# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.55307828
_cell_length_b   14.07825473
_cell_length_c   47.17600512
_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   10993.8232321
_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  0.058009  0.733561  0.293347  1
  Mg  Mg2  1  0.225287  0.657943  0.316769  1
  Mg  Mg3  1  0.058620  0.157943  0.316769  1
  Mg  Mg4  1  0.391342  0.733561  0.293347  1
  Mg  Mg5  1  0.558620  0.657943  0.316769  1
  Mg  Mg6  1  0.224675  0.233561  0.293347  1
  Mg  Mg7  1  0.391953  0.157943  0.316769  1
  Mg  Mg8  1  0.724675  0.733561  0.293347  1
  Mg  Mg9  1  0.891953  0.657943  0.316769  1
  Mg  Mg10  1  0.558009  0.233561  0.293347  1
  Mg  Mg11  1  0.725287  0.157943  0.316769  1
  Mg  Mg12  1  0.891342  0.233561  0.293347  1
  Mg  Mg13  1  0.113451  0.945349  0.304540  1
  Mg  Mg14  1  0.279504  0.022329  0.282351  1
  Mg  Mg15  1  0.112837  0.522329  0.282351  1
  Mg  Mg16  1  0.446784  0.945349  0.304540  1
  Mg  Mg17  1  0.612837  0.022329  0.282351  1
  Mg  Mg18  1  0.280117  0.445349  0.304540  1
  Mg  Mg19  1  0.446170  0.522329  0.282351  1
  Mg  Mg20  1  0.780117  0.945349  0.304540  1
  Mg  Mg21  1  0.946170  0.022329  0.282351  1
  Mg  Mg22  1  0.613451  0.445349  0.304540  1
  Mg  Mg23  1  0.779504  0.522329  0.282351  1
  Mg  Mg24  1  0.946784  0.445349  0.304540  1
  Mg  Mg25  1  0.057704  0.581190  0.342822  1
  Mg  Mg26  1  0.224115  0.504445  0.367012  1
  Mg  Mg27  1  0.057448  0.004445  0.367012  1
  Mg  Mg28  1  0.391037  0.581190  0.342822  1
  Mg  Mg29  1  0.557448  0.504445  0.367012  1
  Mg  Mg30  1  0.224371  0.081190  0.342822  1
  Mg  Mg31  1  0.390781  0.004445  0.367012  1
  Mg  Mg32  1  0.724371  0.581190  0.342822  1
  Mg  Mg33  1  0.890781  0.504445  0.367012  1
  Mg  Mg34  1  0.557704  0.081190  0.342822  1
  Mg  Mg35  1  0.724115  0.004445  0.367012  1
  Mg  Mg36  1  0.891037  0.081190  0.342822  1
  Mg  Mg37  1  0.112661  0.792652  0.354986  1
  Mg  Mg38  1  0.279112  0.868469  0.329798  1
  Mg  Mg39  1  0.112445  0.368469  0.329798  1
  Mg  Mg40  1  0.445995  0.792652  0.354986  1
  Mg  Mg41  1  0.612445  0.868469  0.329798  1
  Mg  Mg42  1  0.279328  0.292652  0.354986  1
  Mg  Mg43  1  0.445778  0.368469  0.329798  1
  Mg  Mg44  1  0.779328  0.792652  0.354986  1
  Mg  Mg45  1  0.945778  0.868469  0.329798  1
  Mg  Mg46  1  0.612661  0.292652  0.354986  1
  Mg  Mg47  1  0.779112  0.368469  0.329798  1
  Mg  Mg48  1  0.945995  0.292652  0.354986  1
  Mg  Mg49  1  0.057536  0.427837  0.392432  1
  Mg  Mg50  1  0.224058  0.351507  0.417444  1
  Mg  Mg51  1  0.057392  0.851507  0.417444  1
  Mg  Mg52  1  0.390869  0.427837  0.392432  1
  Mg  Mg53  1  0.557392  0.351507  0.417444  1
  Mg  Mg54  1  0.224202  0.927837  0.392432  1
  Mg  Mg55  1  0.390725  0.851507  0.417444  1
  Mg  Mg56  1  0.724202  0.427837  0.392432  1
  Mg  Mg57  1  0.890725  0.351507  0.417444  1
  Mg  Mg58  1  0.557536  0.927837  0.392432  1
  Mg  Mg59  1  0.724058  0.851507  0.417444  1
  Mg  Mg60  1  0.890869  0.927837  0.392432  1
  Mg  Mg61  1  0.112799  0.639632  0.405080  1
  Mg  Mg62  1  0.279175  0.716028  0.379843  1
  Mg  Mg63  1  0.112509  0.216028  0.379843  1
  Mg  Mg64  1  0.446133  0.639632  0.405080  1
  Mg  Mg65  1  0.612509  0.716028  0.379843  1
  Mg  Mg66  1  0.279466  0.139632  0.405080  1
  Mg  Mg67  1  0.445842  0.216028  0.379843  1
  Mg  Mg68  1  0.779466  0.639632  0.405080  1
  Mg  Mg69  1  0.945842  0.716028  0.379843  1
  Mg  Mg70  1  0.612799  0.139632  0.405080  1
  Mg  Mg71  1  0.779175  0.216028  0.379843  1
  Mg  Mg72  1  0.946133  0.139632  0.405080  1
  Mg  Mg73  1  0.057461  0.274919  0.442553  1
  Mg  Mg74  1  0.224032  0.198420  0.467624  1
  Mg  Mg75  1  0.057366  0.698420  0.467624  1
  Mg  Mg76  1  0.390795  0.274919  0.442553  1
  Mg  Mg77  1  0.557366  0.198420  0.467624  1
  Mg  Mg78  1  0.224128  0.774919  0.442553  1
  Mg  Mg79  1  0.390699  0.698420  0.467624  1
  Mg  Mg80  1  0.724128  0.274919  0.442553  1
  Mg  Mg81  1  0.890699  0.198420  0.467624  1
  Mg  Mg82  1  0.557461  0.774919  0.442553  1
  Mg  Mg83  1  0.724032  0.698420  0.467624  1
  Mg  Mg84  1  0.890795  0.774919  0.442553  1
  Mg  Mg85  1  0.112629  0.486611  0.455116  1
  Mg  Mg86  1  0.279333  0.563048  0.429930  1
  Mg  Mg87  1  0.112666  0.063048  0.429930  1
  Mg  Mg88  1  0.445962  0.486611  0.455116  1
  Mg  Mg89  1  0.612666  0.563048  0.429930  1
  Mg  Mg90  1  0.279296  0.986611  0.455116  1
  Mg  Mg91  1  0.446000  0.063048  0.429930  1
  Mg  Mg92  1  0.779296  0.486611  0.455116  1
  Mg  Mg93  1  0.946000  0.563048  0.429930  1
  Mg  Mg94  1  0.612629  0.986611  0.455116  1
  Mg  Mg95  1  0.779333  0.063048  0.429930  1
  Mg  Mg96  1  0.945962  0.986611  0.455116  1
  Mg  Mg97  1  0.057419  0.121881  0.492648  1
  Mg  Mg98  1  0.224065  0.045391  0.517767  1
  Mg  Mg99  1  0.057398  0.545391  0.517767  1
  Mg  Mg100  1  0.390752  0.121881  0.492648  1
  Mg  Mg101  1  0.557398  0.045391  0.517767  1
  Mg  Mg102  1  0.224086  0.621881  0.492648  1
  Mg  Mg103  1  0.390731  0.545391  0.517767  1
  Mg  Mg104  1  0.724086  0.121881  0.492648  1
  Mg  Mg105  1  0.890731  0.045391  0.517767  1
  Mg  Mg106  1  0.557419  0.621881  0.492648  1
  Mg  Mg107  1  0.724065  0.545391  0.517767  1
  Mg  Mg108  1  0.890752  0.621881  0.492648  1
  Mg  Mg109  1  0.112608  0.333644  0.505250  1
  Mg  Mg110  1  0.279295  0.410134  0.480131  1
  Mg  Mg111  1  0.112629  0.910134  0.480131  1
  Mg  Mg112  1  0.445941  0.333644  0.505250  1
  Mg  Mg113  1  0.612629  0.410134  0.480131  1
  Mg  Mg114  1  0.279274  0.833644  0.505250  1
  Mg  Mg115  1  0.445962  0.910134  0.480131  1
  Mg  Mg116  1  0.779274  0.333644  0.505250  1
  Mg  Mg117  1  0.945962  0.410134  0.480131  1
  Mg  Mg118  1  0.612608  0.833644  0.505250  1
  Mg  Mg119  1  0.779295  0.910134  0.480131  1
  Mg  Mg120  1  0.945941  0.833644  0.505250  1
  Mg  Mg121  1  0.057398  0.968914  0.542782  1
  Mg  Mg122  1  0.224027  0.892477  0.567968  1
  Mg  Mg123  1  0.057360  0.392477  0.567968  1
  Mg  Mg124  1  0.390731  0.968914  0.542782  1
  Mg  Mg125  1  0.557360  0.892477  0.567968  1
  Mg  Mg126  1  0.224064  0.468914  0.542782  1
  Mg  Mg127  1  0.390694  0.392477  0.567968  1
  Mg  Mg128  1  0.724064  0.968914  0.542782  1
  Mg  Mg129  1  0.890694  0.892477  0.567968  1
  Mg  Mg130  1  0.557398  0.468914  0.542782  1
  Mg  Mg131  1  0.724027  0.392477  0.567968  1
  Mg  Mg132  1  0.890731  0.468914  0.542782  1
  Mg  Mg133  1  0.112565  0.180606  0.555345  1
  Mg  Mg134  1  0.279328  0.257104  0.530274  1
  Mg  Mg135  1  0.112661  0.757104  0.530274  1
  Mg  Mg136  1  0.445899  0.180606  0.555345  1
  Mg  Mg137  1  0.612661  0.257104  0.530274  1
  Mg  Mg138  1  0.279232  0.680606  0.555345  1
  Mg  Mg139  1  0.445994  0.757104  0.530274  1
  Mg  Mg140  1  0.779232  0.180606  0.555345  1
  Mg  Mg141  1  0.945994  0.257104  0.530274  1
  Mg  Mg142  1  0.612565  0.680606  0.555345  1
  Mg  Mg143  1  0.779328  0.757104  0.530274  1
  Mg  Mg144  1  0.945899  0.680606  0.555345  1
  Mg  Mg145  1  0.057227  0.815892  0.592818  1
  Mg  Mg146  1  0.224185  0.739497  0.618055  1
  Mg  Mg147  1  0.057518  0.239497  0.618055  1
  Mg  Mg148  1  0.390561  0.815892  0.592818  1
  Mg  Mg149  1  0.557518  0.739497  0.618055  1
  Mg  Mg150  1  0.223894  0.315892  0.592818  1
  Mg  Mg151  1  0.390851  0.239497  0.618055  1
  Mg  Mg152  1  0.723894  0.815892  0.592818  1
  Mg  Mg153  1  0.890851  0.739497  0.618055  1
  Mg  Mg154  1  0.557227  0.315892  0.592818  1
  Mg  Mg155  1  0.724185  0.239497  0.618055  1
  Mg  Mg156  1  0.890561  0.315892  0.592818  1
  Mg  Mg157  1  0.112491  0.027687  0.605466  1
  Mg  Mg158  1  0.279301  0.104018  0.580454  1
  Mg  Mg159  1  0.112635  0.604018  0.580454  1
  Mg  Mg160  1  0.445824  0.027687  0.605466  1
  Mg  Mg161  1  0.612635  0.104018  0.580454  1
  Mg  Mg162  1  0.279158  0.527687  0.605466  1
  Mg  Mg163  1  0.445968  0.604018  0.580454  1
  Mg  Mg164  1  0.779158  0.027687  0.605466  1
  Mg  Mg165  1  0.945968  0.104018  0.580454  1
  Mg  Mg166  1  0.612491  0.527687  0.605466  1
  Mg  Mg167  1  0.779301  0.604018  0.580454  1
  Mg  Mg168  1  0.945824  0.527687  0.605466  1
  Mg  Mg169  1  0.057365  0.662873  0.642912  1
  Mg  Mg170  1  0.224248  0.587056  0.668100  1
  Mg  Mg171  1  0.057581  0.087056  0.668100  1
  Mg  Mg172  1  0.390698  0.662873  0.642912  1
  Mg  Mg173  1  0.557581  0.587056  0.668100  1
  Mg  Mg174  1  0.224032  0.162873  0.642912  1
  Mg  Mg175  1  0.390915  0.087056  0.668100  1
  Mg  Mg176  1  0.724032  0.662873  0.642912  1
  Mg  Mg177  1  0.890915  0.587056  0.668100  1
  Mg  Mg178  1  0.557365  0.162873  0.642912  1
  Mg  Mg179  1  0.724248  0.087056  0.668100  1
  Mg  Mg180  1  0.890698  0.162873  0.642912  1
  Mg  Mg181  1  0.112323  0.874335  0.655076  1
  Mg  Mg182  1  0.279245  0.951080  0.630886  1
  Mg  Mg183  1  0.112578  0.451080  0.630886  1
  Mg  Mg184  1  0.445656  0.874335  0.655076  1
  Mg  Mg185  1  0.612578  0.951080  0.630886  1
  Mg  Mg186  1  0.278989  0.374335  0.655076  1
  Mg  Mg187  1  0.445912  0.451080  0.630886  1
  Mg  Mg188  1  0.778989  0.874335  0.655076  1
  Mg  Mg189  1  0.945912  0.951080  0.630886  1
  Mg  Mg190  1  0.612323  0.374335  0.655076  1
  Mg  Mg191  1  0.779245  0.451080  0.630886  1
  Mg  Mg192  1  0.945656  0.374335  0.655076  1
  Mg  Mg193  1  0.056576  0.510176  0.693358  1
  Mg  Mg194  1  0.223856  0.433195  0.715547  1
  Mg  Mg195  1  0.057189  0.933195  0.715547  1
  Mg  Mg196  1  0.389909  0.510176  0.693358  1
  Mg  Mg197  1  0.557189  0.433195  0.715547  1
  Mg  Mg198  1  0.223243  0.010176  0.693358  1
  Mg  Mg199  1  0.390523  0.933195  0.715547  1
  Mg  Mg200  1  0.723243  0.510176  0.693358  1
  Mg  Mg201  1  0.890523  0.433195  0.715547  1
  Mg  Mg202  1  0.556576  0.010176  0.693358  1
  Mg  Mg203  1  0.723856  0.933195  0.715547  1
  Mg  Mg204  1  0.889909  0.010176  0.693358  1
  Mg  Mg205  1  0.112018  0.721964  0.704551  1
  Mg  Mg206  1  0.278073  0.797582  0.681129  1
  Mg  Mg207  1  0.111407  0.297582  0.681129  1
  Mg  Mg208  1  0.445351  0.721964  0.704551  1
  Mg  Mg209  1  0.611407  0.797582  0.681129  1
  Mg  Mg210  1  0.278684  0.221964  0.704551  1
  Mg  Mg211  1  0.444740  0.297582  0.681129  1
  Mg  Mg212  1  0.778684  0.721964  0.704551  1
  Mg  Mg213  1  0.944740  0.797582  0.681129  1
  Mg  Mg214  1  0.612018  0.221964  0.704551  1
  Mg  Mg215  1  0.778073  0.297582  0.681129  1
  Mg  Mg216  1  0.945351  0.221964  0.704551  1
