# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.83503692
_cell_length_b   12.82935178
_cell_length_c   46.48555062
_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   7283.19903311
_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  0.616690  0.950756  0.335972  1
  Mg  Mg2  1  0.076098  0.741203  0.284828  1
  Mg  Mg3  1  0.006813  0.990074  0.318742  1
  Mg  Mg4  1  0.372325  0.042789  0.302184  1
  Mg  Mg5  1  0.708554  0.706555  0.302210  1
  Mg  Mg6  1  0.034494  0.368634  0.297876  1
  Mg  Mg7  1  0.406991  0.410323  0.284849  1
  Mg  Mg8  1  0.322463  0.656642  0.316131  1
  Mg  Mg9  1  0.655816  0.341036  0.318763  1
  Mg  Mg10  1  0.884206  0.218576  0.293306  1
  Mg  Mg11  1  0.230855  0.887887  0.290965  1
  Mg  Mg12  1  0.139996  0.146267  0.326868  1
  Mg  Mg13  1  0.530283  0.180110  0.309238  1
  Mg  Mg14  1  0.845996  0.864413  0.309250  1
  Mg  Mg15  1  0.178253  0.512424  0.310818  1
  Mg  Mg16  1  0.553646  0.565112  0.290963  1
  Mg  Mg17  1  0.470005  0.804193  0.324723  1
  Mg  Mg18  1  0.812134  0.474080  0.326834  1
  Mg  Mg19  1  0.503894  0.837832  0.390032  1
  Mg  Mg20  1  0.952142  0.631888  0.334310  1
  Mg  Mg21  1  0.878400  0.883316  0.373277  1
  Mg  Mg22  1  0.252809  0.921445  0.354975  1
  Mg  Mg23  1  0.587428  0.586902  0.354970  1
  Mg  Mg24  1  0.917048  0.251161  0.356311  1
  Mg  Mg25  1  0.297833  0.286254  0.334305  1
  Mg  Mg26  1  0.209864  0.543945  0.374055  1
  Mg  Mg27  1  0.549241  0.212405  0.373266  1
  Mg  Mg28  1  0.769945  0.104072  0.342104  1
  Mg  Mg29  1  0.107250  0.770523  0.348101  1
  Mg  Mg30  1  0.028338  0.025452  0.382982  1
  Mg  Mg31  1  0.398985  0.068197  0.365970  1
  Mg  Mg32  1  0.734211  0.733055  0.365993  1
  Mg  Mg33  1  0.065497  0.399467  0.361787  1
  Mg  Mg34  1  0.436390  0.441417  0.348125  1
  Mg  Mg35  1  0.356923  0.690878  0.380612  1
  Mg  Mg36  1  0.691407  0.362321  0.382992  1
  Mg  Mg37  1  0.386864  0.720651  0.445786  1
  Mg  Mg38  1  0.842715  0.505000  0.391467  1
  Mg  Mg39  1  0.762746  0.763935  0.430195  1
  Mg  Mg40  1  0.136653  0.801247  0.411953  1
  Mg  Mg41  1  0.467318  0.470612  0.411976  1
  Mg  Mg42  1  0.799244  0.133136  0.408324  1
  Mg  Mg43  1  0.171083  0.176684  0.391496  1
  Mg  Mg44  1  0.094079  0.427935  0.427229  1
  Mg  Mg45  1  0.430004  0.096631  0.430171  1
  Mg  Mg46  1  0.651218  0.985159  0.400079  1
  Mg  Mg47  1  0.985157  0.657078  0.400389  1
  Mg  Mg48  1  0.908906  0.911384  0.438198  1
  Mg  Mg49  1  0.282620  0.950777  0.419868  1
  Mg  Mg50  1  0.616928  0.616517  0.419870  1
  Mg  Mg51  1  0.946293  0.280207  0.420397  1
  Mg  Mg52  1  0.323128  0.319162  0.400382  1
  Mg  Mg53  1  0.239818  0.573706  0.438556  1
  Mg  Mg54  1  0.577523  0.242723  0.438188  1
  Mg  Mg55  1  0.269134  0.602850  0.503272  1
  Mg  Mg56  1  0.721518  0.391252  0.448048  1
  Mg  Mg57  1  0.646173  0.644954  0.485100  1
  Mg  Mg58  1  0.015626  0.685804  0.466173  1
  Mg  Mg59  1  0.352040  0.349449  0.466169  1
  Mg  Mg60  1  0.680992  0.014746  0.464907  1
  Mg  Mg61  1  0.057441  0.055380  0.448047  1
  Mg  Mg62  1  0.975922  0.309673  0.484789  1
  Mg  Mg63  1  0.311181  0.979884  0.485096  1
  Mg  Mg64  1  0.533516  0.867338  0.455857  1
  Mg  Mg65  1  0.871062  0.535928  0.456557  1
  Mg  Mg66  1  0.791285  0.793297  0.494881  1
  Mg  Mg67  1  0.166119  0.830396  0.476417  1
  Mg  Mg68  1  0.496651  0.499908  0.476439  1
  Mg  Mg69  1  0.828757  0.162502  0.474336  1
  Mg  Mg70  1  0.202146  0.204894  0.456578  1
  Mg  Mg71  1  0.123179  0.456863  0.492565  1
  Mg  Mg72  1  0.459546  0.124984  0.494855  1
  Mg  Mg73  1  0.152084  0.485645  0.557738  1
  Mg  Mg74  1  0.605434  0.272762  0.503157  1
  Mg  Mg75  1  0.526089  0.529507  0.541176  1
  Mg  Mg76  1  0.899988  0.565674  0.521473  1
  Mg  Mg77  1  0.232070  0.233641  0.521486  1
  Mg  Mg78  1  0.562884  0.896533  0.521343  1
  Mg  Mg79  1  0.939103  0.939145  0.503161  1
  Mg  Mg80  1  0.857880  0.191483  0.540258  1
  Mg  Mg81  1  0.195888  0.859660  0.541157  1
  Mg  Mg82  1  0.416305  0.749942  0.510645  1
  Mg  Mg83  1  0.751733  0.419366  0.513132  1
  Mg  Mg84  1  0.676029  0.673770  0.550458  1
  Mg  Mg85  1  0.045513  0.714690  0.531850  1
  Mg  Mg86  1  0.381065  0.379191  0.531852  1
  Mg  Mg87  1  0.710580  0.044174  0.529440  1
  Mg  Mg88  1  0.085705  0.085442  0.513142  1
  Mg  Mg89  1  0.005179  0.338730  0.549428  1
  Mg  Mg90  1  0.340160  0.009571  0.550449  1
  Mg  Mg91  1  0.034678  0.368096  0.614197  1
  Mg  Mg92  1  0.489802  0.153286  0.559716  1
  Mg  Mg93  1  0.410591  0.409105  0.597649  1
  Mg  Mg94  1  0.781605  0.447627  0.578217  1
  Mg  Mg95  1  0.114151  0.115128  0.578239  1
  Mg  Mg96  1  0.445227  0.778697  0.575158  1
  Mg  Mg97  1  0.819738  0.823407  0.559745  1
  Mg  Mg98  1  0.739846  0.073247  0.593674  1
  Mg  Mg99  1  0.075599  0.744044  0.597640  1
  Mg  Mg100  1  0.298009  0.631540  0.568004  1
  Mg  Mg101  1  0.633497  0.302887  0.568083  1
  Mg  Mg102  1  0.555624  0.559677  0.606126  1
  Mg  Mg103  1  0.928981  0.595558  0.586148  1
  Mg  Mg104  1  0.262087  0.262511  0.586155  1
  Mg  Mg105  1  0.591518  0.925037  0.586753  1
  Mg  Mg106  1  0.969399  0.967044  0.568080  1
  Mg  Mg107  1  0.887089  0.220528  0.606306  1
  Mg  Mg108  1  0.226251  0.888990  0.606112  1
  Mg  Mg109  1  0.915892  0.249308  0.672687  1
  Mg  Mg110  1  0.368663  0.040281  0.616107  1
  Mg  Mg111  1  0.291621  0.291910  0.650474  1
  Mg  Mg112  1  0.661553  0.333662  0.632851  1
  Mg  Mg113  1  0.000371  0.994914  0.632842  1
  Mg  Mg114  1  0.327269  0.660574  0.632574  1
  Mg  Mg115  1  0.706849  0.702177  0.616123  1
  Mg  Mg116  1  0.621149  0.954456  0.651880  1
  Mg  Mg117  1  0.958578  0.624871  0.650473  1
  Mg  Mg118  1  0.181436  0.514823  0.622664  1
  Mg  Mg119  1  0.520030  0.182273  0.624637  1
  Mg  Mg120  1  0.440473  0.439158  0.663667  1
  Mg  Mg121  1  0.811909  0.475261  0.643158  1
  Mg  Mg122  1  0.141888  0.145328  0.643194  1
  Mg  Mg123  1  0.475101  0.808484  0.639070  1
  Mg  Mg124  1  0.848931  0.853436  0.624669  1
  Mg  Mg125  1  0.770603  0.103791  0.657168  1
  Mg  Mg126  1  0.105879  0.773708  0.663651  1
  Mg  Mg127  1  0.800842  0.134013  0.720474  1
  Mg  Mg128  1  0.261437  0.919511  0.670513  1
  Mg  Mg129  1  0.169385  0.175316  0.707064  1
  Mg  Mg130  1  0.556574  0.207547  0.688526  1
  Mg  Mg131  1  0.874485  0.889754  0.688557  1
  Mg  Mg132  1  0.207591  0.540779  0.686433  1
  Mg  Mg133  1  0.586269  0.594757  0.670519  1
  Mg  Mg134  1  0.502460  0.835670  0.702675  1
  Mg  Mg135  1  0.842155  0.502423  0.707026  1
  Mg  Mg136  1  0.064788  0.397946  0.678504  1
  Mg  Mg137  1  0.400265  0.073606  0.681248  1
  Mg  Mg138  1  0.327000  0.317832  0.713842  1
  Mg  Mg139  1  0.684313  0.367146  0.696702  1
  Mg  Mg140  1  0.033922  0.017679  0.696687  1
  Mg  Mg141  1  0.352815  0.685997  0.696420  1
  Mg  Mg142  1  0.740402  0.733554  0.681277  1
  Mg  Mg143  1  0.649541  0.982563  0.716044  1
  Mg  Mg144  1  0.984672  0.660045  0.713844  1
