# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.53378239
_cell_length_b   14.04704847
_cell_length_c   46.96192048
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg216
_cell_volume   10906.9456027
_cell_formula_units_Z   216
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  0.057506  0.725619  0.293210  1
  Mg  Mg2  1  0.225932  0.649326  0.317765  1
  Mg  Mg3  1  0.059266  0.149326  0.317765  1
  Mg  Mg4  1  0.390839  0.725619  0.293210  1
  Mg  Mg5  1  0.559266  0.649326  0.317765  1
  Mg  Mg6  1  0.224172  0.225619  0.293210  1
  Mg  Mg7  1  0.392599  0.149326  0.317765  1
  Mg  Mg8  1  0.724172  0.725619  0.293210  1
  Mg  Mg9  1  0.892599  0.649326  0.317765  1
  Mg  Mg10  1  0.557506  0.225619  0.293210  1
  Mg  Mg11  1  0.725932  0.149326  0.317765  1
  Mg  Mg12  1  0.890839  0.225619  0.293210  1
  Mg  Mg13  1  0.115031  0.936660  0.306217  1
  Mg  Mg14  1  0.281026  0.008044  0.282882  1
  Mg  Mg15  1  0.114359  0.508044  0.282882  1
  Mg  Mg16  1  0.448364  0.936660  0.306217  1
  Mg  Mg17  1  0.614359  0.008044  0.282882  1
  Mg  Mg18  1  0.281698  0.436660  0.306217  1
  Mg  Mg19  1  0.447693  0.508044  0.282882  1
  Mg  Mg20  1  0.781698  0.936660  0.306217  1
  Mg  Mg21  1  0.947693  0.008044  0.282882  1
  Mg  Mg22  1  0.615031  0.436660  0.306217  1
  Mg  Mg23  1  0.781026  0.508044  0.282882  1
  Mg  Mg24  1  0.948364  0.436660  0.306217  1
  Mg  Mg25  1  0.059197  0.572888  0.343672  1
  Mg  Mg26  1  0.225291  0.495360  0.367736  1
  Mg  Mg27  1  0.058624  0.995360  0.367736  1
  Mg  Mg28  1  0.392531  0.572888  0.343672  1
  Mg  Mg29  1  0.558624  0.495360  0.367736  1
  Mg  Mg30  1  0.225864  0.072888  0.343672  1
  Mg  Mg31  1  0.391957  0.995360  0.367736  1
  Mg  Mg32  1  0.725864  0.572888  0.343672  1
  Mg  Mg33  1  0.891957  0.495360  0.367736  1
  Mg  Mg34  1  0.559197  0.072888  0.343672  1
  Mg  Mg35  1  0.725291  0.995360  0.367736  1
  Mg  Mg36  1  0.892531  0.072888  0.343672  1
  Mg  Mg37  1  0.112527  0.783137  0.355785  1
  Mg  Mg38  1  0.279436  0.859018  0.331451  1
  Mg  Mg39  1  0.112770  0.359018  0.331451  1
  Mg  Mg40  1  0.445860  0.783137  0.355785  1
  Mg  Mg41  1  0.612770  0.859018  0.331451  1
  Mg  Mg42  1  0.279193  0.283137  0.355785  1
  Mg  Mg43  1  0.446103  0.359018  0.331451  1
  Mg  Mg44  1  0.779193  0.783137  0.355785  1
  Mg  Mg45  1  0.946103  0.859018  0.331451  1
  Mg  Mg46  1  0.612527  0.283137  0.355785  1
  Mg  Mg47  1  0.779436  0.359018  0.331451  1
  Mg  Mg48  1  0.945860  0.283137  0.355785  1
  Mg  Mg49  1  0.058127  0.418719  0.393097  1
  Mg  Mg50  1  0.224596  0.341880  0.418135  1
  Mg  Mg51  1  0.057929  0.841880  0.418135  1
  Mg  Mg52  1  0.391461  0.418719  0.393097  1
  Mg  Mg53  1  0.557929  0.341880  0.418135  1
  Mg  Mg54  1  0.224794  0.918719  0.393097  1
  Mg  Mg55  1  0.391263  0.841880  0.418135  1
  Mg  Mg56  1  0.724794  0.418719  0.393097  1
  Mg  Mg57  1  0.891263  0.341880  0.418135  1
  Mg  Mg58  1  0.558127  0.918719  0.393097  1
  Mg  Mg59  1  0.724596  0.841880  0.418135  1
  Mg  Mg60  1  0.891461  0.918719  0.393097  1
  Mg  Mg61  1  0.113365  0.630058  0.405861  1
  Mg  Mg62  1  0.279458  0.706312  0.380698  1
  Mg  Mg63  1  0.112791  0.206312  0.380698  1
  Mg  Mg64  1  0.446698  0.630058  0.405861  1
  Mg  Mg65  1  0.612791  0.706312  0.380698  1
  Mg  Mg66  1  0.280032  0.130058  0.405861  1
  Mg  Mg67  1  0.446124  0.206312  0.380698  1
  Mg  Mg68  1  0.780032  0.630058  0.405861  1
  Mg  Mg69  1  0.946124  0.706312  0.380698  1
  Mg  Mg70  1  0.613365  0.130058  0.405861  1
  Mg  Mg71  1  0.779458  0.206312  0.380698  1
  Mg  Mg72  1  0.946698  0.130058  0.405861  1
  Mg  Mg73  1  0.057965  0.265166  0.443334  1
  Mg  Mg74  1  0.224526  0.188304  0.468417  1
  Mg  Mg75  1  0.057860  0.688304  0.468417  1
  Mg  Mg76  1  0.391298  0.265166  0.443334  1
  Mg  Mg77  1  0.557860  0.188304  0.468417  1
  Mg  Mg78  1  0.224632  0.765166  0.443334  1
  Mg  Mg79  1  0.391193  0.688304  0.468417  1
  Mg  Mg80  1  0.724632  0.265166  0.443334  1
  Mg  Mg81  1  0.891193  0.188304  0.468417  1
  Mg  Mg82  1  0.557965  0.765166  0.443334  1
  Mg  Mg83  1  0.724526  0.688304  0.468417  1
  Mg  Mg84  1  0.891298  0.765166  0.443334  1
  Mg  Mg85  1  0.113238  0.476553  0.455915  1
  Mg  Mg86  1  0.279887  0.553197  0.430777  1
  Mg  Mg87  1  0.113220  0.053197  0.430777  1
  Mg  Mg88  1  0.446571  0.476553  0.455915  1
  Mg  Mg89  1  0.613220  0.553197  0.430777  1
  Mg  Mg90  1  0.279904  0.976553  0.455915  1
  Mg  Mg91  1  0.446554  0.053197  0.430777  1
  Mg  Mg92  1  0.779904  0.476553  0.455915  1
  Mg  Mg93  1  0.946554  0.553197  0.430777  1
  Mg  Mg94  1  0.613238  0.976553  0.455915  1
  Mg  Mg95  1  0.779887  0.053197  0.430777  1
  Mg  Mg96  1  0.946571  0.976553  0.455915  1
  Mg  Mg97  1  0.057884  0.111463  0.493478  1
  Mg  Mg98  1  0.224541  0.034709  0.518604  1
  Mg  Mg99  1  0.057874  0.534709  0.518604  1
  Mg  Mg100  1  0.391218  0.111463  0.493478  1
  Mg  Mg101  1  0.557874  0.034709  0.518604  1
  Mg  Mg102  1  0.224551  0.611463  0.493478  1
  Mg  Mg103  1  0.391208  0.534709  0.518604  1
  Mg  Mg104  1  0.724551  0.111463  0.493478  1
  Mg  Mg105  1  0.891208  0.034709  0.518604  1
  Mg  Mg106  1  0.557884  0.611463  0.493478  1
  Mg  Mg107  1  0.724541  0.534709  0.518604  1
  Mg  Mg108  1  0.891218  0.611463  0.493478  1
  Mg  Mg109  1  0.113205  0.323014  0.506099  1
  Mg  Mg110  1  0.279881  0.399768  0.480972  1
  Mg  Mg111  1  0.113215  0.899768  0.480972  1
  Mg  Mg112  1  0.446538  0.323014  0.506099  1
  Mg  Mg113  1  0.613215  0.399768  0.480972  1
  Mg  Mg114  1  0.279871  0.823014  0.506099  1
  Mg  Mg115  1  0.446548  0.899768  0.480972  1
  Mg  Mg116  1  0.779871  0.323014  0.506099  1
  Mg  Mg117  1  0.946548  0.399768  0.480972  1
  Mg  Mg118  1  0.613205  0.823014  0.506099  1
  Mg  Mg119  1  0.779881  0.899768  0.480972  1
  Mg  Mg120  1  0.946538  0.823014  0.506099  1
  Mg  Mg121  1  0.057851  0.957923  0.543661  1
  Mg  Mg122  1  0.224536  0.881279  0.568799  1
  Mg  Mg123  1  0.057869  0.381279  0.568799  1
  Mg  Mg124  1  0.391185  0.957923  0.543661  1
  Mg  Mg125  1  0.557869  0.881279  0.568799  1
  Mg  Mg126  1  0.224518  0.457923  0.543661  1
  Mg  Mg127  1  0.391202  0.381279  0.568799  1
  Mg  Mg128  1  0.724518  0.957923  0.543661  1
  Mg  Mg129  1  0.891202  0.881279  0.568799  1
  Mg  Mg130  1  0.557851  0.457923  0.543661  1
  Mg  Mg131  1  0.724536  0.381279  0.568799  1
  Mg  Mg132  1  0.891185  0.457923  0.543661  1
  Mg  Mg133  1  0.113124  0.169310  0.556242  1
  Mg  Mg134  1  0.279896  0.246173  0.531159  1
  Mg  Mg135  1  0.113230  0.746173  0.531159  1
  Mg  Mg136  1  0.446458  0.169310  0.556242  1
  Mg  Mg137  1  0.613230  0.246173  0.531159  1
  Mg  Mg138  1  0.279791  0.669310  0.556242  1
  Mg  Mg139  1  0.446563  0.746173  0.531159  1
  Mg  Mg140  1  0.779791  0.169310  0.556242  1
  Mg  Mg141  1  0.946563  0.246173  0.531159  1
  Mg  Mg142  1  0.613124  0.669310  0.556242  1
  Mg  Mg143  1  0.779896  0.746173  0.531159  1
  Mg  Mg144  1  0.946458  0.669310  0.556242  1
  Mg  Mg145  1  0.057724  0.804418  0.593715  1
  Mg  Mg146  1  0.224965  0.728164  0.618878  1
  Mg  Mg147  1  0.058298  0.228164  0.618878  1
  Mg  Mg148  1  0.391057  0.804418  0.593715  1
  Mg  Mg149  1  0.558298  0.728164  0.618878  1
  Mg  Mg150  1  0.224391  0.304418  0.593715  1
  Mg  Mg151  1  0.391631  0.228164  0.618878  1
  Mg  Mg152  1  0.724391  0.804418  0.593715  1
  Mg  Mg153  1  0.891631  0.728164  0.618878  1
  Mg  Mg154  1  0.557724  0.304418  0.593715  1
  Mg  Mg155  1  0.724965  0.228164  0.618878  1
  Mg  Mg156  1  0.891057  0.304418  0.593715  1
  Mg  Mg157  1  0.112962  0.015758  0.606479  1
  Mg  Mg158  1  0.279826  0.092596  0.581442  1
  Mg  Mg159  1  0.113160  0.592596  0.581442  1
  Mg  Mg160  1  0.446295  0.015758  0.606479  1
  Mg  Mg161  1  0.613160  0.092596  0.581442  1
  Mg  Mg162  1  0.279628  0.515758  0.606479  1
  Mg  Mg163  1  0.446493  0.592596  0.581442  1
  Mg  Mg164  1  0.779628  0.015758  0.606479  1
  Mg  Mg165  1  0.946493  0.092596  0.581442  1
  Mg  Mg166  1  0.612962  0.515758  0.606479  1
  Mg  Mg167  1  0.779826  0.592596  0.581442  1
  Mg  Mg168  1  0.946295  0.515758  0.606479  1
  Mg  Mg169  1  0.058562  0.651340  0.643791  1
  Mg  Mg170  1  0.224986  0.575458  0.668125  1
  Mg  Mg171  1  0.058319  0.075458  0.668125  1
  Mg  Mg172  1  0.391896  0.651340  0.643791  1
  Mg  Mg173  1  0.558319  0.575458  0.668125  1
  Mg  Mg174  1  0.225229  0.151340  0.643791  1
  Mg  Mg175  1  0.391653  0.075458  0.668125  1
  Mg  Mg176  1  0.725229  0.651340  0.643791  1
  Mg  Mg177  1  0.891653  0.575458  0.668125  1
  Mg  Mg178  1  0.558562  0.151340  0.643791  1
  Mg  Mg179  1  0.724986  0.075458  0.668125  1
  Mg  Mg180  1  0.891896  0.151340  0.643791  1
  Mg  Mg181  1  0.111892  0.861589  0.655904  1
  Mg  Mg182  1  0.279132  0.939116  0.631841  1
  Mg  Mg183  1  0.112465  0.439116  0.631841  1
  Mg  Mg184  1  0.445225  0.861589  0.655904  1
  Mg  Mg185  1  0.612465  0.939116  0.631841  1
  Mg  Mg186  1  0.278558  0.361589  0.655904  1
  Mg  Mg187  1  0.445799  0.439116  0.631841  1
  Mg  Mg188  1  0.778558  0.861589  0.655904  1
  Mg  Mg189  1  0.945799  0.939116  0.631841  1
  Mg  Mg190  1  0.611892  0.361589  0.655904  1
  Mg  Mg191  1  0.779132  0.439116  0.631841  1
  Mg  Mg192  1  0.945225  0.361589  0.655904  1
  Mg  Mg193  1  0.056058  0.497817  0.693359  1
  Mg  Mg194  1  0.223396  0.426433  0.716695  1
  Mg  Mg195  1  0.056730  0.926433  0.716695  1
  Mg  Mg196  1  0.389392  0.497817  0.693359  1
  Mg  Mg197  1  0.556730  0.426433  0.716695  1
  Mg  Mg198  1  0.222725  0.997817  0.693359  1
  Mg  Mg199  1  0.390063  0.926433  0.716695  1
  Mg  Mg200  1  0.722725  0.497817  0.693359  1
  Mg  Mg201  1  0.890063  0.426433  0.716695  1
  Mg  Mg202  1  0.556058  0.997817  0.693359  1
  Mg  Mg203  1  0.723396  0.926433  0.716695  1
  Mg  Mg204  1  0.889392  0.997817  0.693359  1
  Mg  Mg205  1  0.113584  0.708858  0.706366  1
  Mg  Mg206  1  0.278490  0.785150  0.681811  1
  Mg  Mg207  1  0.111824  0.285150  0.681811  1
  Mg  Mg208  1  0.446917  0.708858  0.706366  1
  Mg  Mg209  1  0.611824  0.785150  0.681811  1
  Mg  Mg210  1  0.280250  0.208858  0.706366  1
  Mg  Mg211  1  0.445157  0.285150  0.681811  1
  Mg  Mg212  1  0.780250  0.708858  0.706366  1
  Mg  Mg213  1  0.945157  0.785150  0.681811  1
  Mg  Mg214  1  0.613584  0.208858  0.706366  1
  Mg  Mg215  1  0.778490  0.285150  0.681811  1
  Mg  Mg216  1  0.946917  0.208858  0.706366  1
