# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.50127830
_cell_length_b   31.20380564
_cell_length_c   45.93534792
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.94725014
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg156
_cell_volume   7854.65744176
_cell_formula_units_Z   156
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  0.986359  0.982563  0.279664  1
  Mg  Mg2  1  0.823255  0.312727  0.290928  1
  Mg  Mg3  1  0.658882  0.645017  0.302418  1
  Mg  Mg4  1  0.197941  0.229608  0.288302  1
  Mg  Mg5  1  0.033278  0.561914  0.299737  1
  Mg  Mg6  1  0.870355  0.895074  0.310480  1
  Mg  Mg7  1  0.905477  0.146585  0.285246  1
  Mg  Mg8  1  0.740860  0.478880  0.296639  1
  Mg  Mg9  1  0.578644  0.810825  0.308167  1
  Mg  Mg10  1  0.610320  0.063949  0.282550  1
  Mg  Mg11  1  0.448595  0.395799  0.294009  1
  Mg  Mg12  1  0.284559  0.728047  0.305541  1
  Mg  Mg13  1  0.490034  0.977772  0.312991  1
  Mg  Mg14  1  0.324483  0.310191  0.324608  1
  Mg  Mg15  1  0.160045  0.642468  0.336092  1
  Mg  Mg16  1  0.700843  0.227139  0.321803  1
  Mg  Mg17  1  0.536090  0.559410  0.333229  1
  Mg  Mg18  1  0.370901  0.891987  0.344224  1
  Mg  Mg19  1  0.406748  0.144190  0.319001  1
  Mg  Mg20  1  0.242108  0.476345  0.330337  1
  Mg  Mg21  1  0.077978  0.808756  0.341737  1
  Mg  Mg22  1  0.112750  0.061279  0.316257  1
  Mg  Mg23  1  0.948226  0.393270  0.327499  1
  Mg  Mg24  1  0.784183  0.725463  0.339078  1
  Mg  Mg25  1  0.991378  0.975273  0.347394  1
  Mg  Mg26  1  0.825749  0.307624  0.358851  1
  Mg  Mg27  1  0.660962  0.639932  0.370336  1
  Mg  Mg28  1  0.200977  0.224549  0.356088  1
  Mg  Mg29  1  0.036284  0.556856  0.367503  1
  Mg  Mg30  1  0.871011  0.889357  0.378671  1
  Mg  Mg31  1  0.907859  0.141469  0.353193  1
  Mg  Mg32  1  0.743355  0.473776  0.364567  1
  Mg  Mg33  1  0.578672  0.806247  0.376005  1
  Mg  Mg34  1  0.615131  0.058139  0.350213  1
  Mg  Mg35  1  0.450426  0.390688  0.361772  1
  Mg  Mg36  1  0.285764  0.723093  0.373275  1
  Mg  Mg37  1  0.493193  0.972426  0.381590  1
  Mg  Mg38  1  0.327076  0.305013  0.393278  1
  Mg  Mg39  1  0.162058  0.637417  0.404741  1
  Mg  Mg40  1  0.702194  0.221916  0.390449  1
  Mg  Mg41  1  0.537329  0.554290  0.401878  1
  Mg  Mg42  1  0.371721  0.886740  0.413193  1
  Mg  Mg43  1  0.409631  0.138726  0.387551  1
  Mg  Mg44  1  0.244605  0.471194  0.398999  1
  Mg  Mg45  1  0.079434  0.803648  0.410438  1
  Mg  Mg46  1  0.117152  0.055626  0.384683  1
  Mg  Mg47  1  0.951827  0.388103  0.396149  1
  Mg  Mg48  1  0.786733  0.720534  0.407656  1
  Mg  Mg49  1  0.994759  0.969819  0.416333  1
  Mg  Mg50  1  0.828465  0.302372  0.427937  1
  Mg  Mg51  1  0.663187  0.634828  0.439407  1
  Mg  Mg52  1  0.203674  0.219226  0.425098  1
  Mg  Mg53  1  0.038545  0.551711  0.436549  1
  Mg  Mg54  1  0.872694  0.884127  0.447938  1
  Mg  Mg55  1  0.910980  0.136102  0.422203  1
  Mg  Mg56  1  0.745873  0.468596  0.433661  1
  Mg  Mg57  1  0.580394  0.801047  0.445138  1
  Mg  Mg58  1  0.618646  0.052927  0.419259  1
  Mg  Mg59  1  0.453170  0.385483  0.430826  1
  Mg  Mg60  1  0.287783  0.717941  0.442315  1
  Mg  Mg61  1  0.496085  0.967206  0.450914  1
  Mg  Mg62  1  0.329792  0.299741  0.462546  1
  Mg  Mg63  1  0.164370  0.632234  0.474019  1
  Mg  Mg64  1  0.705031  0.216616  0.459689  1
  Mg  Mg65  1  0.539734  0.549114  0.471146  1
  Mg  Mg66  1  0.373764  0.881556  0.482601  1
  Mg  Mg67  1  0.412482  0.133465  0.456798  1
  Mg  Mg68  1  0.247134  0.465992  0.468279  1
  Mg  Mg69  1  0.081508  0.798459  0.479761  1
  Mg  Mg70  1  0.120095  0.050343  0.453902  1
  Mg  Mg71  1  0.954516  0.382871  0.465418  1
  Mg  Mg72  1  0.788961  0.715351  0.476921  1
  Mg  Mg73  1  0.997408  0.964641  0.485614  1
  Mg  Mg74  1  0.831141  0.297126  0.497180  1
  Mg  Mg75  1  0.665586  0.629632  0.508658  1
  Mg  Mg76  1  0.206437  0.213992  0.494311  1
  Mg  Mg77  1  0.040962  0.546506  0.505776  1
  Mg  Mg78  1  0.874952  0.878982  0.517259  1
  Mg  Mg79  1  0.913833  0.130869  0.491436  1
  Mg  Mg80  1  0.748400  0.463381  0.502913  1
  Mg  Mg81  1  0.582694  0.795879  0.514428  1
  Mg  Mg82  1  0.621413  0.047733  0.488513  1
  Mg  Mg83  1  0.455819  0.380252  0.500046  1
  Mg  Mg84  1  0.290189  0.712753  0.511542  1
  Mg  Mg85  1  0.498634  0.962054  0.520277  1
  Mg  Mg86  1  0.332465  0.294513  0.531811  1
  Mg  Mg87  1  0.166803  0.627023  0.543283  1
  Mg  Mg88  1  0.707803  0.211391  0.528945  1
  Mg  Mg89  1  0.542199  0.543896  0.540409  1
  Mg  Mg90  1  0.376199  0.876407  0.551958  1
  Mg  Mg91  1  0.415221  0.128266  0.526064  1
  Mg  Mg92  1  0.249680  0.460766  0.537545  1
  Mg  Mg93  1  0.084010  0.793282  0.549056  1
  Mg  Mg94  1  0.122708  0.045165  0.523176  1
  Mg  Mg95  1  0.957121  0.377640  0.534677  1
  Mg  Mg96  1  0.791439  0.710164  0.546181  1
  Mg  Mg97  1  0.999867  0.959500  0.554935  1
  Mg  Mg98  1  0.833791  0.291912  0.566430  1
  Mg  Mg99  1  0.668075  0.624410  0.577900  1
  Mg  Mg100  1  0.209178  0.208790  0.563535  1
  Mg  Mg101  1  0.043477  0.541273  0.574995  1
  Mg  Mg102  1  0.877557  0.873807  0.586515  1
  Mg  Mg103  1  0.916527  0.125672  0.560692  1
  Mg  Mg104  1  0.750957  0.458149  0.572161  1
  Mg  Mg105  1  0.585312  0.790700  0.583714  1
  Mg  Mg106  1  0.623890  0.042563  0.557781  1
  Mg  Mg107  1  0.458384  0.375033  0.569267  1
  Mg  Mg108  1  0.292750  0.707534  0.580755  1
  Mg  Mg109  1  0.500987  0.956871  0.589683  1
  Mg  Mg110  1  0.335098  0.289323  0.601088  1
  Mg  Mg111  1  0.169290  0.621768  0.612538  1
  Mg  Mg112  1  0.710487  0.206203  0.598212  1
  Mg  Mg113  1  0.544741  0.538634  0.609662  1
  Mg  Mg114  1  0.378880  0.871217  0.621261  1
  Mg  Mg115  1  0.417859  0.123078  0.595352  1
  Mg  Mg116  1  0.252243  0.455524  0.606819  1
  Mg  Mg117  1  0.086867  0.788017  0.618322  1
  Mg  Mg118  1  0.125145  0.039974  0.592487  1
  Mg  Mg119  1  0.959661  0.372428  0.603944  1
  Mg  Mg120  1  0.793946  0.704945  0.615433  1
  Mg  Mg121  1  0.002011  0.954292  0.624185  1
  Mg  Mg122  1  0.836365  0.286759  0.635515  1
  Mg  Mg123  1  0.670604  0.619097  0.646944  1
  Mg  Mg124  1  0.211856  0.203675  0.632573  1
  Mg  Mg125  1  0.046173  0.536005  0.644026  1
  Mg  Mg126  1  0.880838  0.868434  0.655395  1
  Mg  Mg127  1  0.919166  0.120526  0.629782  1
  Mg  Mg128  1  0.753514  0.452926  0.641248  1
  Mg  Mg129  1  0.587980  0.785508  0.652814  1
  Mg  Mg130  1  0.626258  0.037382  0.626882  1
  Mg  Mg131  1  0.460824  0.369850  0.638317  1
  Mg  Mg132  1  0.295212  0.702242  0.649766  1
  Mg  Mg133  1  0.503200  0.951616  0.658633  1
  Mg  Mg134  1  0.337653  0.284203  0.669745  1
  Mg  Mg135  1  0.171906  0.616447  0.681147  1
  Mg  Mg136  1  0.714207  0.201131  0.666843  1
  Mg  Mg137  1  0.548479  0.533425  0.678304  1
  Mg  Mg138  1  0.381767  0.865704  0.689781  1
  Mg  Mg139  1  0.420440  0.118090  0.663984  1
  Mg  Mg140  1  0.254808  0.450350  0.675483  1
  Mg  Mg141  1  0.089389  0.782645  0.686908  1
  Mg  Mg142  1  0.126786  0.034893  0.661174  1
  Mg  Mg143  1  0.961164  0.367273  0.672592  1
  Mg  Mg144  1  0.795266  0.699510  0.683969  1
  Mg  Mg145  1  0.002386  0.948949  0.692359  1
  Mg  Mg146  1  0.838903  0.281660  0.703436  1
  Mg  Mg147  1  0.673199  0.613959  0.714865  1
  Mg  Mg148  1  0.214027  0.198649  0.700346  1
  Mg  Mg149  1  0.048123  0.530911  0.711798  1
  Mg  Mg150  1  0.882625  0.862151  0.722975  1
  Mg  Mg151  1  0.922017  0.115629  0.697697  1
  Mg  Mg152  1  0.756079  0.447817  0.709171  1
  Mg  Mg153  1  0.590121  0.779391  0.720621  1
  Mg  Mg154  1  0.629715  0.032738  0.694613  1
  Mg  Mg155  1  0.464044  0.364756  0.706082  1
  Mg  Mg156  1  0.297126  0.696828  0.717509  1
