# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.02170077
_cell_length_b   16.76604073
_cell_length_c   46.64221832
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   70.84013300
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg156
_cell_volume   8141.59055006
_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  0.425120  0.730246  0.313148  1
  Mg  Mg2  1  0.925120  0.730246  0.313148  1
  Mg  Mg3  1  0.507963  0.070342  0.302702  1
  Mg  Mg4  1  0.583564  0.413302  0.291760  1
  Mg  Mg5  1  0.007963  0.070342  0.302702  1
  Mg  Mg6  1  0.083564  0.413302  0.291760  1
  Mg  Mg7  1  0.672902  0.570380  0.302703  1
  Mg  Mg8  1  0.172902  0.570380  0.302703  1
  Mg  Mg9  1  0.754299  0.913269  0.291765  1
  Mg  Mg10  1  0.595841  0.230258  0.313150  1
  Mg  Mg11  1  0.254299  0.913269  0.291765  1
  Mg  Mg12  1  0.095841  0.230258  0.313150  1
  Mg  Mg13  1  0.185977  0.710329  0.345923  1
  Mg  Mg14  1  0.685977  0.710329  0.345923  1
  Mg  Mg15  1  0.268067  0.049955  0.335187  1
  Mg  Mg16  1  0.345837  0.389626  0.323715  1
  Mg  Mg17  1  0.768067  0.049955  0.335187  1
  Mg  Mg18  1  0.845837  0.389626  0.323715  1
  Mg  Mg19  1  0.433171  0.549952  0.335188  1
  Mg  Mg20  1  0.933171  0.549952  0.335188  1
  Mg  Mg21  1  0.515689  0.889624  0.323726  1
  Mg  Mg22  1  0.354903  0.210318  0.345919  1
  Mg  Mg23  1  0.015689  0.889624  0.323726  1
  Mg  Mg24  1  0.854903  0.210318  0.345919  1
  Mg  Mg25  1  0.946746  0.689904  0.379059  1
  Mg  Mg26  1  0.446746  0.689904  0.379059  1
  Mg  Mg27  1  0.028091  0.029574  0.368005  1
  Mg  Mg28  1  0.105947  0.370059  0.357051  1
  Mg  Mg29  1  0.528091  0.029574  0.368005  1
  Mg  Mg30  1  0.605947  0.370059  0.357051  1
  Mg  Mg31  1  0.193515  0.529575  0.368003  1
  Mg  Mg32  1  0.693515  0.529575  0.368003  1
  Mg  Mg33  1  0.275164  0.870052  0.357054  1
  Mg  Mg34  1  0.114534  0.189903  0.379059  1
  Mg  Mg35  1  0.775164  0.870052  0.357054  1
  Mg  Mg36  1  0.614534  0.189903  0.379059  1
  Mg  Mg37  1  0.706900  0.669738  0.412376  1
  Mg  Mg38  1  0.206900  0.669738  0.412376  1
  Mg  Mg39  1  0.787853  0.009816  0.401383  1
  Mg  Mg40  1  0.866638  0.349932  0.390119  1
  Mg  Mg41  1  0.287853  0.009816  0.401383  1
  Mg  Mg42  1  0.366638  0.349932  0.390119  1
  Mg  Mg43  1  0.953498  0.509816  0.401383  1
  Mg  Mg44  1  0.453498  0.509816  0.401383  1
  Mg  Mg45  1  0.034590  0.849930  0.390125  1
  Mg  Mg46  1  0.874531  0.169739  0.412376  1
  Mg  Mg47  1  0.534590  0.849930  0.390125  1
  Mg  Mg48  1  0.374531  0.169739  0.412376  1
  Mg  Mg49  1  0.467121  0.649599  0.445938  1
  Mg  Mg50  1  0.967121  0.649599  0.445938  1
  Mg  Mg51  1  0.547777  0.989621  0.434828  1
  Mg  Mg52  1  0.626980  0.329642  0.423682  1
  Mg  Mg53  1  0.047777  0.989621  0.434828  1
  Mg  Mg54  1  0.126980  0.329642  0.423682  1
  Mg  Mg55  1  0.713758  0.489620  0.434827  1
  Mg  Mg56  1  0.213758  0.489620  0.434827  1
  Mg  Mg57  1  0.794531  0.829641  0.423685  1
  Mg  Mg58  1  0.634437  0.149598  0.445939  1
  Mg  Mg59  1  0.294531  0.829641  0.423685  1
  Mg  Mg60  1  0.134437  0.149598  0.445939  1
  Mg  Mg61  1  0.227187  0.629553  0.479430  1
  Mg  Mg62  1  0.727187  0.629553  0.479430  1
  Mg  Mg63  1  0.307762  0.969537  0.468307  1
  Mg  Mg64  1  0.387132  0.309549  0.457096  1
  Mg  Mg65  1  0.807762  0.969537  0.468307  1
  Mg  Mg66  1  0.887132  0.309549  0.457096  1
  Mg  Mg67  1  0.473845  0.469537  0.468307  1
  Mg  Mg68  1  0.973845  0.469537  0.468307  1
  Mg  Mg69  1  0.554463  0.809547  0.457099  1
  Mg  Mg70  1  0.394404  0.129552  0.479431  1
  Mg  Mg71  1  0.054463  0.809547  0.457099  1
  Mg  Mg72  1  0.894404  0.129552  0.479431  1
  Mg  Mg73  1  0.987215  0.609503  0.512922  1
  Mg  Mg74  1  0.487215  0.609503  0.512922  1
  Mg  Mg75  1  0.067725  0.949501  0.501779  1
  Mg  Mg76  1  0.147218  0.289499  0.490633  1
  Mg  Mg77  1  0.567725  0.949501  0.501779  1
  Mg  Mg78  1  0.647218  0.289499  0.490633  1
  Mg  Mg79  1  0.233908  0.449500  0.501778  1
  Mg  Mg80  1  0.733908  0.449500  0.501778  1
  Mg  Mg81  1  0.314418  0.789498  0.490635  1
  Mg  Mg82  1  0.154415  0.109502  0.512925  1
  Mg  Mg83  1  0.814418  0.789498  0.490635  1
  Mg  Mg84  1  0.654415  0.109502  0.512925  1
  Mg  Mg85  1  0.747169  0.589453  0.546458  1
  Mg  Mg86  1  0.247169  0.589453  0.546458  1
  Mg  Mg87  1  0.827788  0.929464  0.535250  1
  Mg  Mg88  1  0.907229  0.269448  0.524126  1
  Mg  Mg89  1  0.327788  0.929464  0.535250  1
  Mg  Mg90  1  0.407229  0.269448  0.524126  1
  Mg  Mg91  1  0.993871  0.429464  0.535250  1
  Mg  Mg92  1  0.493871  0.429464  0.535250  1
  Mg  Mg93  1  0.074445  0.769448  0.524128  1
  Mg  Mg94  1  0.914501  0.089452  0.546461  1
  Mg  Mg95  1  0.574445  0.769448  0.524128  1
  Mg  Mg96  1  0.414501  0.089452  0.546461  1
  Mg  Mg97  1  0.507102  0.569360  0.579872  1
  Mg  Mg98  1  0.007102  0.569360  0.579872  1
  Mg  Mg99  1  0.587875  0.909381  0.568731  1
  Mg  Mg100  1  0.667196  0.249403  0.557618  1
  Mg  Mg101  1  0.087875  0.909381  0.568731  1
  Mg  Mg102  1  0.167196  0.249403  0.557618  1
  Mg  Mg103  1  0.753856  0.409380  0.568730  1
  Mg  Mg104  1  0.253856  0.409380  0.568730  1
  Mg  Mg105  1  0.834512  0.749402  0.557619  1
  Mg  Mg106  1  0.674652  0.069358  0.579876  1
  Mg  Mg107  1  0.334512  0.749402  0.557619  1
  Mg  Mg108  1  0.174652  0.069358  0.579876  1
  Mg  Mg109  1  0.267042  0.549071  0.613432  1
  Mg  Mg110  1  0.767042  0.549071  0.613432  1
  Mg  Mg111  1  0.348135  0.889185  0.602174  1
  Mg  Mg112  1  0.427102  0.229262  0.591181  1
  Mg  Mg113  1  0.848135  0.889185  0.602174  1
  Mg  Mg114  1  0.927102  0.229262  0.591181  1
  Mg  Mg115  1  0.513780  0.389185  0.602174  1
  Mg  Mg116  1  0.013780  0.389185  0.602174  1
  Mg  Mg117  1  0.594733  0.729263  0.591181  1
  Mg  Mg118  1  0.434995  0.049069  0.613439  1
  Mg  Mg119  1  0.094733  0.729263  0.591181  1
  Mg  Mg120  1  0.934995  0.049069  0.613439  1
  Mg  Mg121  1  0.026469  0.528948  0.646503  1
  Mg  Mg122  1  0.526469  0.528948  0.646503  1
  Mg  Mg123  1  0.108117  0.869426  0.635555  1
  Mg  Mg124  1  0.187098  0.209098  0.624498  1
  Mg  Mg125  1  0.608117  0.869426  0.635555  1
  Mg  Mg126  1  0.687098  0.209098  0.624498  1
  Mg  Mg127  1  0.273542  0.369426  0.635553  1
  Mg  Mg128  1  0.773542  0.369426  0.635553  1
  Mg  Mg129  1  0.354886  0.709097  0.624498  1
  Mg  Mg130  1  0.195685  0.028942  0.646507  1
  Mg  Mg131  1  0.854886  0.709097  0.624498  1
  Mg  Mg132  1  0.695685  0.028942  0.646507  1
  Mg  Mg133  1  0.785944  0.509377  0.679831  1
  Mg  Mg134  1  0.285944  0.509377  0.679831  1
  Mg  Mg135  1  0.868462  0.849049  0.668369  1
  Mg  Mg136  1  0.946729  0.188683  0.657638  1
  Mg  Mg137  1  0.368462  0.849049  0.668369  1
  Mg  Mg138  1  0.446729  0.188683  0.657638  1
  Mg  Mg139  1  0.033566  0.349046  0.668370  1
  Mg  Mg140  1  0.533566  0.349046  0.668370  1
  Mg  Mg141  1  0.115655  0.688672  0.657634  1
  Mg  Mg142  1  0.955795  0.009375  0.679843  1
  Mg  Mg143  1  0.615655  0.688672  0.657634  1
  Mg  Mg144  1  0.455795  0.009375  0.679843  1
  Mg  Mg145  1  0.547334  0.485732  0.711793  1
  Mg  Mg146  1  0.047334  0.485732  0.711793  1
  Mg  Mg147  1  0.628731  0.828621  0.700855  1
  Mg  Mg148  1  0.705792  0.168743  0.690407  1
  Mg  Mg149  1  0.128731  0.828621  0.700855  1
  Mg  Mg150  1  0.205792  0.168743  0.690407  1
  Mg  Mg151  1  0.793669  0.328659  0.700855  1
  Mg  Mg152  1  0.293669  0.328659  0.700855  1
  Mg  Mg153  1  0.876512  0.668755  0.690410  1
  Mg  Mg154  1  0.718068  0.985699  0.711797  1
  Mg  Mg155  1  0.376512  0.668755  0.690410  1
  Mg  Mg156  1  0.218068  0.985699  0.711797  1
