  Mg3  1  0.169866  0.860455  0.290467  1
  Mg  Mg4  1  0.912376  0.348252  0.306643  1
  Mg  Mg5  1  0.836533  0.860455  0.290467  1
  Mg  Mg6  1  0.503199  0.860455  0.290467  1
  Mg  Mg7  1  0.049196  0.723119  0.310070  1
  Mg  Mg8  1  0.715863  0.723119  0.310070  1
  Mg  Mg9  1  0.632359  0.231185  0.294987  1
  Mg  Mg10  1  0.382529  0.723119  0.310070  1
  Mg  Mg11  1  0.299025  0.231185  0.294987  1
  Mg  Mg12  1  0.965692  0.231185  0.294987  1
  Mg  Mg13  1  0.878911  0.605565  0.298954  1
  Mg  Mg14  1  0.545578  0.605565  0.298954  1
  Mg  Mg15  1  0.284956  0.094633  0.314393  1
  Mg  Mg16  1  0.212245  0.605565  0.298954  1
  Mg  Mg17  1  0.951623  0.094633  0.314393  1
  Mg  Mg18  1  0.618290  0.094633  0.314393  1
  Mg  Mg19  1  0.861728  0.468368  0.318549  1
  Mg  Mg20  1  0.528394  0.468368  0.318549  1
  Mg  Mg21  1  0.448200  0.975005  0.302518  1
  Mg  Mg22  1  0.195061  0.468368  0.318549  1
  Mg  Mg23  1  0.114867  0.975005  0.302518  1
  Mg  Mg24  1  0.781533  0.975005  0.302518  1
  Mg  Mg25  1  0.405531  0.332208  0.338582  1
  Mg  Mg26  1  0.072198  0.332208  0.338582  1
  Mg  Mg27  1  0.993541  0.840412  0.321830  1
  Mg  Mg28  1  0.738864  0.332208  0.338582  1
  Mg  Mg29  1  0.660208  0.840412  0.321830  1
  Mg  Mg30  1  0.326875  0.840412  0.321830  1
  Mg  Mg31  1  0.872362  0.706167  0.342417  1
  Mg  Mg32  1  0.539029  0.706167  0.342417  1
  Mg  Mg33  1  0.457186  0.213354  0.326310  1
  Mg  Mg34  1  0.205696  0.706167  0.342417  1
  Mg  Mg35  1  0.123853  0.213354  0.326310  1
  Mg  Mg36  1  0.790519  0.213354  0.326310  1
  Mg  Mg37  1  0.701306  0.586434  0.330109  1
  Mg  Mg38  1  0.367973  0.586434  0.330109  1
  Mg  Mg39  1  0.111767  0.078716  0.346519  1
  Mg  Mg40  1  0.034639  0.586434  0.330109  1
  Mg  Mg41  1  0.778434  0.078716  0.346519  1
  Mg  Mg42  1  0.445100  0.078716  0.346519  1
  Mg  Mg43  1  0.687242  0.451480  0.350484  1
  Mg  Mg44  1  0.353909  0.451480  0.350484  1
  Mg  Mg45  1  0.274274  0.959904  0.334636  1
  Mg  Mg46  1  0.020575  0.451480  0.350484  1
  Mg  Mg47  1  0.940941  0.959904  0.334636  1
  Mg  Mg48  1  0.607607  0.959904  0.334636  1
  Mg  Mg49  1  0.230805  0.315572  0.371332  1
  Mg  Mg50  1  0.897471  0.315572  0.371332  1
  Mg  Mg51  1  0.818791  0.824782  0.355062  1
  Mg  Mg52  1  0.564138  0.315572  0.371332  1
  Mg  Mg53  1  0.485458  0.824782  0.355062  1
  Mg  Mg54  1  0.152125  0.824782  0.355062  1
  Mg  Mg55  1  0.696490  0.688659  0.375129  1
  Mg  Mg56  1  0.363156  0.688659  0.375129  1
  Mg  Mg57  1  0.282933  0.197207  0.359442  1
  Mg  Mg58  1  0.029823  0.688659  0.375129  1
  Mg  Mg59  1  0.949600  0.197207  0.359442  1
  Mg  Mg60  1  0.616267  0.197207  0.359442  1
  Mg  Mg61  1  0.526382  0.570402  0.363390  1
  Mg  Mg62  1  0.193049  0.570402  0.363390  1
  Mg  Mg63  1  0.936615  0.061823  0.379733  1
  Mg  Mg64  1  0.859715  0.570402  0.363390  1
  Mg  Mg65  1  0.603281  0.061823  0.379733  1
  Mg  Mg66  1  0.269948  0.061823  0.379733  1
  Mg  Mg67  1  0.512711  0.434607  0.383704  1
  Mg  Mg68  1  0.179378  0.434607  0.383704  1
  Mg  Mg69  1  0.099423  0.942797  0.367192  1
  Mg  Mg70  1  0.846045  0.434607  0.383704  1
  Mg  Mg71  1  0.766090  0.942797  0.367192  1
  Mg  Mg72  1  0.432757  0.942797  0.367192  1
  Mg  Mg73  1  0.056250  0.299253  0.404693  1
  Mg  Mg74  1  0.722917  0.299253  0.404693  1
  Mg  Mg75  1  0.643915  0.807685  0.387884  1
  Mg  Mg76  1  0.389584  0.299253  0.404693  1
  Mg  Mg77  1  0.310582  0.807685  0.387884  1
  Mg  Mg78  1  0.977249  0.807685  0.387884  1
  Mg  Mg79  1  0.521096  0.672206  0.408667  1
  Mg  Mg80  1  0.187763  0.672206  0.408667  1
  Mg  Mg81  1  0.107658  0.180388  0.392183  1
  Mg  Mg82  1  0.854429  0.672206  0.408667  1
  Mg  Mg83  1  0.774324  0.180388  0.392183  1
  Mg  Mg84  1  0.440991  0.180388  0.392183  1
  Mg  Mg85  1  0.350704  0.553334  0.396125  1
  Mg  Mg86  1  0.017371  0.553334  0.396125  1
  Mg  Mg87  1  0.761978  0.045055  0.412940  1
  Mg  Mg88  1  0.684038  0.553334  0.396125  1
  Mg  Mg89  1  0.428645  0.045055  0.412940  1
  Mg  Mg90  1  0.095312  0.045055  0.412940  1
  Mg  Mg91  1  0.337714  0.417836  0.416955  1
  Mg  Mg92  1  0.004381  0.417836  0.416955  1
  Mg  Mg93  1  0.924999  0.926401  0.400566  1
  Mg  Mg94  1  0.671048  0.417836  0.416955  1
  Mg  Mg95  1  0.591666  0.926401  0.400566  1
  Mg  Mg96  1  0.258333  0.926401  0.400566  1
  Mg  Mg97  1  0.881105  0.282319  0.438265  1
  Mg  Mg98  1  0.547772  0.282319  0.438265  1
  Mg  Mg99  1  0.468639  0.790657  0.421487  1
  Mg  Mg100  1  0.214439  0.282319  0.438265  1
  Mg  Mg101  1  0.135306  0.790657  0.421487  1
  Mg  Mg102  1  0.801972  0.790657  0.421487  1
  Mg  Mg103  1  0.345794  0.655189  0.442235  1
  Mg  Mg104  1  0.012461  0.655189  0.442235  1
  Mg  Mg105  1  0.932757  0.163623  0.425921  1
  Mg  Mg106  1  0.679128  0.655189  0.442235  1
  Mg  Mg107  1  0.599424  0.163623  0.425921  1
  Mg  Mg108  1  0.266091  0.163623  0.425921  1
  Mg  Mg109  1  0.175293  0.536412  0.429877  1
  Mg  Mg110  1  0.841960  0.536412  0.429877  1
  Mg  Mg111  1  0.587026  0.028170  0.446697  1
  Mg  Mg112  1  0.508626  0.536412  0.429877  1
  Mg  Mg113  1  0.253693  0.028170  0.446697  1
  Mg  Mg114  1  0.920359  0.028170  0.446697  1
  Mg  Mg115  1  0.162761  0.401081  0.450770  1
  Mg  Mg116  1  0.829428  0.401081  0.450770  1
  Mg  Mg117  1  0.749937  0.909499  0.434112  1
  Mg  Mg118  1  0.496095  0.401081  0.450770  1
  Mg  Mg119  1  0.416604  0.909499  0.434112  1
  Mg  Mg120  1  0.083270  0.909499  0.434112  1
  Mg  Mg121  1  0.706149  0.265600  0.471871  1
  Mg  Mg122  1  0.372816  0.265600  0.471871  1
  Mg  Mg123  1  0.293639  0.773925  0.455002  1
  Mg  Mg124  1  0.039482  0.265600  0.471871  1
  Mg  Mg125  1  0.960305  0.773925  0.455002  1
  Mg  Mg126  1  0.626972  0.773925  0.455002  1
  Mg  Mg127  1  0.170693  0.638502  0.475905  1
  Mg  Mg128  1  0.837359  0.638502  0.475905  1
  Mg  Mg129  1  0.757776  0.146813  0.459336  1
  Mg  Mg130  1  0.504026  0.638502  0.475905  1
  Mg  Mg131  1  0.424442  0.146813  0.459336  1
  Mg  Mg132  1  0.091109  0.146813  0.459336  1
  Mg  Mg133  1  1.000232  0.519689  0.463323  1
  Mg  Mg134  1  0.666899  0.519689  0.463323  1
  Mg  Mg135  1  0.412089  0.011442  0.480248  1
  Mg  Mg136  1  0.333565  0.519689  0.463323  1
  Mg  Mg137  1  0.078756  0.011442  0.480248  1
  Mg  Mg138  1  0.745422  0.011442  0.480248  1
  Mg  Mg139  1  0.987765  0.384334  0.484310  1
  Mg  Mg140  1  0.654431  0.384334  0.484310  1
  Mg  Mg141  1  0.574914  0.892639  0.467655  1
  Mg  Mg142  1  0.321098  0.384334  0.484310  1
  Mg  Mg143  1  0.241581  0.892639  0.467655  1
  Mg  Mg144  1  0.908247  0.892639  0.467655  1
  Mg  Mg145  1  0.531113  0.248863  0.505447  1
  Mg  Mg146  1  0.197780  0.248863  0.505447  1
  Mg  Mg147  1  0.118538  0.757163  0.488602  1
  Mg  Mg148  1  0.864446  0.248863  0.505447  1
  Mg  Mg149  1  0.785204  0.757163  0.488602  1
  Mg  Mg150  1  0.451871  0.757163  0.488602  1
  Mg  Mg151  1  0.995626  0.621750  0.509433  1
  Mg  Mg152  1  0.662293  0.621750  0.509433  1
  Mg  Mg153  1  0.582792  0.130098  0.492986  1
  Mg  Mg154  1  0.328960  0.621750  0.509433  1
  Mg  Mg155  1  0.249459  0.130098  0.492986  1
  Mg  Mg156  1  0.916126  0.130098  0.492986  1
  Mg  Mg157  1  0.825148  0.503025  0.497035  1
  Mg  Mg158  1  0.491814  0.503025  0.497035  1
  Mg  Mg159  1  0.237113  0.994677  0.513829  1
  Mg  Mg160  1  0.158481  0.503025  0.497035  1
  Mg  Mg161  1  0.903780  0.994677  0.513829  1
  Mg  Mg162  1  0.570447  0.994677  0.513829  1
  Mg  Mg163  1  0.812793  0.367664  0.517940  1
  Mg  Mg164  1  0.479460  0.367664  0.517940  1
  Mg  Mg165  1  0.399905  0.875944  0.501237  1
  Mg  Mg166  1  0.146127  0.367664  0.517940  1
  Mg  Mg167  1  0.066571  0.875944  0.501237  1
  Mg  Mg168  1  0.733238  0.875944  0.501237  1
  Mg  Mg169  1  0.356133  0.232158  0.539047  1
  Mg  Mg170  1  0.022800  0.232158  0.539047  1
  Mg  Mg171  1  0.943494  0.740433  0.522223  1
  Mg  Mg172  1  0.689466  0.232158  0.539047  1
  Mg  Mg173  1  0.610161  0.740433  0.522223  1
  Mg  Mg174  1  0.276828  0.740433  0.522223  1
  Mg  Mg175  1  0.820611  0.605093  0.543145  1
  Mg  Mg176  1  0.487278  0.605093  0.543145  1
  Mg  Mg177  1  0.407819  0.113374  0.526571  1
  Mg  Mg178  1  0.153944  0.605093  0.543145  1
  Mg  Mg179  1  0.074486  0.113374  0.526571  1
  Mg  Mg180  1  0.741152  0.113374  0.526571  1
  Mg  Mg181  1  0.650170  0.486266  0.530596  1
  Mg  Mg182  1  0.316836  0.486266  0.530596  1
  Mg  Mg183  1  0.062086  0.977954  0.547478  1
  Mg  Mg184  1  0.983503  0.486266  0.530596  1
  Mg  Mg185  1  0.728753  0.977954  0.547478  1
  Mg  Mg186  1  0.395419  0.977954  0.547478  1
  Mg  Mg187  1  0.637781  0.350878  0.551548  1
  Mg  Mg188  1  0.304448  0.350878  0.551548  1
  Mg  Mg189  1  0.224879  0.859196  0.534784  1
  Mg  Mg190  1  0.971115  0.350878  0.551548  1
  Mg  Mg191  1  0.891545  0.859196  0.534784  1
  Mg  Mg192  1  0.558212  0.859196  0.534784  1
  Mg  Mg193  1  0.181129  0.215453  0.572639  1
  Mg  Mg194  1  0.847796  0.215453  0.572639  1
  Mg  Mg195  1  0.768388  0.723726  0.555752  1
  Mg  Mg196  1  0.514463  0.215453  0.572639  1
  Mg  Mg197  1  0.435055  0.723726  0.555752  1
  Mg  Mg198  1  0.101722  0.723726  0.555752  1
  Mg  Mg199  1  0.645545  0.588259  0.576540  1
  Mg  Mg200  1  0.312211  0.588259  0.576540  1
  Mg  Mg201  1  0.232813  0.096609  0.560122  1
  Mg  Mg202  1  0.978878  0.588259  0.576540  1
  Mg  Mg203  1  0.899480  0.096609  0.560122  1
  Mg  Mg204  1  0.566147  0.096609  0.560122  1
  Mg  Mg205  1  0.475189  0.469615  0.564247  1
  Mg  Mg206  1  0.141856  0.469615  0.564247  1
  Mg  Mg207  1  0.887080  0.961192  0.580939  1
  Mg  Mg208  1  0.808523  0.469615  0.564247  1
  Mg  Mg209  1  0.553747  0.961192  0.580939  1
  Mg  Mg210  1  0.220413  0.961192  0.580939  1
  Mg  Mg211  1  0.462808  0.334262  0.585058  1
  Mg  Mg212  1  0.129474  0.334262  0.585058  1
  Mg  Mg213  1  0.049771  0.842437  0.568373  1
  Mg  Mg214  1  0.796141  0.334262  0.585058  1
  Mg  Mg215  1  0.716437  0.842437  0.568373  1
  Mg  Mg216  1  0.383104  0.842437  0.568373  1
  Mg  Mg217  1  0.005959  0.198433  0.606181  1
  Mg  Mg218  1  0.672625  0.198433  0.606181  1
  Mg  Mg219  1  0.593217  0.706833  0.589535  1
  Mg  Mg220  1  0.339292  0.198433  0.606181  1
  Mg  Mg221  1  0.259884  0.706833  0.589535  1
  Mg  Mg222  1  0.926550  0.706833  0.589535  1
  Mg  Mg223  1  0.470462  0.571488  0.610328  1
  Mg  Mg224  1  0.137129  0.571488  0.610328  1
  Mg  Mg225  1  0.057882  0.079782  0.593883  1
  Mg  Mg226  1  0.803795  0.571488  0.610328  1
  Mg  Mg227  1  0.724549  0.079782  0.593883  1
  Mg  Mg228  1  0.391215  0.079782  0.593883  1
  Mg  Mg229  1  0.300252  0.452583  0.597898  1
  Mg  Mg230  1  0.966918  0.452583  0.597898  1
  Mg  Mg231  1  0.711870  0.944251  0.614639  1
  Mg  Mg232  1  0.633585  0.452583  0.597898  1
  Mg  Mg233  1  0.378537  0.944251  0.614639  1
  Mg  Mg234  1  0.045203  0.944251  0.614639  1
  Mg  Mg235  1  0.287905  0.317404  0.618746  1
  Mg  Mg236  1  0.954571  0.317404  0.618746  1
  Mg  Mg237  1  0.874632  0.825498  0.601893  1
  Mg  Mg238  1  0.621238  0.317404  0.618746  1
  Mg  Mg239  1  0.541299  0.825498  0.601893  1
  Mg  Mg240  1  0.207965  0.825498  0.601893  1
  Mg  Mg241  1  0.831350  0.181987  0.639510  1
  Mg  Mg242  1  0.498017  0.181987  0.639510  1
  Mg  Mg243  1  0.417867  0.690049  0.622716  1
  Mg  Mg244  1  0.164684  0.181987  0.639510  1
  Mg  Mg245  1  0.084534  0.690049  0.622716  1
  Mg  Mg246  1  0.751201  0.690049  0.622716  1
  Mg  Mg247  1  0.295758  0.554650  0.643063  1
  Mg  Mg248  1  0.962425  0.554650  0.643063  1
  Mg  Mg249  1  0.882968  0.062976  0.627163  1
  Mg  Mg250  1  0.629091  0.554650  0.643063  1
  Mg  Mg251  1  0.549635  0.062976  0.627163  1
  Mg  Mg252  1  0.216301  0.062976  0.627163  1
  Mg  Mg253  1  0.125532  0.436288  0.631352  1
  Mg  Mg254  1  0.792198  0.436288  0.631352  1
  Mg  Mg255  1  0.536520  0.927276  0.647409  1
  Mg  Mg256  1  0.458865  0.436288  0.631352  1
  Mg  Mg257  1  0.203187  0.927276  0.647409  1
  Mg  Mg258  1  0.869853  0.927276  0.647409  1
  Mg  Mg259  1  0.112488  0.300400  0.651438  1
  Mg  Mg260  1  0.779155  0.300400  0.651438  1
  Mg  Mg261  1  0.699445  0.809068  0.635263  1
  Mg  Mg262  1  0.445822  0.300400  0.651438  1
  Mg  Mg263  1  0.366112  0.809068  0.635263  1
  Mg  Mg264  1  0.032779  0.809068  0.635263  1
  Mg  Mg265  1  0.656591  0.165240  0.672251  1
  Mg  Mg266  1  0.323258  0.165240  0.672251  1
  Mg  Mg267  1  0.242858  0.673046  0.655968  1
  Mg  Mg268  1  0.989924  0.165240  0.672251  1
  Mg  Mg269  1  0.909525  0.673046  0.655968  1
  Mg  Mg270  1  0.576192  0.673046  0.655968  1
  Mg  Mg271  1  0.120355  0.538177  0.676268  1
  Mg  Mg272  1  0.787022  0.538177  0.676268  1
  Mg  Mg273  1  0.708594  0.046109  0.660333  1
  Mg  Mg274  1  0.453688  0.538177  0.676268  1
  Mg  Mg275  1  0.375261  0.046109  0.660333  1
  Mg  Mg276  1  0.041927  0.046109  0.660333  1
  Mg  Mg277  1  0.950279  0.419217  0.664401  1
  Mg  Mg278  1  0.616946  0.419217  0.664401  1
  Mg  Mg279  1  0.362110  0.911322  0.680605  1
  Mg  Mg280  1  0.283613  0.419217  0.664401  1
  Mg  Mg281  1  0.028777  0.911322  0.680605  1
  Mg  Mg282  1  0.695443  0.911322  0.680605  1
  Mg  Mg283  1  0.937762  0.283940  0.684531  1
  Mg  Mg284  1  0.604429  0.283940  0.684531  1
  Mg  Mg285  1  0.523959  0.792058  0.667796  1
  Mg  Mg286  1  0.271095  0.283940  0.684531  1
  Mg  Mg287  1  0.190626  0.792058  0.667796  1
  Mg  Mg288  1  0.857292  0.792058  0.667796  1
  Mg  Mg289  1  0.483077  0.149006  0.704218  1
  Mg  Mg290  1  0.149744  0.149006  0.704218  1
  Mg  Mg291  1  0.067240  0.657452  0.688033  1
  Mg  Mg292  1  0.816411  0.149006  0.704218  1
  Mg  Mg293  1  0.733907  0.657452  0.688033  1
  Mg  Mg294  1  0.400573  0.657452  0.688033  1
  Mg  Mg295  1  0.944792  0.521702  0.707560  1
  Mg  Mg296  1  0.611459  0.521702  0.707560  1
  Mg  Mg297  1  0.534228  0.028928  0.692375  1
  Mg  Mg298  1  0.278126  0.521702  0.707560  1
  Mg  Mg299  1  0.200894  0.028928  0.692375  1
  Mg  Mg300  1  0.867561  0.028928  0.692375  1
  Mg  Mg301  1  0.775889  0.402063  0.696398  1
  Mg  Mg302  1  0.442556  0.402063  0.696398  1
  Mg  Mg303  1  0.185246  0.891602  0.711945  1
  Mg  Mg304  1  0.109223  0.402063  0.696398  1
  Mg  Mg305  1  0.851912  0.891602  0.711945  1
  Mg  Mg306  1  0.518579  0.891602  0.711945  1
  Mg  Mg307  1  0.762646  0.265930  0.715897  1
  Mg  Mg308  1  0.429312  0.265930  0.715897  1
  Mg  Mg309  1  0.349454  0.776805  0.699929  1
  Mg  Mg310  1  0.095979  0.265930  0.715897  1
  Mg  Mg311  1  0.016121  0.776805  0.699929  1
  Mg  Mg312  1  0.682787  0.776805  0.699929  1
