# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.80563768
_cell_length_b   21.67462128
_cell_length_c   46.80188506
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   76.36493472
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg264
_cell_volume   13609.9267277
_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  0.356616  0.382134  0.295317  1
  Mg  Mg2  1  0.751348  0.390761  0.283488  1
  Mg  Mg3  1  0.965235  0.375784  0.308108  1
  Mg  Mg4  1  0.356616  0.882134  0.295317  1
  Mg  Mg5  1  0.751348  0.890761  0.283488  1
  Mg  Mg6  1  0.965235  0.875784  0.308108  1
  Mg  Mg7  1  0.360228  0.744747  0.319283  1
  Mg  Mg8  1  0.753529  0.750729  0.305811  1
  Mg  Mg9  1  0.141412  0.758015  0.293800  1
  Mg  Mg10  1  0.360228  0.244747  0.319283  1
  Mg  Mg11  1  0.753529  0.250729  0.305811  1
  Mg  Mg12  1  0.141412  0.258015  0.293800  1
  Mg  Mg13  1  0.268360  0.621481  0.313547  1
  Mg  Mg14  1  0.660970  0.627311  0.300887  1
  Mg  Mg15  1  0.045056  0.637444  0.288922  1
  Mg  Mg16  1  0.268360  0.121481  0.313547  1
  Mg  Mg17  1  0.660970  0.127311  0.300887  1
  Mg  Mg18  1  0.045056  0.137444  0.288922  1
  Mg  Mg19  1  0.565827  0.506066  0.296244  1
  Mg  Mg20  1  0.956062  0.513005  0.284224  1
  Mg  Mg21  1  0.174525  0.500397  0.308678  1
  Mg  Mg22  1  0.565827  0.006066  0.296244  1
  Mg  Mg23  1  0.956062  0.013005  0.284224  1
  Mg  Mg24  1  0.174525  1.000397  0.308678  1
  Mg  Mg25  1  0.177772  0.365996  0.334415  1
  Mg  Mg26  1  0.571584  0.369058  0.321048  1
  Mg  Mg27  1  0.783910  0.360547  0.348422  1
  Mg  Mg28  1  0.177772  0.865996  0.334415  1
  Mg  Mg29  1  0.571584  0.869058  0.321048  1
  Mg  Mg30  1  0.783910  0.860547  0.348422  1
  Mg  Mg31  1  0.177969  0.730088  0.359122  1
  Mg  Mg32  1  0.571706  0.735890  0.346030  1
  Mg  Mg33  1  0.962567  0.742721  0.333712  1
  Mg  Mg34  1  0.177969  0.230088  0.359122  1
  Mg  Mg35  1  0.571706  0.235890  0.346030  1
  Mg  Mg36  1  0.962567  0.242721  0.333712  1
  Mg  Mg37  1  0.088443  0.607714  0.353976  1
  Mg  Mg38  1  0.481408  0.612222  0.341593  1
  Mg  Mg39  1  0.872924  0.618475  0.329150  1
  Mg  Mg40  1  0.088443  0.107714  0.353976  1
  Mg  Mg41  1  0.481408  0.112222  0.341593  1
  Mg  Mg42  1  0.872924  0.118475  0.329150  1
  Mg  Mg43  1  0.390513  0.488983  0.336302  1
  Mg  Mg44  1  0.782900  0.495698  0.324027  1
  Mg  Mg45  1  0.998481  0.485114  0.349541  1
  Mg  Mg46  1  0.390513  0.988983  0.336302  1
  Mg  Mg47  1  0.782900  0.995698  0.324027  1
  Mg  Mg48  1  0.998481  0.985114  0.349541  1
  Mg  Mg49  1  0.999318  0.349887  0.374272  1
  Mg  Mg50  1  0.391185  0.354587  0.361320  1
  Mg  Mg51  1  0.605767  0.344002  0.387550  1
  Mg  Mg52  1  0.999318  0.849887  0.374272  1
  Mg  Mg53  1  0.391185  0.854587  0.361320  1
  Mg  Mg54  1  0.605767  0.844002  0.387550  1
  Mg  Mg55  1  0.998297  0.714218  0.399569  1
  Mg  Mg56  1  0.391235  0.719558  0.386009  1
  Mg  Mg57  1  0.783417  0.725461  0.372944  1
  Mg  Mg58  1  0.998297  0.214218  0.399569  1
  Mg  Mg59  1  0.391235  0.219558  0.386009  1
  Mg  Mg60  1  0.783417  0.225461  0.372944  1
  Mg  Mg61  1  0.909912  0.591607  0.394581  1
  Mg  Mg62  1  0.302354  0.596840  0.380631  1
  Mg  Mg63  1  0.694318  0.602496  0.367845  1
  Mg  Mg64  1  0.909912  0.091607  0.394581  1
  Mg  Mg65  1  0.302354  0.096840  0.380631  1
  Mg  Mg66  1  0.694318  0.102496  0.367845  1
  Mg  Mg67  1  0.213447  0.474157  0.375366  1
  Mg  Mg68  1  0.605503  0.478871  0.362230  1
  Mg  Mg69  1  0.821497  0.468600  0.389207  1
  Mg  Mg70  1  0.213447  0.974157  0.375366  1
  Mg  Mg71  1  0.605503  0.978871  0.362230  1
  Mg  Mg72  1  0.821497  0.968600  0.389207  1
  Mg  Mg73  1  0.820910  0.333219  0.414559  1
  Mg  Mg74  1  0.213486  0.338495  0.400835  1
  Mg  Mg75  1  0.427840  0.327757  0.427802  1
  Mg  Mg76  1  0.820910  0.833219  0.414559  1
  Mg  Mg77  1  0.213486  0.838495  0.400835  1
  Mg  Mg78  1  0.427840  0.827757  0.427802  1
  Mg  Mg79  1  0.819046  0.698087  0.439818  1
  Mg  Mg80  1  0.212255  0.703407  0.426225  1
  Mg  Mg81  1  0.604606  0.708893  0.413086  1
  Mg  Mg82  1  0.819046  0.198087  0.439818  1
  Mg  Mg83  1  0.212255  0.203407  0.426225  1
  Mg  Mg84  1  0.604606  0.208893  0.413086  1
  Mg  Mg85  1  0.731397  0.575244  0.434483  1
  Mg  Mg86  1  0.124429  0.580648  0.420928  1
  Mg  Mg87  1  0.516765  0.585780  0.407815  1
  Mg  Mg88  1  0.731397  0.075244  0.434483  1
  Mg  Mg89  1  0.124429  0.080648  0.420928  1
  Mg  Mg90  1  0.516765  0.085780  0.407815  1
  Mg  Mg91  1  0.036675  0.457790  0.415798  1
  Mg  Mg92  1  0.428706  0.463004  0.402344  1
  Mg  Mg93  1  0.643771  0.452277  0.428972  1
  Mg  Mg94  1  0.036675  0.957790  0.415798  1
  Mg  Mg95  1  0.428706  0.963004  0.402344  1
  Mg  Mg96  1  0.643771  0.952277  0.428972  1
  Mg  Mg97  1  0.642367  0.317068  0.454506  1
  Mg  Mg98  1  0.035349  0.322410  0.441102  1
  Mg  Mg99  1  0.249688  0.311612  0.467856  1
  Mg  Mg100  1  0.642367  0.817068  0.454506  1
  Mg  Mg101  1  0.035349  0.822410  0.441102  1
  Mg  Mg102  1  0.249688  0.811612  0.467856  1
  Mg  Mg103  1  0.640606  0.681775  0.480025  1
  Mg  Mg104  1  0.033574  0.687167  0.466556  1
  Mg  Mg105  1  0.426179  0.692545  0.453145  1
  Mg  Mg106  1  0.640606  0.181775  0.480025  1
  Mg  Mg107  1  0.033574  0.187167  0.466556  1
  Mg  Mg108  1  0.426179  0.192545  0.453145  1
  Mg  Mg109  1  0.553227  0.558911  0.474604  1
  Mg  Mg110  1  0.946116  0.564403  0.461280  1
  Mg  Mg111  1  0.338592  0.569788  0.447719  1
  Mg  Mg112  1  0.553227  0.058911  0.474604  1
  Mg  Mg113  1  0.946116  0.064403  0.461280  1
  Mg  Mg114  1  0.338592  0.069788  0.447719  1
  Mg  Mg115  1  0.858680  0.441565  0.455896  1
  Mg  Mg116  1  0.251171  0.446885  0.442291  1
  Mg  Mg117  1  0.465808  0.436151  0.469150  1
  Mg  Mg118  1  0.858680  0.941565  0.455896  1
  Mg  Mg119  1  0.251171  0.946885  0.442291  1
  Mg  Mg120  1  0.465808  0.936151  0.469150  1
  Mg  Mg121  1  0.464144  0.300812  0.494681  1
  Mg  Mg122  1  0.857027  0.306217  0.481365  1
  Mg  Mg123  1  0.071441  0.295441  0.508028  1
  Mg  Mg124  1  0.464144  0.800812  0.494681  1
  Mg  Mg125  1  0.857027  0.806217  0.481365  1
  Mg  Mg126  1  0.071441  0.795441  0.508028  1
  Mg  Mg127  1  0.462372  0.665589  0.520100  1
  Mg  Mg128  1  0.855094  0.671019  0.506762  1
  Mg  Mg129  1  0.247892  0.676385  0.493336  1
  Mg  Mg130  1  0.462372  0.165589  0.520100  1
  Mg  Mg131  1  0.855094  0.171019  0.506762  1
  Mg  Mg132  1  0.247892  0.176385  0.493336  1
  Mg  Mg133  1  0.374952  0.542804  0.514718  1
  Mg  Mg134  1  0.767775  0.548168  0.501401  1
  Mg  Mg135  1  0.160628  0.553507  0.487926  1
  Mg  Mg136  1  0.374952  0.042804  0.514718  1
  Mg  Mg137  1  0.767775  0.048168  0.501401  1
  Mg  Mg138  1  0.160628  0.053507  0.487926  1
  Mg  Mg139  1  0.680470  0.425300  0.495916  1
  Mg  Mg140  1  0.073308  0.430679  0.482588  1
  Mg  Mg141  1  0.287687  0.419910  0.509300  1
  Mg  Mg142  1  0.680470  0.925300  0.495916  1
  Mg  Mg143  1  0.073308  0.930679  0.482588  1
  Mg  Mg144  1  0.287687  0.919910  0.509300  1
  Mg  Mg145  1  0.285967  0.284638  0.534837  1
  Mg  Mg146  1  0.678598  0.290043  0.521445  1
  Mg  Mg147  1  0.893210  0.279243  0.548288  1
  Mg  Mg148  1  0.285967  0.784638  0.534837  1
  Mg  Mg149  1  0.678598  0.790043  0.521445  1
  Mg  Mg150  1  0.893210  0.779243  0.548288  1
  Mg  Mg151  1  0.284513  0.649444  0.560340  1
  Mg  Mg152  1  0.677006  0.654723  0.546970  1
  Mg  Mg153  1  0.069765  0.660149  0.533472  1
  Mg  Mg154  1  0.284513  0.149444  0.560340  1
  Mg  Mg155  1  0.677006  0.154723  0.546970  1
  Mg  Mg156  1  0.069765  0.160149  0.533472  1
  Mg  Mg157  1  0.196994  0.526484  0.554919  1
  Mg  Mg158  1  0.589501  0.531881  0.541447  1
  Mg  Mg159  1  0.982366  0.537335  0.528082  1
  Mg  Mg160  1  0.196994  0.026484  0.554919  1
  Mg  Mg161  1  0.589501  0.031881  0.541447  1
  Mg  Mg162  1  0.982366  0.037335  0.528082  1
  Mg  Mg163  1  0.501953  0.409160  0.536032  1
  Mg  Mg164  1  0.894968  0.414531  0.522762  1
  Mg  Mg165  1  0.109410  0.403642  0.549509  1
  Mg  Mg166  1  0.501953  0.909160  0.536032  1
  Mg  Mg167  1  0.894968  0.914531  0.522762  1
  Mg  Mg168  1  0.109410  0.903642  0.549509  1
  Mg  Mg169  1  0.107683  0.268519  0.574903  1
  Mg  Mg170  1  0.500341  0.273865  0.561646  1
  Mg  Mg171  1  0.714855  0.262963  0.588360  1
  Mg  Mg172  1  0.107683  0.768519  0.574903  1
  Mg  Mg173  1  0.500341  0.773865  0.561646  1
  Mg  Mg174  1  0.714855  0.762963  0.588360  1
  Mg  Mg175  1  0.107098  0.633239  0.600214  1
  Mg  Mg176  1  0.499153  0.638534  0.586891  1
  Mg  Mg177  1  0.891746  0.643987  0.573584  1
  Mg  Mg178  1  0.107098  0.133239  0.600214  1
  Mg  Mg179  1  0.499153  0.138534  0.586891  1
  Mg  Mg180  1  0.891746  0.143987  0.573584  1
  Mg  Mg181  1  0.018911  0.510249  0.594797  1
  Mg  Mg182  1  0.411159  0.515716  0.581700  1
  Mg  Mg183  1  0.804094  0.521094  0.568349  1
  Mg  Mg184  1  0.018911  0.010249  0.594797  1
  Mg  Mg185  1  0.411159  0.015716  0.581700  1
  Mg  Mg186  1  0.804094  0.021094  0.568349  1
  Mg  Mg187  1  0.323258  0.392900  0.576382  1
  Mg  Mg188  1  0.716459  0.398227  0.562887  1
  Mg  Mg189  1  0.930701  0.387551  0.589724  1
  Mg  Mg190  1  0.323258  0.892900  0.576382  1
  Mg  Mg191  1  0.716459  0.898227  0.562887  1
  Mg  Mg192  1  0.930701  0.887551  0.589724  1
  Mg  Mg193  1  0.929988  0.251984  0.615197  1
  Mg  Mg194  1  0.322300  0.257749  0.601879  1
  Mg  Mg195  1  0.536604  0.246456  0.628525  1
  Mg  Mg196  1  0.929988  0.751984  0.615197  1
  Mg  Mg197  1  0.322300  0.757749  0.601879  1
  Mg  Mg198  1  0.536604  0.746456  0.628525  1
  Mg  Mg199  1  0.930621  0.616776  0.639782  1
  Mg  Mg200  1  0.322355  0.622227  0.627238  1
  Mg  Mg201  1  0.714375  0.627639  0.613902  1
  Mg  Mg202  1  0.930621  0.116776  0.639782  1
  Mg  Mg203  1  0.322355  0.122227  0.627238  1
  Mg  Mg204  1  0.714375  0.127639  0.613902  1
  Mg  Mg205  1  0.840790  0.494382  0.635183  1
  Mg  Mg206  1  0.233188  0.499436  0.621995  1
  Mg  Mg207  1  0.625709  0.504785  0.608230  1
  Mg  Mg208  1  0.840790  0.994382  0.635183  1
  Mg  Mg209  1  0.233188  0.999436  0.621995  1
  Mg  Mg210  1  0.625709  0.004785  0.608230  1
  Mg  Mg211  1  0.144278  0.376551  0.616603  1
  Mg  Mg212  1  0.537075  0.382241  0.602876  1
  Mg  Mg213  1  0.752103  0.370885  0.629676  1
  Mg  Mg214  1  0.144278  0.876551  0.616603  1
  Mg  Mg215  1  0.537075  0.882241  0.602876  1
  Mg  Mg216  1  0.752103  0.870885  0.629676  1
  Mg  Mg217  1  0.752287  0.235521  0.654879  1
  Mg  Mg218  1  0.144780  0.241514  0.641370  1
  Mg  Mg219  1  0.359262  0.229953  0.668324  1
  Mg  Mg220  1  0.752287  0.735521  0.654879  1
  Mg  Mg221  1  0.144780  0.741514  0.641370  1
  Mg  Mg222  1  0.359262  0.729953  0.668324  1
  Mg  Mg223  1  0.753767  0.602067  0.680051  1
  Mg  Mg224  1  0.144644  0.607260  0.666081  1
  Mg  Mg225  1  0.537392  0.611459  0.653111  1
  Mg  Mg226  1  0.753767  0.102067  0.680051  1
  Mg  Mg227  1  0.144644  0.107260  0.666081  1
  Mg  Mg228  1  0.537392  0.111459  0.653111  1
  Mg  Mg229  1  0.663187  0.478126  0.673592  1
  Mg  Mg230  1  0.054301  0.483693  0.660910  1
  Mg  Mg231  1  0.446947  0.488963  0.648590  1
  Mg  Mg232  1  0.663187  0.978126  0.673592  1
  Mg  Mg233  1  0.054301  0.983693  0.660910  1
  Mg  Mg234  1  0.446947  0.988963  0.648590  1
  Mg  Mg235  1  0.963999  0.360015  0.656463  1
  Mg  Mg236  1  0.356995  0.366235  0.643402  1
  Mg  Mg237  1  0.571194  0.354916  0.668229  1
  Mg  Mg238  1  0.963999  0.860015  0.656463  1
  Mg  Mg239  1  0.356995  0.866235  0.643402  1
  Mg  Mg240  1  0.571194  0.854916  0.668229  1
  Mg  Mg241  1  0.573817  0.221047  0.695197  1
  Mg  Mg242  1  0.963508  0.226995  0.681876  1
  Mg  Mg243  1  0.180353  0.213825  0.707086  1
  Mg  Mg244  1  0.573817  0.721047  0.695197  1
  Mg  Mg245  1  0.963508  0.726995  0.681876  1
  Mg  Mg246  1  0.180353  0.713825  0.707086  1
  Mg  Mg247  1  0.574636  0.582411  0.717640  1
  Mg  Mg248  1  0.969830  0.589650  0.705533  1
  Mg  Mg249  1  0.359374  0.595485  0.693694  1
  Mg  Mg250  1  0.574636  0.082411  0.717640  1
  Mg  Mg251  1  0.969830  0.089650  0.705533  1
  Mg  Mg252  1  0.359374  0.095485  0.693694  1
  Mg  Mg253  1  0.490140  0.457977  0.713605  1
  Mg  Mg254  1  0.875912  0.466817  0.701475  1
  Mg  Mg255  1  0.266795  0.474717  0.689053  1
  Mg  Mg256  1  0.490140  0.957977  0.713605  1
  Mg  Mg257  1  0.875912  0.966817  0.701475  1
  Mg  Mg258  1  0.266795  0.974717  0.689053  1
  Mg  Mg259  1  0.780540  0.345284  0.696685  1
  Mg  Mg260  1  0.175130  0.351404  0.683346  1
  Mg  Mg261  1  0.393762  0.338001  0.708587  1
  Mg  Mg262  1  0.780540  0.845284  0.696685  1
  Mg  Mg263  1  0.175130  0.851404  0.683346  1
  Mg  Mg264  1  0.393762  0.838001  0.708587  1
