# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.50196383
_cell_length_b   31.19504538
_cell_length_c   45.81631146
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.94775866
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg156
_cell_volume   7833.08565115
_cell_formula_units_Z   156
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  0.984703  0.983363  0.281664  1
  Mg  Mg2  1  0.822948  0.312873  0.292741  1
  Mg  Mg3  1  0.659157  0.645136  0.304267  1
  Mg  Mg4  1  0.195816  0.229722  0.290113  1
  Mg  Mg5  1  0.031833  0.562037  0.301562  1
  Mg  Mg6  1  0.870255  0.895561  0.312088  1
  Mg  Mg7  1  0.904740  0.146660  0.287072  1
  Mg  Mg8  1  0.740797  0.479015  0.298460  1
  Mg  Mg9  1  0.579778  0.810824  0.310041  1
  Mg  Mg10  1  0.609865  0.064151  0.284324  1
  Mg  Mg11  1  0.449947  0.395944  0.295821  1
  Mg  Mg12  1  0.286578  0.728147  0.307403  1
  Mg  Mg13  1  0.489343  0.978130  0.314326  1
  Mg  Mg14  1  0.324139  0.310382  0.325808  1
  Mg  Mg15  1  0.160264  0.642628  0.337331  1
  Mg  Mg16  1  0.699939  0.227344  0.323001  1
  Mg  Mg17  1  0.535719  0.559590  0.334446  1
  Mg  Mg18  1  0.370774  0.892306  0.345257  1
  Mg  Mg19  1  0.406072  0.144443  0.320238  1
  Mg  Mg20  1  0.242014  0.476533  0.331555  1
  Mg  Mg21  1  0.078504  0.808952  0.342965  1
  Mg  Mg22  1  0.112166  0.061594  0.317534  1
  Mg  Mg23  1  0.948435  0.393464  0.328701  1
  Mg  Mg24  1  0.785034  0.725588  0.340345  1
  Mg  Mg25  1  0.990363  0.975632  0.348607  1
  Mg  Mg26  1  0.825395  0.307849  0.359892  1
  Mg  Mg27  1  0.661035  0.640126  0.371414  1
  Mg  Mg28  1  0.199665  0.224796  0.357131  1
  Mg  Mg29  1  0.035442  0.557062  0.368554  1
  Mg  Mg30  1  0.870584  0.889546  0.379657  1
  Mg  Mg31  1  0.907220  0.141743  0.354268  1
  Mg  Mg32  1  0.743238  0.473984  0.365619  1
  Mg  Mg33  1  0.578889  0.806484  0.377084  1
  Mg  Mg34  1  0.615275  0.058358  0.351209  1
  Mg  Mg35  1  0.451013  0.390900  0.362807  1
  Mg  Mg36  1  0.286778  0.723310  0.374349  1
  Mg  Mg37  1  0.492765  0.972646  0.382551  1
  Mg  Mg38  1  0.326732  0.305257  0.394240  1
  Mg  Mg39  1  0.162071  0.637649  0.405726  1
  Mg  Mg40  1  0.701262  0.222175  0.391429  1
  Mg  Mg41  1  0.536792  0.554510  0.402866  1
  Mg  Mg42  1  0.371407  0.886947  0.414164  1
  Mg  Mg43  1  0.409190  0.138969  0.388519  1
  Mg  Mg44  1  0.244476  0.471416  0.399970  1
  Mg  Mg45  1  0.079588  0.803855  0.411441  1
  Mg  Mg46  1  0.117292  0.055880  0.385666  1
  Mg  Mg47  1  0.952061  0.388332  0.397122  1
  Mg  Mg48  1  0.787258  0.720770  0.408668  1
  Mg  Mg49  1  0.994459  0.970005  0.417446  1
  Mg  Mg50  1  0.828168  0.302601  0.429052  1
  Mg  Mg51  1  0.663197  0.635051  0.440546  1
  Mg  Mg52  1  0.203084  0.219451  0.426215  1
  Mg  Mg53  1  0.038275  0.551932  0.437680  1
  Mg  Mg54  1  0.872487  0.884312  0.449084  1
  Mg  Mg55  1  0.910587  0.136330  0.423322  1
  Mg  Mg56  1  0.745745  0.468816  0.434785  1
  Mg  Mg57  1  0.580464  0.801254  0.446302  1
  Mg  Mg58  1  0.618589  0.053134  0.420338  1
  Mg  Mg59  1  0.453166  0.385707  0.431945  1
  Mg  Mg60  1  0.288045  0.718157  0.443466  1
  Mg  Mg61  1  0.495822  0.967390  0.452085  1
  Mg  Mg62  1  0.329512  0.299959  0.463745  1
  Mg  Mg63  1  0.164377  0.632451  0.475243  1
  Mg  Mg64  1  0.704523  0.216833  0.460890  1
  Mg  Mg65  1  0.539516  0.549332  0.472365  1
  Mg  Mg66  1  0.373553  0.881765  0.483846  1
  Mg  Mg67  1  0.412148  0.133671  0.457990  1
  Mg  Mg68  1  0.247006  0.466210  0.469488  1
  Mg  Mg69  1  0.081591  0.798667  0.481004  1
  Mg  Mg70  1  0.119987  0.050542  0.455089  1
  Mg  Mg71  1  0.954475  0.383089  0.466624  1
  Mg  Mg72  1  0.789176  0.715569  0.478161  1
  Mg  Mg73  1  0.997171  0.964842  0.486909  1
  Mg  Mg74  1  0.830883  0.297335  0.498480  1
  Mg  Mg75  1  0.665608  0.629845  0.509985  1
  Mg  Mg76  1  0.205976  0.214197  0.495606  1
  Mg  Mg77  1  0.040754  0.546714  0.507092  1
  Mg  Mg78  1  0.874768  0.879198  0.518603  1
  Mg  Mg79  1  0.913501  0.131070  0.492729  1
  Mg  Mg80  1  0.748270  0.463591  0.504224  1
  Mg  Mg81  1  0.582776  0.796100  0.515781  1
  Mg  Mg82  1  0.621269  0.047928  0.489787  1
  Mg  Mg83  1  0.455775  0.380461  0.501350  1
  Mg  Mg84  1  0.290428  0.712965  0.512874  1
  Mg  Mg85  1  0.498389  0.962259  0.521674  1
  Mg  Mg86  1  0.332221  0.294713  0.533210  1
  Mg  Mg87  1  0.166823  0.627223  0.544704  1
  Mg  Mg88  1  0.707350  0.211590  0.530341  1
  Mg  Mg89  1  0.541982  0.544100  0.541826  1
  Mg  Mg90  1  0.376024  0.876639  0.553429  1
  Mg  Mg91  1  0.414893  0.128466  0.527452  1
  Mg  Mg92  1  0.249558  0.460968  0.538955  1
  Mg  Mg93  1  0.084169  0.793498  0.550493  1
  Mg  Mg94  1  0.122552  0.045371  0.524564  1
  Mg  Mg95  1  0.957099  0.377842  0.536081  1
  Mg  Mg96  1  0.791717  0.710379  0.547618  1
  Mg  Mg97  1  0.999577  0.959730  0.556428  1
  Mg  Mg98  1  0.833558  0.292108  0.567917  1
  Mg  Mg99  1  0.668136  0.624605  0.579410  1
  Mg  Mg100  1  0.208678  0.208985  0.565016  1
  Mg  Mg101  1  0.043215  0.541467  0.576494  1
  Mg  Mg102  1  0.877376  0.874025  0.588039  1
  Mg  Mg103  1  0.916178  0.125867  0.562174  1
  Mg  Mg104  1  0.750833  0.458348  0.573658  1
  Mg  Mg105  1  0.585517  0.790923  0.585261  1
  Mg  Mg106  1  0.623688  0.042768  0.559248  1
  Mg  Mg107  1  0.458423  0.375233  0.570755  1
  Mg  Mg108  1  0.293169  0.707713  0.582258  1
  Mg  Mg109  1  0.500583  0.957081  0.591357  1
  Mg  Mg110  1  0.334878  0.289522  0.602721  1
  Mg  Mg111  1  0.169309  0.621947  0.614191  1
  Mg  Mg112  1  0.709726  0.206387  0.599839  1
  Mg  Mg113  1  0.544210  0.538821  0.611307  1
  Mg  Mg114  1  0.378523  0.871451  0.622956  1
  Mg  Mg115  1  0.417472  0.123266  0.596980  1
  Mg  Mg116  1  0.252124  0.455716  0.608466  1
  Mg  Mg117  1  0.087364  0.788153  0.619954  1
  Mg  Mg118  1  0.125100  0.040164  0.594121  1
  Mg  Mg119  1  0.959962  0.372627  0.605577  1
  Mg  Mg120  1  0.794569  0.705139  0.617097  1
  Mg  Mg121  1  0.001369  0.954491  0.625833  1
  Mg  Mg122  1  0.836114  0.286987  0.637065  1
  Mg  Mg123  1  0.670646  0.619273  0.648516  1
  Mg  Mg124  1  0.210693  0.203904  0.634129  1
  Mg  Mg125  1  0.045296  0.536195  0.645605  1
  Mg  Mg126  1  0.880914  0.868448  0.656832  1
  Mg  Mg127  1  0.918795  0.120711  0.631339  1
  Mg  Mg128  1  0.753378  0.453134  0.642815  1
  Mg  Mg129  1  0.588288  0.785734  0.654418  1
  Mg  Mg130  1  0.626417  0.037581  0.628445  1
  Mg  Mg131  1  0.461451  0.370069  0.639886  1
  Mg  Mg132  1  0.296232  0.702388  0.651346  1
  Mg  Mg133  1  0.502802  0.951727  0.660241  1
  Mg  Mg134  1  0.337389  0.284464  0.671126  1
  Mg  Mg135  1  0.171838  0.616645  0.682550  1
  Mg  Mg136  1  0.713511  0.201401  0.668228  1
  Mg  Mg137  1  0.547972  0.533645  0.679721  1
  Mg  Mg138  1  0.381695  0.865755  0.691116  1
  Mg  Mg139  1  0.419987  0.118388  0.665353  1
  Mg  Mg140  1  0.254660  0.450579  0.676886  1
  Mg  Mg141  1  0.089798  0.782724  0.688242  1
  Mg  Mg142  1  0.126662  0.035077  0.662618  1
  Mg  Mg143  1  0.961359  0.367512  0.673995  1
  Mg  Mg144  1  0.795546  0.699711  0.685395  1
  Mg  Mg145  1  0.000426  0.948876  0.693384  1
  Mg  Mg146  1  0.838589  0.281966  0.704216  1
  Mg  Mg147  1  0.673089  0.614238  0.715670  1
  Mg  Mg148  1  0.212319  0.199009  0.701132  1
  Mg  Mg149  1  0.046447  0.531186  0.712604  1
  Mg  Mg150  1  0.882816  0.861665  0.723629  1
  Mg  Mg151  1  0.921785  0.116043  0.698475  1
  Mg  Mg152  1  0.755904  0.448097  0.709969  1
  Mg  Mg153  1  0.589684  0.779538  0.721444  1
  Mg  Mg154  1  0.630899  0.033253  0.695382  1
  Mg  Mg155  1  0.465314  0.365048  0.706877  1
  Mg  Mg156  1  0.298243  0.697043  0.718333  1
