# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.82760900
_cell_length_b   12.82623672
_cell_length_c   46.40195332
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.07978686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg144
_cell_volume   7264.12971264
_cell_formula_units_Z   144
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  0.628988  0.955250  0.333763  1
  Mg  Mg2  1  0.954904  0.629347  0.333763  1
  Mg  Mg3  1  0.006972  0.007340  0.317542  1
  Mg  Mg4  1  0.373809  0.046915  0.298104  1
  Mg  Mg5  1  0.711735  0.712104  0.301792  1
  Mg  Mg6  1  0.046530  0.374172  0.298101  1
  Mg  Mg7  1  0.414167  0.414546  0.283726  1
  Mg  Mg8  1  0.341630  0.659549  0.315690  1
  Mg  Mg9  1  0.659181  0.342016  0.315694  1
  Mg  Mg10  1  0.889720  0.231661  0.291182  1
  Mg  Mg11  1  0.231287  0.890115  0.291182  1
  Mg  Mg12  1  0.149539  0.149891  0.325149  1
  Mg  Mg13  1  0.530604  0.183279  0.307945  1
  Mg  Mg14  1  0.861574  0.861953  0.308180  1
  Mg  Mg15  1  0.182913  0.530951  0.307947  1
  Mg  Mg16  1  0.564879  0.565277  0.288304  1
  Mg  Mg17  1  0.475053  0.815970  0.323123  1
  Mg  Mg18  1  0.815623  0.475414  0.323127  1
  Mg  Mg19  1  0.509904  0.848249  0.388063  1
  Mg  Mg20  1  0.847940  0.510223  0.388066  1
  Mg  Mg21  1  0.888203  0.888540  0.371449  1
  Mg  Mg22  1  0.258018  0.926075  0.353859  1
  Mg  Mg23  1  0.594458  0.594796  0.351923  1
  Mg  Mg24  1  0.925734  0.258352  0.353857  1
  Mg  Mg25  1  0.299027  0.299364  0.331257  1
  Mg  Mg26  1  0.216849  0.554820  0.371278  1
  Mg  Mg27  1  0.554487  0.217187  0.371277  1
  Mg  Mg28  1  0.775901  0.111154  0.340797  1
  Mg  Mg29  1  0.110806  0.776256  0.340799  1
  Mg  Mg30  1  0.033892  0.034212  0.380962  1
  Mg  Mg31  1  0.404859  0.075237  0.361330  1
  Mg  Mg32  1  0.740656  0.740987  0.364678  1
  Mg  Mg33  1  0.074903  0.405190  0.361327  1
  Mg  Mg34  1  0.444911  0.445270  0.346367  1
  Mg  Mg35  1  0.367313  0.697397  0.379370  1
  Mg  Mg36  1  0.697081  0.367637  0.379373  1
  Mg  Mg37  1  0.396491  0.727302  0.444596  1
  Mg  Mg38  1  0.727019  0.396780  0.444599  1
  Mg  Mg39  1  0.770580  0.770883  0.428627  1
  Mg  Mg40  1  0.141112  0.806548  0.406813  1
  Mg  Mg41  1  0.475906  0.476218  0.409972  1
  Mg  Mg42  1  0.806242  0.141411  0.406812  1
  Mg  Mg43  1  0.180543  0.180863  0.389440  1
  Mg  Mg44  1  0.102319  0.435484  0.426357  1
  Mg  Mg45  1  0.435187  0.102622  0.426358  1
  Mg  Mg46  1  0.660742  0.991395  0.398067  1
  Mg  Mg47  1  0.991080  0.661064  0.398069  1
  Mg  Mg48  1  0.917536  0.917825  0.436206  1
  Mg  Mg49  1  0.287829  0.955062  0.418234  1
  Mg  Mg50  1  0.624084  0.624384  0.417244  1
  Mg  Mg51  1  0.954755  0.288129  0.418233  1
  Mg  Mg52  1  0.328252  0.328568  0.397678  1
  Mg  Mg53  1  0.247537  0.583051  0.436157  1
  Mg  Mg54  1  0.582763  0.247832  0.436156  1
  Mg  Mg55  1  0.277505  0.611326  0.501241  1
  Mg  Mg56  1  0.611071  0.277767  0.501242  1
  Mg  Mg57  1  0.652540  0.652808  0.482862  1
  Mg  Mg58  1  0.021195  0.690372  0.463271  1
  Mg  Mg59  1  0.357582  0.357858  0.463815  1
  Mg  Mg60  1  0.690094  0.021468  0.463269  1
  Mg  Mg61  1  0.063486  0.063773  0.446015  1
  Mg  Mg62  1  0.984505  0.317141  0.483020  1
  Mg  Mg63  1  0.316873  0.984778  0.483022  1
  Mg  Mg64  1  0.540819  0.876389  0.453894  1
  Mg  Mg65  1  0.876109  0.541106  0.453895  1
  Mg  Mg66  1  0.799327  0.799591  0.493325  1
  Mg  Mg67  1  0.170820  0.836084  0.472695  1
  Mg  Mg68  1  0.504964  0.505240  0.474453  1
  Mg  Mg69  1  0.835812  0.171086  0.472695  1
  Mg  Mg70  1  0.210277  0.210562  0.454492  1
  Mg  Mg71  1  0.130869  0.465044  0.491563  1
  Mg  Mg72  1  0.464788  0.131130  0.491563  1
  Mg  Mg73  1  0.159197  0.495026  0.556797  1
  Mg  Mg74  1  0.494803  0.159426  0.556796  1
  Mg  Mg75  1  0.534439  0.534680  0.539208  1
  Mg  Mg76  1  0.905069  0.570750  0.519375  1
  Mg  Mg77  1  0.239496  0.239740  0.519358  1
  Mg  Mg78  1  0.570501  0.905311  0.519374  1
  Mg  Mg79  1  0.946334  0.946589  0.501177  1
  Mg  Mg80  1  0.864891  0.200620  0.538449  1
  Mg  Mg81  1  0.200387  0.865131  0.538448  1
  Mg  Mg82  1  0.424872  0.757409  0.509668  1
  Mg  Mg83  1  0.757160  0.425126  0.509672  1
  Mg  Mg84  1  0.681854  0.682083  0.548494  1
  Mg  Mg85  1  0.050733  0.719644  0.528219  1
  Mg  Mg86  1  0.386717  0.386962  0.529763  1
  Mg  Mg87  1  0.719401  0.050971  0.528217  1
  Mg  Mg88  1  0.092442  0.092697  0.511277  1
  Mg  Mg89  1  0.014178  0.346040  0.548093  1
  Mg  Mg90  1  0.345812  0.014412  0.548096  1
  Mg  Mg91  1  0.045412  0.374186  0.613404  1
  Mg  Mg92  1  0.373991  0.045614  0.613407  1
  Mg  Mg93  1  0.416120  0.416330  0.595815  1
  Mg  Mg94  1  0.786425  0.453569  0.574508  1
  Mg  Mg95  1  0.121565  0.121783  0.576677  1
  Mg  Mg96  1  0.453354  0.786633  0.574505  1
  Mg  Mg97  1  0.828662  0.828894  0.558427  1
  Mg  Mg98  1  0.748613  0.080100  0.592893  1
  Mg  Mg99  1  0.079898  0.748818  0.592896  1
  Mg  Mg100  1  0.307377  0.639410  0.566375  1
  Mg  Mg101  1  0.639189  0.307603  0.566376  1
  Mg  Mg102  1  0.563969  0.564171  0.604285  1
  Mg  Mg103  1  0.933629  0.599647  0.584746  1
  Mg  Mg104  1  0.269044  0.269253  0.583896  1
  Mg  Mg105  1  0.599429  0.933841  0.584745  1
  Mg  Mg106  1  0.975603  0.975821  0.566144  1
  Mg  Mg107  1  0.893973  0.230754  0.604342  1
  Mg  Mg108  1  0.230561  0.894173  0.604342  1
  Mg  Mg109  1  0.919681  0.263914  0.670453  1
  Mg  Mg110  1  0.263751  0.919853  0.670453  1
  Mg  Mg111  1  0.298358  0.298527  0.648016  1
  Mg  Mg112  1  0.667802  0.337796  0.631436  1
  Mg  Mg113  1  0.005364  0.005542  0.630909  1
  Mg  Mg114  1  0.337609  0.667977  0.631435  1
  Mg  Mg115  1  0.711305  0.711506  0.614497  1
  Mg  Mg116  1  0.628282  0.963600  0.649760  1
  Mg  Mg117  1  0.963433  0.628462  0.649759  1
  Mg  Mg118  1  0.188444  0.525015  0.622067  1
  Mg  Mg119  1  0.524831  0.188636  0.622066  1
  Mg  Mg120  1  0.445914  0.446076  0.662045  1
  Mg  Mg121  1  0.817645  0.481700  0.638739  1
  Mg  Mg122  1  0.150077  0.150263  0.642247  1
  Mg  Mg123  1  0.481511  0.817819  0.638735  1
  Mg  Mg124  1  0.858315  0.858510  0.623955  1
  Mg  Mg125  1  0.779347  0.109396  0.656899  1
  Mg  Mg126  1  0.109239  0.779512  0.656902  1
  Mg  Mg127  1  0.809106  0.141816  0.719502  1
  Mg  Mg128  1  0.141680  0.809243  0.719505  1
  Mg  Mg129  1  0.181183  0.181330  0.705639  1
  Mg  Mg130  1  0.561095  0.210955  0.686079  1
  Mg  Mg131  1  0.893814  0.893963  0.688310  1
  Mg  Mg132  1  0.210812  0.561236  0.686081  1
  Mg  Mg133  1  0.599846  0.600016  0.668240  1
  Mg  Mg134  1  0.508873  0.845736  0.701827  1
  Mg  Mg135  1  0.845598  0.509007  0.701832  1
  Mg  Mg136  1  0.077861  0.405109  0.677935  1
  Mg  Mg137  1  0.404950  0.078027  0.677939  1
  Mg  Mg138  1  0.330943  0.331065  0.710343  1
  Mg  Mg139  1  0.687647  0.371107  0.694934  1
  Mg  Mg140  1  0.037212  0.037361  0.693841  1
  Mg  Mg141  1  0.370950  0.687801  0.694932  1
  Mg  Mg142  1  0.746510  0.746656  0.679633  1
  Mg  Mg143  1  0.663532  0.987224  0.713109  1
  Mg  Mg144  1  0.987092  0.663664  0.713109  1
