# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.85204234
_cell_length_b   22.45136853
_cell_length_c   48.44950176
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.89738821
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg288
_cell_volume   13763.1511086
_cell_formula_units_Z   288
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  0.922944  0.665409  0.282717  1
  Mg  Mg2  1  0.474993  0.467000  0.340861  1
  Mg  Mg3  1  0.529594  0.648515  0.297119  1
  Mg  Mg4  1  0.806814  0.133550  0.340629  1
  Mg  Mg5  1  0.865389  0.314038  0.296787  1
  Mg  Mg6  1  0.801812  0.454408  0.310231  1
  Mg  Mg7  1  0.257447  0.333285  0.282927  1
  Mg  Mg8  1  0.200274  0.477419  0.296824  1
  Mg  Mg9  1  0.142067  0.618711  0.310145  1
  Mg  Mg10  1  0.474162  0.967301  0.340706  1
  Mg  Mg11  1  0.531931  0.148342  0.297077  1
  Mg  Mg12  1  0.474691  0.286709  0.310788  1
  Mg  Mg13  1  0.865787  0.809941  0.296716  1
  Mg  Mg14  1  0.801951  0.953758  0.310244  1
  Mg  Mg15  1  0.256997  0.834378  0.283098  1
  Mg  Mg16  1  0.200433  0.976844  0.296921  1
  Mg  Mg17  1  0.141072  0.118581  0.309815  1
  Mg  Mg18  1  0.471336  0.787869  0.311303  1
  Mg  Mg19  1  0.090211  0.749854  0.282780  1
  Mg  Mg20  1  0.751722  0.583516  0.282689  1
  Mg  Mg21  1  0.698630  0.727955  0.296937  1
  Mg  Mg22  1  0.087875  0.249543  0.282475  1
  Mg  Mg23  1  0.031350  0.395077  0.296440  1
  Mg  Mg24  1  0.971050  0.536574  0.310271  1
  Mg  Mg25  1  0.427396  0.417061  0.283855  1
  Mg  Mg26  1  0.375228  0.558603  0.297942  1
  Mg  Mg27  1  0.304569  0.703843  0.311154  1
  Mg  Mg28  1  0.756737  0.084401  0.283621  1
  Mg  Mg29  1  0.708365  0.226201  0.298022  1
  Mg  Mg30  1  0.640304  0.368687  0.312252  1
  Mg  Mg31  1  0.029916  0.894953  0.296729  1
  Mg  Mg32  1  0.972135  0.036079  0.311406  1
  Mg  Mg33  1  0.427655  0.917517  0.283719  1
  Mg  Mg34  1  0.374045  0.059221  0.297698  1
  Mg  Mg35  1  0.304748  0.203597  0.310679  1
  Mg  Mg36  1  0.639946  0.868864  0.312060  1
  Mg  Mg37  1  0.807975  0.635252  0.338800  1
  Mg  Mg38  1  0.358825  0.436202  0.396333  1
  Mg  Mg39  1  0.418289  0.613826  0.354232  1
  Mg  Mg40  1  0.691304  0.102394  0.395845  1
  Mg  Mg41  1  0.753652  0.279646  0.354556  1
  Mg  Mg42  1  0.693623  0.423257  0.368127  1
  Mg  Mg43  1  0.140177  0.302241  0.338665  1
  Mg  Mg44  1  0.085343  0.446408  0.353149  1
  Mg  Mg45  1  0.026875  0.589249  0.366867  1
  Mg  Mg46  1  0.358718  0.936540  0.396379  1
  Mg  Mg47  1  0.417791  0.113923  0.354017  1
  Mg  Mg48  1  0.359076  0.256355  0.367226  1
  Mg  Mg49  1  0.753448  0.778830  0.353743  1
  Mg  Mg50  1  0.693072  0.923117  0.367921  1
  Mg  Mg51  1  0.141168  0.802937  0.339055  1
  Mg  Mg52  1  0.085224  0.946174  0.353633  1
  Mg  Mg53  1  0.026804  0.089264  0.367642  1
  Mg  Mg54  1  0.359465  0.756622  0.367614  1
  Mg  Mg55  1  0.976402  0.718023  0.338655  1
  Mg  Mg56  1  0.637531  0.551960  0.337999  1
  Mg  Mg57  1  0.585385  0.696442  0.353633  1
  Mg  Mg58  1  0.972279  0.216928  0.337334  1
  Mg  Mg59  1  0.917316  0.363753  0.352895  1
  Mg  Mg60  1  0.858535  0.506475  0.366556  1
  Mg  Mg61  1  0.308845  0.384919  0.339131  1
  Mg  Mg62  1  0.252963  0.529428  0.353540  1
  Mg  Mg63  1  0.192677  0.672998  0.367132  1
  Mg  Mg64  1  0.637491  0.051518  0.338073  1
  Mg  Mg65  1  0.585723  0.196446  0.353800  1
  Mg  Mg66  1  0.526869  0.338749  0.367769  1
  Mg  Mg67  1  0.916936  0.863283  0.352959  1
  Mg  Mg68  1  0.858363  0.005650  0.367009  1
  Mg  Mg69  1  0.308519  0.885613  0.339468  1
  Mg  Mg70  1  0.251657  0.029740  0.353337  1
  Mg  Mg71  1  0.191075  0.173020  0.366562  1
  Mg  Mg72  1  0.527228  0.839000  0.367858  1
  Mg  Mg73  1  0.691803  0.602534  0.395435  1
  Mg  Mg74  1  0.242504  0.405147  0.453246  1
  Mg  Mg75  1  0.302395  0.581816  0.410660  1
  Mg  Mg76  1  0.575748  0.071971  0.453418  1
  Mg  Mg77  1  0.636313  0.248236  0.410962  1
  Mg  Mg78  1  0.577863  0.391789  0.424822  1
  Mg  Mg79  1  0.024077  0.269551  0.394972  1
  Mg  Mg80  1  0.968411  0.415275  0.410071  1
  Mg  Mg81  1  0.911164  0.558106  0.424112  1
  Mg  Mg82  1  0.242947  0.905183  0.453520  1
  Mg  Mg83  1  0.301570  0.082088  0.410383  1
  Mg  Mg84  1  0.243427  0.225224  0.424106  1
  Mg  Mg85  1  0.636515  0.747923  0.410764  1
  Mg  Mg86  1  0.577691  0.891965  0.424802  1
  Mg  Mg87  1  0.025050  0.770211  0.395746  1
  Mg  Mg88  1  0.968558  0.914856  0.410331  1
  Mg  Mg89  1  0.911021  0.058107  0.424432  1
  Mg  Mg90  1  0.243949  0.725222  0.424498  1
  Mg  Mg91  1  0.859317  0.685991  0.395949  1
  Mg  Mg92  1  0.525347  0.520191  0.396527  1
  Mg  Mg93  1  0.469819  0.665145  0.411039  1
  Mg  Mg94  1  0.858868  0.186176  0.396471  1
  Mg  Mg95  1  0.803326  0.331720  0.411124  1
  Mg  Mg96  1  0.744429  0.475546  0.424966  1
  Mg  Mg97  1  0.191719  0.353345  0.395912  1
  Mg  Mg98  1  0.136246  0.498193  0.410431  1
  Mg  Mg99  1  0.077645  0.641763  0.424419  1
  Mg  Mg100  1  0.525038  0.020295  0.396405  1
  Mg  Mg101  1  0.469491  0.165268  0.410866  1
  Mg  Mg102  1  0.410820  0.308396  0.424754  1
  Mg  Mg103  1  0.802449  0.831424  0.410692  1
  Mg  Mg104  1  0.744147  0.975346  0.424840  1
  Mg  Mg105  1  0.192472  0.853460  0.396317  1
  Mg  Mg106  1  0.136276  0.998071  0.410806  1
  Mg  Mg107  1  0.077414  0.142137  0.424713  1
  Mg  Mg108  1  0.411427  0.808467  0.424981  1
  Mg  Mg109  1  0.575989  0.571806  0.453489  1
  Mg  Mg110  1  0.126473  0.373501  0.510171  1
  Mg  Mg111  1  0.186697  0.550071  0.467736  1
  Mg  Mg112  1  0.459536  0.040451  0.510215  1
  Mg  Mg113  1  0.520158  0.216913  0.468014  1
  Mg  Mg114  1  0.461766  0.360769  0.482017  1
  Mg  Mg115  1  0.909160  0.238476  0.453440  1
  Mg  Mg116  1  0.853487  0.383559  0.468025  1
  Mg  Mg117  1  0.795577  0.527307  0.482086  1
  Mg  Mg118  1  0.126699  0.873675  0.510357  1
  Mg  Mg119  1  0.186473  0.050305  0.467955  1
  Mg  Mg120  1  0.128338  0.194214  0.481951  1
  Mg  Mg121  1  0.520691  0.716781  0.468184  1
  Mg  Mg122  1  0.462106  0.860841  0.482182  1
  Mg  Mg123  1  0.909193  0.738260  0.453088  1
  Mg  Mg124  1  0.853036  0.883468  0.467788  1
  Mg  Mg125  1  0.795281  0.027327  0.481935  1
  Mg  Mg126  1  0.128339  0.693903  0.481746  1
  Mg  Mg127  1  0.742721  0.654321  0.452808  1
  Mg  Mg128  1  0.409296  0.488421  0.453182  1
  Mg  Mg129  1  0.353047  0.633680  0.467823  1
  Mg  Mg130  1  0.742651  0.154714  0.453072  1
  Mg  Mg131  1  0.686461  0.300286  0.467974  1
  Mg  Mg132  1  0.628643  0.443955  0.481898  1
  Mg  Mg133  1  0.075328  0.321647  0.452636  1
  Mg  Mg134  1  0.019569  0.466722  0.467487  1
  Mg  Mg135  1  0.961973  0.610221  0.481450  1
  Mg  Mg136  1  0.408940  0.988756  0.453164  1
  Mg  Mg137  1  0.352555  0.133832  0.467627  1
  Mg  Mg138  1  0.294790  0.277254  0.481580  1
  Mg  Mg139  1  0.686450  0.800165  0.467778  1
  Mg  Mg140  1  0.628296  0.944139  0.481788  1
  Mg  Mg141  1  0.075824  0.821841  0.453092  1
  Mg  Mg142  1  0.019649  0.966712  0.467672  1
  Mg  Mg143  1  0.961768  0.110534  0.481739  1
  Mg  Mg144  1  0.295180  0.777180  0.481787  1
  Mg  Mg145  1  0.459884  0.540162  0.510206  1
  Mg  Mg146  1  0.010814  0.342523  0.567975  1
  Mg  Mg147  1  0.070236  0.518645  0.524769  1
  Mg  Mg148  1  0.343939  0.009388  0.568014  1
  Mg  Mg149  1  0.403476  0.185640  0.524862  1
  Mg  Mg150  1  0.345690  0.329267  0.538904  1
  Mg  Mg151  1  0.793243  0.206975  0.510348  1
  Mg  Mg152  1  0.736884  0.352233  0.525040  1
  Mg  Mg153  1  0.679612  0.495653  0.538992  1
  Mg  Mg154  1  0.010630  0.842362  0.567527  1
  Mg  Mg155  1  0.070255  0.018851  0.524904  1
  Mg  Mg156  1  0.012378  0.162542  0.539001  1
  Mg  Mg157  1  0.403976  0.685621  0.525001  1
  Mg  Mg158  1  0.345876  0.829254  0.538964  1
  Mg  Mg159  1  0.793100  0.706407  0.509920  1
  Mg  Mg160  1  0.736809  0.852380  0.524801  1
  Mg  Mg161  1  0.679128  0.995939  0.538773  1
  Mg  Mg162  1  0.012539  0.662163  0.538610  1
  Mg  Mg163  1  0.626822  0.623461  0.510584  1
  Mg  Mg164  1  0.293175  0.457152  0.510482  1
  Mg  Mg165  1  0.237520  0.602079  0.524984  1
  Mg  Mg166  1  0.626612  0.123781  0.510459  1
  Mg  Mg167  1  0.570579  0.268904  0.525109  1
  Mg  Mg168  1  0.512384  0.412945  0.539251  1
  Mg  Mg169  1  0.959970  0.290510  0.510615  1
  Mg  Mg170  1  0.904278  0.435261  0.525146  1
  Mg  Mg171  1  0.846296  0.579180  0.539300  1
  Mg  Mg172  1  0.293380  0.957339  0.510657  1
  Mg  Mg173  1  0.237300  0.102285  0.525219  1
  Mg  Mg174  1  0.179235  0.245978  0.539287  1
  Mg  Mg175  1  0.571307  0.768918  0.525345  1
  Mg  Mg176  1  0.512584  0.913037  0.539411  1
  Mg  Mg177  1  0.959809  0.790302  0.510284  1
  Mg  Mg178  1  0.904003  0.935407  0.524949  1
  Mg  Mg179  1  0.845907  0.079263  0.539084  1
  Mg  Mg180  1  0.179185  0.745817  0.539028  1
  Mg  Mg181  1  0.343807  0.509309  0.567776  1
  Mg  Mg182  1  0.894501  0.311265  0.625334  1
  Mg  Mg183  1  0.955155  0.486932  0.582384  1
  Mg  Mg184  1  0.227821  0.977614  0.625236  1
  Mg  Mg185  1  0.288432  0.154052  0.582664  1
  Mg  Mg186  1  0.229782  0.297860  0.596556  1
  Mg  Mg187  1  0.677288  0.175817  0.567567  1
  Mg  Mg188  1  0.620786  0.321039  0.582232  1
  Mg  Mg189  1  0.562896  0.465062  0.596518  1
  Mg  Mg190  1  0.893922  0.809993  0.623577  1
  Mg  Mg191  1  0.954870  0.987297  0.582162  1
  Mg  Mg192  1  0.896336  0.131127  0.596205  1
  Mg  Mg193  1  0.288827  0.654033  0.582317  1
  Mg  Mg194  1  0.229922  0.797727  0.596261  1
  Mg  Mg195  1  0.677505  0.675488  0.567704  1
  Mg  Mg196  1  0.621946  0.821278  0.582613  1
  Mg  Mg197  1  0.563248  0.964912  0.596767  1
  Mg  Mg198  1  0.896695  0.631367  0.596479  1
  Mg  Mg199  1  0.510753  0.591788  0.567071  1
  Mg  Mg200  1  0.177381  0.425622  0.567514  1
  Mg  Mg201  1  0.120805  0.570639  0.582008  1
  Mg  Mg202  1  0.510354  0.091984  0.567118  1
  Mg  Mg203  1  0.454144  0.237582  0.582028  1
  Mg  Mg204  1  0.395928  0.381433  0.596075  1
  Mg  Mg205  1  0.844056  0.259279  0.567604  1
  Mg  Mg206  1  0.787568  0.403961  0.582252  1
  Mg  Mg207  1  0.730629  0.547288  0.596008  1
  Mg  Mg208  1  0.177504  0.925840  0.567549  1
  Mg  Mg209  1  0.121032  0.070755  0.582214  1
  Mg  Mg210  1  0.062669  0.214465  0.596208  1
  Mg  Mg211  1  0.454845  0.737812  0.582159  1
  Mg  Mg212  1  0.395898  0.881442  0.596067  1
  Mg  Mg213  1  0.843571  0.758510  0.566797  1
  Mg  Mg214  1  0.787512  0.904434  0.581874  1
  Mg  Mg215  1  0.729839  0.047523  0.595698  1
  Mg  Mg216  1  0.063082  0.714080  0.595554  1
  Mg  Mg217  1  0.228001  0.477669  0.624961  1
  Mg  Mg218  1  0.779981  0.280831  0.682541  1
  Mg  Mg219  1  0.838109  0.455800  0.639441  1
  Mg  Mg220  1  0.112692  0.946630  0.682550  1
  Mg  Mg221  1  0.171441  0.122831  0.639463  1
  Mg  Mg222  1  0.112752  0.265263  0.653300  1
  Mg  Mg223  1  0.560912  0.143152  0.623754  1
  Mg  Mg224  1  0.504466  0.290107  0.638997  1
  Mg  Mg225  1  0.445608  0.433131  0.653053  1
  Mg  Mg226  1  0.778339  0.780369  0.683053  1
  Mg  Mg227  1  0.838517  0.956427  0.638941  1
  Mg  Mg228  1  0.780000  0.098914  0.652350  1
  Mg  Mg229  1  0.170665  0.623062  0.639076  1
  Mg  Mg230  1  0.113713  0.764813  0.652452  1
  Mg  Mg231  1  0.561483  0.642991  0.623619  1
  Mg  Mg232  1  0.505002  0.790662  0.639215  1
  Mg  Mg233  1  0.445855  0.932806  0.653075  1
  Mg  Mg234  1  0.781481  0.598336  0.652921  1
  Mg  Mg235  1  0.394465  0.561496  0.625184  1
  Mg  Mg236  1  0.062265  0.394410  0.625384  1
  Mg  Mg237  1  0.005474  0.539218  0.639415  1
  Mg  Mg238  1  0.395265  0.061159  0.625446  1
  Mg  Mg239  1  0.339531  0.206360  0.639972  1
  Mg  Mg240  1  0.280929  0.348286  0.653962  1
  Mg  Mg241  1  0.728638  0.228373  0.624531  1
  Mg  Mg242  1  0.671469  0.373180  0.639438  1
  Mg  Mg243  1  0.613766  0.516334  0.653793  1
  Mg  Mg244  1  0.062603  0.894400  0.624646  1
  Mg  Mg245  1  0.005776  0.039370  0.639305  1
  Mg  Mg246  1  0.946152  0.182466  0.653378  1
  Mg  Mg247  1  0.340384  0.706403  0.639626  1
  Mg  Mg248  1  0.280487  0.848645  0.653786  1
  Mg  Mg249  1  0.728497  0.728007  0.624731  1
  Mg  Mg250  1  0.673848  0.873355  0.640136  1
  Mg  Mg251  1  0.615301  0.015376  0.654352  1
  Mg  Mg252  1  0.945898  0.683629  0.653712  1
  Mg  Mg253  1  0.117073  0.447901  0.681865  1
  Mg  Mg254  1  0.644730  0.239850  0.735483  1
  Mg  Mg255  1  0.725601  0.424975  0.696453  1
  Mg  Mg256  1  0.981121  0.906784  0.735134  1
  Mg  Mg257  1  0.059053  0.090985  0.696186  1
  Mg  Mg258  1  0.998334  0.235138  0.709715  1
  Mg  Mg259  1  0.449949  0.114488  0.681879  1
  Mg  Mg260  1  0.398724  0.257205  0.697522  1
  Mg  Mg261  1  0.333830  0.401897  0.709905  1
  Mg  Mg262  1  0.641520  0.738178  0.735410  1
  Mg  Mg263  1  0.731710  0.923675  0.698125  1
  Mg  Mg264  1  0.665208  0.071739  0.710507  1
  Mg  Mg265  1  0.058657  0.592205  0.695875  1
  Mg  Mg266  1  0.996614  0.738228  0.710275  1
  Mg  Mg267  1  0.449231  0.614950  0.681721  1
  Mg  Mg268  1  0.398869  0.757300  0.697256  1
  Mg  Mg269  1  0.331670  0.901961  0.710076  1
  Mg  Mg270  1  0.664922  0.572102  0.710150  1
  Mg  Mg271  1  0.282996  0.531466  0.681443  1
  Mg  Mg272  1  0.950349  0.364186  0.681696  1
  Mg  Mg273  1  0.891232  0.508503  0.695907  1
  Mg  Mg274  1  0.283016  0.030593  0.681616  1
  Mg  Mg275  1  0.225411  0.175229  0.696024  1
  Mg  Mg276  1  0.168094  0.317481  0.709358  1
  Mg  Mg277  1  0.616306  0.195840  0.678486  1
  Mg  Mg278  1  0.557491  0.343271  0.695221  1
  Mg  Mg279  1  0.499705  0.486265  0.709331  1
  Mg  Mg280  1  0.948473  0.861317  0.678482  1
  Mg  Mg281  1  0.889211  0.009843  0.695055  1
  Mg  Mg282  1  0.832047  0.152173  0.708705  1
  Mg  Mg283  1  0.224169  0.675808  0.695610  1
  Mg  Mg284  1  0.167068  0.817298  0.708680  1
  Mg  Mg285  1  0.616280  0.695313  0.678292  1
  Mg  Mg286  1  0.557134  0.843882  0.695681  1
  Mg  Mg287  1  0.501063  0.985317  0.709371  1
  Mg  Mg288  1  0.832815  0.652082  0.709250  1
