# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.84880579
_cell_length_b   21.65392991
_cell_length_c   46.47732044
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   76.38302320
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg264
_cell_volume   13545.8986266
_cell_formula_units_Z   264
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  0.350947  0.383163  0.297708  1
  Mg  Mg2  1  0.745983  0.389540  0.284390  1
  Mg  Mg3  1  0.959994  0.376386  0.310088  1
  Mg  Mg4  1  0.350947  0.883163  0.297708  1
  Mg  Mg5  1  0.745983  0.889540  0.284390  1
  Mg  Mg6  1  0.959994  0.876386  0.310088  1
  Mg  Mg7  1  0.349946  0.746621  0.322331  1
  Mg  Mg8  1  0.744995  0.752209  0.309007  1
  Mg  Mg9  1  0.136119  0.756509  0.296402  1
  Mg  Mg10  1  0.349946  0.246621  0.322331  1
  Mg  Mg11  1  0.744995  0.252209  0.309007  1
  Mg  Mg12  1  0.136119  0.256509  0.296402  1
  Mg  Mg13  1  0.262756  0.623253  0.316740  1
  Mg  Mg14  1  0.659103  0.627714  0.303937  1
  Mg  Mg15  1  0.048078  0.635101  0.290784  1
  Mg  Mg16  1  0.262756  0.123253  0.316740  1
  Mg  Mg17  1  0.659103  0.127714  0.303937  1
  Mg  Mg18  1  0.048078  0.135101  0.290784  1
  Mg  Mg19  1  0.570762  0.505937  0.298686  1
  Mg  Mg20  1  0.960985  0.512549  0.285648  1
  Mg  Mg21  1  0.174658  0.501430  0.311349  1
  Mg  Mg22  1  0.570762  0.005937  0.298686  1
  Mg  Mg23  1  0.960985  0.012549  0.285648  1
  Mg  Mg24  1  0.174658  0.001430  0.311349  1
  Mg  Mg25  1  0.173901  0.365628  0.336328  1
  Mg  Mg26  1  0.567445  0.370666  0.322941  1
  Mg  Mg27  1  0.781335  0.360426  0.349766  1
  Mg  Mg28  1  0.173901  0.865628  0.336328  1
  Mg  Mg29  1  0.567445  0.870666  0.322941  1
  Mg  Mg30  1  0.781335  0.860426  0.349766  1
  Mg  Mg31  1  0.172032  0.730155  0.361772  1
  Mg  Mg32  1  0.565409  0.735643  0.348194  1
  Mg  Mg33  1  0.957587  0.741555  0.335368  1
  Mg  Mg34  1  0.172032  0.230155  0.361772  1
  Mg  Mg35  1  0.565409  0.235643  0.348194  1
  Mg  Mg36  1  0.957587  0.241555  0.335368  1
  Mg  Mg37  1  0.085024  0.607664  0.356287  1
  Mg  Mg38  1  0.478216  0.612810  0.343020  1
  Mg  Mg39  1  0.871122  0.618416  0.330172  1
  Mg  Mg40  1  0.085024  0.107664  0.356287  1
  Mg  Mg41  1  0.478216  0.112810  0.343020  1
  Mg  Mg42  1  0.871122  0.118416  0.330172  1
  Mg  Mg43  1  0.390961  0.490047  0.337664  1
  Mg  Mg44  1  0.784346  0.495500  0.324866  1
  Mg  Mg45  1  0.998177  0.484844  0.351041  1
  Mg  Mg46  1  0.390961  0.990047  0.337664  1
  Mg  Mg47  1  0.784346  0.995500  0.324866  1
  Mg  Mg48  1  0.998177  0.984844  0.351041  1
  Mg  Mg49  1  0.995838  0.349579  0.376202  1
  Mg  Mg50  1  0.388640  0.354826  0.363015  1
  Mg  Mg51  1  0.602918  0.344045  0.389397  1
  Mg  Mg52  1  0.995838  0.849579  0.376202  1
  Mg  Mg53  1  0.388640  0.854826  0.363015  1
  Mg  Mg54  1  0.602918  0.844045  0.389397  1
  Mg  Mg55  1  0.993263  0.714246  0.401718  1
  Mg  Mg56  1  0.386451  0.719546  0.388296  1
  Mg  Mg57  1  0.778788  0.725068  0.375061  1
  Mg  Mg58  1  0.993263  0.214246  0.401718  1
  Mg  Mg59  1  0.386451  0.219546  0.388296  1
  Mg  Mg60  1  0.778788  0.225068  0.375061  1
  Mg  Mg61  1  0.906602  0.591489  0.396334  1
  Mg  Mg62  1  0.299603  0.596824  0.382812  1
  Mg  Mg63  1  0.692123  0.602204  0.369705  1
  Mg  Mg64  1  0.906602  0.091489  0.396334  1
  Mg  Mg65  1  0.299603  0.096824  0.382812  1
  Mg  Mg66  1  0.692123  0.102204  0.369705  1
  Mg  Mg67  1  0.212845  0.474031  0.377278  1
  Mg  Mg68  1  0.605420  0.479116  0.364073  1
  Mg  Mg69  1  0.819966  0.468654  0.390874  1
  Mg  Mg70  1  0.212845  0.974031  0.377278  1
  Mg  Mg71  1  0.605420  0.979116  0.364073  1
  Mg  Mg72  1  0.819966  0.968654  0.390874  1
  Mg  Mg73  1  0.817522  0.333300  0.416374  1
  Mg  Mg74  1  0.210350  0.338696  0.402794  1
  Mg  Mg75  1  0.424842  0.327879  0.429711  1
  Mg  Mg76  1  0.817522  0.833300  0.416374  1
  Mg  Mg77  1  0.210350  0.838696  0.402794  1
  Mg  Mg78  1  0.424842  0.827879  0.429711  1
  Mg  Mg79  1  0.814949  0.698018  0.441941  1
  Mg  Mg80  1  0.207956  0.703397  0.428512  1
  Mg  Mg81  1  0.600456  0.708855  0.415026  1
  Mg  Mg82  1  0.814949  0.198018  0.441941  1
  Mg  Mg83  1  0.207956  0.203397  0.428512  1
  Mg  Mg84  1  0.600456  0.208855  0.415026  1
  Mg  Mg85  1  0.728330  0.575235  0.436464  1
  Mg  Mg86  1  0.121290  0.580623  0.422978  1
  Mg  Mg87  1  0.513908  0.585967  0.409527  1
  Mg  Mg88  1  0.728330  0.075235  0.436464  1
  Mg  Mg89  1  0.121290  0.080623  0.422978  1
  Mg  Mg90  1  0.513908  0.085967  0.409527  1
  Mg  Mg91  1  0.034706  0.457843  0.417551  1
  Mg  Mg92  1  0.427294  0.463224  0.404034  1
  Mg  Mg93  1  0.641738  0.452385  0.430862  1
  Mg  Mg94  1  0.034706  0.957843  0.417551  1
  Mg  Mg95  1  0.427294  0.963224  0.404034  1
  Mg  Mg96  1  0.641738  0.952385  0.430862  1
  Mg  Mg97  1  0.639235  0.317126  0.456446  1
  Mg  Mg98  1  0.032107  0.322523  0.443064  1
  Mg  Mg99  1  0.246574  0.311759  0.469841  1
  Mg  Mg100  1  0.639235  0.817126  0.456446  1
  Mg  Mg101  1  0.032107  0.822523  0.443064  1
  Mg  Mg102  1  0.246574  0.811759  0.469841  1
  Mg  Mg103  1  0.636701  0.681877  0.482096  1
  Mg  Mg104  1  0.029532  0.687233  0.468681  1
  Mg  Mg105  1  0.422339  0.692579  0.455273  1
  Mg  Mg106  1  0.636701  0.181877  0.482096  1
  Mg  Mg107  1  0.029532  0.187233  0.468681  1
  Mg  Mg108  1  0.422339  0.192579  0.455273  1
  Mg  Mg109  1  0.550140  0.559065  0.476544  1
  Mg  Mg110  1  0.942965  0.564462  0.463219  1
  Mg  Mg111  1  0.335726  0.569819  0.449745  1
  Mg  Mg112  1  0.550140  0.059065  0.476544  1
  Mg  Mg113  1  0.942965  0.064462  0.463219  1
  Mg  Mg114  1  0.335726  0.069819  0.449745  1
  Mg  Mg115  1  0.856400  0.441674  0.457712  1
  Mg  Mg116  1  0.249142  0.447039  0.444194  1
  Mg  Mg117  1  0.463558  0.436296  0.471013  1
  Mg  Mg118  1  0.856400  0.941674  0.457712  1
  Mg  Mg119  1  0.249142  0.947039  0.444194  1
  Mg  Mg120  1  0.463558  0.936296  0.471013  1
  Mg  Mg121  1  0.461018  0.300998  0.496672  1
  Mg  Mg122  1  0.853820  0.306374  0.483309  1
  Mg  Mg123  1  0.068253  0.295636  0.510044  1
  Mg  Mg124  1  0.461018  0.800998  0.496672  1
  Mg  Mg125  1  0.853820  0.806374  0.483309  1
  Mg  Mg126  1  0.068253  0.795636  0.510044  1
  Mg  Mg127  1  0.458451  0.665736  0.522254  1
  Mg  Mg128  1  0.851218  0.671130  0.508899  1
  Mg  Mg129  1  0.244009  0.676479  0.495490  1
  Mg  Mg130  1  0.458451  0.165736  0.522254  1
  Mg  Mg131  1  0.851218  0.171130  0.508899  1
  Mg  Mg132  1  0.244009  0.176479  0.495490  1
  Mg  Mg133  1  0.371880  0.542959  0.516739  1
  Mg  Mg134  1  0.764666  0.548335  0.503395  1
  Mg  Mg135  1  0.157464  0.553688  0.489952  1
  Mg  Mg136  1  0.371880  0.042959  0.516739  1
  Mg  Mg137  1  0.764666  0.048335  0.503395  1
  Mg  Mg138  1  0.157464  0.053688  0.489952  1
  Mg  Mg139  1  0.678091  0.425518  0.497795  1
  Mg  Mg140  1  0.070912  0.430898  0.484452  1
  Mg  Mg141  1  0.285308  0.420166  0.511189  1
  Mg  Mg142  1  0.678091  0.925518  0.497795  1
  Mg  Mg143  1  0.070912  0.930898  0.484452  1
  Mg  Mg144  1  0.285308  0.920166  0.511189  1
  Mg  Mg145  1  0.282747  0.284862  0.536864  1
  Mg  Mg146  1  0.675511  0.290233  0.523482  1
  Mg  Mg147  1  0.889980  0.279521  0.550311  1
  Mg  Mg148  1  0.282747  0.784862  0.536864  1
  Mg  Mg149  1  0.675511  0.790233  0.523482  1
  Mg  Mg150  1  0.889980  0.779521  0.550311  1
  Mg  Mg151  1  0.280202  0.649612  0.562478  1
  Mg  Mg152  1  0.672986  0.654987  0.549110  1
  Mg  Mg153  1  0.065706  0.660355  0.535658  1
  Mg  Mg154  1  0.280202  0.149612  0.562478  1
  Mg  Mg155  1  0.672986  0.154987  0.549110  1
  Mg  Mg156  1  0.065706  0.160355  0.535658  1
  Mg  Mg157  1  0.193656  0.526805  0.556938  1
  Mg  Mg158  1  0.586414  0.532186  0.543503  1
  Mg  Mg159  1  0.979197  0.537565  0.530170  1
  Mg  Mg160  1  0.193656  0.026805  0.556938  1
  Mg  Mg161  1  0.586414  0.032186  0.543503  1
  Mg  Mg162  1  0.979197  0.037565  0.530170  1
  Mg  Mg163  1  0.499791  0.409426  0.537970  1
  Mg  Mg164  1  0.892610  0.414794  0.524664  1
  Mg  Mg165  1  0.107036  0.404024  0.551412  1
  Mg  Mg166  1  0.499791  0.909426  0.537970  1
  Mg  Mg167  1  0.892610  0.914794  0.524664  1
  Mg  Mg168  1  0.107036  0.904024  0.551412  1
  Mg  Mg169  1  0.104381  0.268758  0.576998  1
  Mg  Mg170  1  0.497263  0.274124  0.563648  1
  Mg  Mg171  1  0.711788  0.263281  0.590563  1
  Mg  Mg172  1  0.104381  0.768758  0.576998  1
  Mg  Mg173  1  0.497263  0.774124  0.563648  1
  Mg  Mg174  1  0.711788  0.763281  0.590563  1
  Mg  Mg175  1  0.102016  0.633392  0.602589  1
  Mg  Mg176  1  0.494734  0.638805  0.589156  1
  Mg  Mg177  1  0.887484  0.644238  0.575827  1
  Mg  Mg178  1  0.102016  0.133392  0.602589  1
  Mg  Mg179  1  0.494734  0.138805  0.589156  1
  Mg  Mg180  1  0.887484  0.144238  0.575827  1
  Mg  Mg181  1  0.015522  0.510592  0.597142  1
  Mg  Mg182  1  0.408154  0.516019  0.583701  1
  Mg  Mg183  1  0.800948  0.521455  0.570356  1
  Mg  Mg184  1  0.015522  0.010592  0.597142  1
  Mg  Mg185  1  0.408154  0.016019  0.583701  1
  Mg  Mg186  1  0.800948  0.021455  0.570356  1
  Mg  Mg187  1  0.321478  0.393233  0.578145  1
  Mg  Mg188  1  0.714295  0.398633  0.564735  1
  Mg  Mg189  1  0.928794  0.387911  0.591692  1
  Mg  Mg190  1  0.321478  0.893233  0.578145  1
  Mg  Mg191  1  0.714295  0.898633  0.564735  1
  Mg  Mg192  1  0.928794  0.887911  0.591692  1
  Mg  Mg193  1  0.926166  0.252575  0.617270  1
  Mg  Mg194  1  0.319066  0.257891  0.603891  1
  Mg  Mg195  1  0.533378  0.247083  0.630520  1
  Mg  Mg196  1  0.926166  0.752575  0.617270  1
  Mg  Mg197  1  0.319066  0.757891  0.603891  1
  Mg  Mg198  1  0.533378  0.747083  0.630520  1
  Mg  Mg199  1  0.924045  0.617382  0.642463  1
  Mg  Mg200  1  0.316581  0.622563  0.629348  1
  Mg  Mg201  1  0.709369  0.628077  0.616093  1
  Mg  Mg202  1  0.924045  0.117382  0.642463  1
  Mg  Mg203  1  0.316581  0.122563  0.629348  1
  Mg  Mg204  1  0.709369  0.128077  0.616093  1
  Mg  Mg205  1  0.837186  0.494783  0.637188  1
  Mg  Mg206  1  0.229927  0.499748  0.623844  1
  Mg  Mg207  1  0.622783  0.505214  0.610425  1
  Mg  Mg208  1  0.837186  0.994783  0.637188  1
  Mg  Mg209  1  0.229927  0.999748  0.623844  1
  Mg  Mg210  1  0.622783  0.005214  0.610425  1
  Mg  Mg211  1  0.143136  0.377019  0.618335  1
  Mg  Mg212  1  0.535980  0.382448  0.604921  1
  Mg  Mg213  1  0.750454  0.371795  0.631507  1
  Mg  Mg214  1  0.143136  0.877019  0.618335  1
  Mg  Mg215  1  0.535980  0.882448  0.604921  1
  Mg  Mg216  1  0.750454  0.871795  0.631507  1
  Mg  Mg217  1  0.747995  0.236357  0.657226  1
  Mg  Mg218  1  0.140669  0.241690  0.643622  1
  Mg  Mg219  1  0.355013  0.230771  0.670381  1
  Mg  Mg220  1  0.747995  0.736357  0.657226  1
  Mg  Mg221  1  0.140669  0.741690  0.643622  1
  Mg  Mg222  1  0.355013  0.730771  0.670381  1
  Mg  Mg223  1  0.745318  0.601334  0.682347  1
  Mg  Mg224  1  0.138332  0.606536  0.668848  1
  Mg  Mg225  1  0.531041  0.611807  0.655678  1
  Mg  Mg226  1  0.745318  0.101334  0.682347  1
  Mg  Mg227  1  0.138332  0.106536  0.668848  1
  Mg  Mg228  1  0.531041  0.111807  0.655678  1
  Mg  Mg229  1  0.658412  0.478715  0.676629  1
  Mg  Mg230  1  0.051374  0.483767  0.663575  1
  Mg  Mg231  1  0.444357  0.488972  0.650411  1
  Mg  Mg232  1  0.658412  0.978715  0.676629  1
  Mg  Mg233  1  0.051374  0.983767  0.663575  1
  Mg  Mg234  1  0.444357  0.988972  0.650411  1
  Mg  Mg235  1  0.964414  0.360981  0.658239  1
  Mg  Mg236  1  0.357179  0.366366  0.644915  1
  Mg  Mg237  1  0.571425  0.355396  0.671113  1
  Mg  Mg238  1  0.964414  0.860981  0.658239  1
  Mg  Mg239  1  0.357179  0.866366  0.644915  1
  Mg  Mg240  1  0.571425  0.855396  0.671113  1
  Mg  Mg241  1  0.567989  0.220167  0.696451  1
  Mg  Mg242  1  0.962489  0.226178  0.683426  1
  Mg  Mg243  1  0.177756  0.213207  0.709021  1
  Mg  Mg244  1  0.567989  0.720167  0.696451  1
  Mg  Mg245  1  0.962489  0.726178  0.683426  1
  Mg  Mg246  1  0.177756  0.713207  0.709021  1
  Mg  Mg247  1  0.566086  0.583826  0.721004  1
  Mg  Mg248  1  0.960192  0.590288  0.707778  1
  Mg  Mg249  1  0.353788  0.594862  0.695264  1
  Mg  Mg250  1  0.566086  0.083826  0.721004  1
  Mg  Mg251  1  0.960192  0.090288  0.707778  1
  Mg  Mg252  1  0.353788  0.094862  0.695264  1
  Mg  Mg253  1  0.481438  0.460772  0.715881  1
  Mg  Mg254  1  0.871806  0.468170  0.702763  1
  Mg  Mg255  1  0.266489  0.473081  0.689942  1
  Mg  Mg256  1  0.481438  0.960772  0.715881  1
  Mg  Mg257  1  0.871806  0.968170  0.702763  1
  Mg  Mg258  1  0.266489  0.973081  0.689942  1
  Mg  Mg259  1  0.784789  0.346121  0.697062  1
  Mg  Mg260  1  0.179205  0.349768  0.684373  1
  Mg  Mg261  1  0.393240  0.339726  0.710250  1
  Mg  Mg262  1  0.784789  0.846121  0.697062  1
  Mg  Mg263  1  0.179205  0.849768  0.684373  1
  Mg  Mg264  1  0.393240  0.839726  0.710250  1
