# generated using pymatgen
data_Mg13Al14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.44733303
_cell_length_b   14.86297351
_cell_length_c   51.93583778
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.82593010
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg13Al14
_chemical_formula_sum   'Mg104 Al112'
_cell_volume   9263.17032417
_cell_formula_units_Z   8
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  0.593491  0.711974  0.336905  1
  Mg  Mg2  1  0.165154  0.517722  0.360739  1
  Mg  Mg3  1  0.262863  0.722469  0.338505  1
  Mg  Mg4  1  0.897681  0.663071  0.282988  1
  Mg  Mg5  1  0.824244  0.180305  0.358353  1
  Mg  Mg6  1  0.237723  0.648432  0.283960  1
  Mg  Mg7  1  0.255478  0.373761  0.337556  1
  Mg  Mg8  1  0.254567  0.399298  0.281289  1
  Mg  Mg9  1  0.373291  0.256722  0.317872  1
  Mg  Mg10  1  0.723577  0.308790  0.376920  1
  Mg  Mg11  1  0.285854  0.763312  0.394446  1
  Mg  Mg12  1  0.370070  0.934964  0.320069  1
  Mg  Mg13  1  0.827735  0.521168  0.360612  1
  Mg  Mg14  1  0.904553  0.355238  0.284243  1
  Mg  Mg15  1  0.510282  0.151152  0.300075  1
  Mg  Mg16  1  0.609781  0.376844  0.282822  1
  Mg  Mg17  1  0.595272  0.050173  0.338619  1
  Mg  Mg18  1  0.142077  0.803949  0.300315  1
  Mg  Mg19  1  0.925114  0.055379  0.335273  1
  Mg  Mg20  1  0.950100  0.762801  0.394146  1
  Mg  Mg21  1  0.936026  0.727299  0.338104  1
  Mg  Mg22  1  0.056496  0.638777  0.377896  1
  Mg  Mg23  1  0.045573  0.940689  0.319195  1
  Mg  Mg24  1  0.597939  0.385243  0.339538  1
  Mg  Mg25  1  0.056080  0.305482  0.374276  1
  Mg  Mg26  1  0.136992  0.164879  0.300714  1
  Mg  Mg27  1  0.973128  0.470501  0.451153  1
  Mg  Mg28  1  0.534976  0.262251  0.469166  1
  Mg  Mg29  1  0.640660  0.471010  0.450544  1
  Mg  Mg30  1  0.287503  0.432524  0.393553  1
  Mg  Mg31  1  0.201111  0.929678  0.468087  1
  Mg  Mg32  1  0.619445  0.434907  0.395050  1
  Mg  Mg33  1  0.637529  0.135898  0.450173  1
  Mg  Mg34  1  0.614210  0.098025  0.394077  1
  Mg  Mg35  1  0.743494  0.012602  0.432168  1
  Mg  Mg36  1  0.094360  0.051554  0.487096  1
  Mg  Mg37  1  0.657440  0.508557  0.506337  1
  Mg  Mg38  1  0.742674  0.679027  0.430963  1
  Mg  Mg39  1  0.200614  0.262849  0.468949  1
  Mg  Mg40  1  0.287746  0.100378  0.395317  1
  Mg  Mg41  1  0.849075  0.890643  0.413113  1
  Mg  Mg42  1  0.956917  0.096959  0.392635  1
  Mg  Mg43  1  0.971401  0.805638  0.450221  1
  Mg  Mg44  1  0.515231  0.559097  0.412178  1
  Mg  Mg45  1  0.307793  0.806578  0.450341  1
  Mg  Mg46  1  0.323443  0.507877  0.506142  1
  Mg  Mg47  1  0.303668  0.470945  0.449830  1
  Mg  Mg48  1  0.428217  0.383437  0.488181  1
  Mg  Mg49  1  0.410779  0.680620  0.431286  1
  Mg  Mg50  1  0.973142  0.137105  0.449470  1
  Mg  Mg51  1  0.429853  0.051261  0.487247  1
  Mg  Mg52  1  0.515883  0.890714  0.413360  1
  Mg  Mg53  1  0.343853  0.216098  0.561689  1
  Mg  Mg54  1  0.904754  0.005848  0.580996  1
  Mg  Mg55  1  0.012503  0.215956  0.563330  1
  Mg  Mg56  1  0.658662  0.178202  0.506592  1
  Mg  Mg57  1  0.572796  0.673561  0.580001  1
  Mg  Mg58  1  0.993190  0.178438  0.506524  1
  Mg  Mg59  1  0.008672  0.880438  0.561638  1
  Mg  Mg60  1  0.987338  0.843200  0.505974  1
  Mg  Mg61  1  0.115661  0.757364  0.544000  1
  Mg  Mg62  1  0.467337  0.795794  0.598865  1
  Mg  Mg63  1  0.028854  0.254861  0.620704  1
  Mg  Mg64  1  0.115492  0.423169  0.543562  1
  Mg  Mg65  1  0.574061  0.007068  0.581361  1
  Mg  Mg66  1  0.658208  0.843320  0.506159  1
  Mg  Mg67  1  0.222026  0.634690  0.525199  1
  Mg  Mg68  1  0.329097  0.843159  0.506126  1
  Mg  Mg69  1  0.343130  0.548162  0.562813  1
  Mg  Mg70  1  0.888028  0.302635  0.524438  1
  Mg  Mg71  1  0.678259  0.549499  0.562425  1
  Mg  Mg72  1  0.698594  0.254177  0.619983  1
  Mg  Mg73  1  0.676576  0.216241  0.563057  1
  Mg  Mg74  1  0.801028  0.128381  0.600617  1
  Mg  Mg75  1  0.781120  0.423667  0.543428  1
  Mg  Mg76  1  0.345473  0.880950  0.561783  1
  Mg  Mg77  1  0.800715  0.795919  0.598653  1
  Mg  Mg78  1  0.886455  0.635211  0.525241  1
  Mg  Mg79  1  0.725053  0.977940  0.675039  1
  Mg  Mg80  1  0.274043  0.748510  0.692426  1
  Mg  Mg81  1  0.380545  0.960468  0.673436  1
  Mg  Mg82  1  0.031363  0.923125  0.617264  1
  Mg  Mg83  1  0.949708  0.434706  0.692475  1
  Mg  Mg84  1  0.365765  0.923622  0.617607  1
  Mg  Mg85  1  0.390132  0.632651  0.675657  1
  Mg  Mg86  1  0.358728  0.589469  0.619010  1
  Mg  Mg87  1  0.492504  0.509346  0.653223  1
  Mg  Mg88  1  0.806688  0.532170  0.710579  1
  Mg  Mg89  1  0.418908  0.021292  0.728231  1
  Mg  Mg90  1  0.488880  0.167790  0.652298  1
  Mg  Mg91  1  0.946443  0.750857  0.692083  1
  Mg  Mg92  1  0.029376  0.586121  0.616478  1
  Mg  Mg93  1  0.594840  0.380599  0.637366  1
  Mg  Mg94  1  0.703311  0.589065  0.618035  1
  Mg  Mg95  1  0.715717  0.308177  0.677583  1
  Mg  Mg96  1  0.260984  0.048738  0.633945  1
  Mg  Mg97  1  0.067107  0.313497  0.678619  1
  Mg  Mg98  1  0.075632  0.025955  0.727492  1
  Mg  Mg99  1  0.053465  0.962146  0.672982  1
  Mg  Mg100  1  0.175389  0.880423  0.711427  1
  Mg  Mg101  1  0.151960  0.168413  0.651701  1
  Mg  Mg102  1  0.721242  0.635514  0.673328  1
  Mg  Mg103  1  0.186137  0.528130  0.710550  1
  Mg  Mg104  1  0.259416  0.382503  0.639254  1
  Al  Al105  1  0.487052  0.505940  0.357509  1
  Al  Al106  1  0.931354  0.396171  0.341556  1
  Al  Al107  1  0.119939  0.464609  0.310512  1
  Al  Al108  1  0.391913  0.307523  0.375349  1
  Al  Al109  1  0.356127  0.581436  0.322232  1
  Al  Al110  1  0.384548  0.967694  0.375226  1
  Al  Al111  1  0.950554  0.424973  0.395619  1
  Al  Al112  1  0.715157  0.647150  0.372859  1
  Al  Al113  1  0.480137  0.480687  0.307555  1
  Al  Al114  1  0.719148  0.964687  0.374804  1
  Al  Al115  1  0.404785  0.648018  0.373592  1
  Al  Al116  1  0.804117  0.801842  0.308346  1
  Al  Al117  1  0.467472  0.794897  0.308864  1
  Al  Al118  1  0.497198  0.848915  0.358690  1
  Al  Al119  1  0.784301  0.137446  0.304510  1
  Al  Al120  1  0.262690  0.042980  0.293912  1
  Al  Al121  1  0.827180  0.853232  0.358017  1
  Al  Al122  1  0.695302  0.924393  0.323879  1
  Al  Al123  1  0.057301  0.968131  0.374358  1
  Al  Al124  1  0.705888  0.589296  0.320031  1
  Al  Al125  1  0.266396  0.051606  0.341993  1
  Al  Al126  1  0.011281  0.269697  0.319278  1
  Al  Al127  1  0.165997  0.856559  0.357752  1
  Al  Al128  1  0.031150  0.590074  0.320527  1
  Al  Al129  1  0.721634  0.275970  0.322123  1
  Al  Al130  1  0.485279  0.174807  0.357791  1
  Al  Al131  1  0.165670  0.171343  0.357718  1
  Al  Al132  1  0.816840  0.474213  0.309435  1
  Al  Al133  1  0.865444  0.257285  0.468018  1
  Al  Al134  1  0.307949  0.142999  0.451122  1
  Al  Al135  1  0.516515  0.228239  0.413424  1
  Al  Al136  1  0.765874  0.057048  0.488659  1
  Al  Al137  1  0.743266  0.342422  0.431700  1
  Al  Al138  1  0.757935  0.714488  0.486564  1
  Al  Al139  1  0.321455  0.170615  0.505822  1
  Al  Al140  1  0.089931  0.390465  0.485462  1
  Al  Al141  1  0.852975  0.230441  0.414602  1
  Al  Al142  1  0.092458  0.710940  0.486647  1
  Al  Al143  1  0.774474  0.390778  0.485700  1
  Al  Al144  1  0.170813  0.552107  0.416628  1
  Al  Al145  1  0.855830  0.550878  0.416907  1
  Al  Al146  1  0.871025  0.599816  0.470087  1
  Al  Al147  1  0.178920  0.885910  0.411458  1
  Al  Al148  1  0.622787  0.771140  0.393110  1
  Al  Al149  1  0.203348  0.600350  0.469871  1
  Al  Al150  1  0.079356  0.684661  0.433565  1
  Al  Al151  1  0.429639  0.714362  0.486782  1
  Al  Al152  1  0.074762  0.343686  0.429909  1
  Al  Al153  1  0.637105  0.799177  0.449625  1
  Al  Al154  1  0.403056  0.018442  0.429584  1
  Al  Al155  1  0.538018  0.603399  0.470154  1
  Al  Al156  1  0.405370  0.337924  0.429861  1
  Al  Al157  1  0.088817  0.018451  0.429212  1
  Al  Al158  1  0.855047  0.924295  0.470935  1
  Al  Al159  1  0.542600  0.923775  0.471135  1
  Al  Al160  1  0.184364  0.228008  0.412842  1
  Al  Al161  1  0.237852  0.002366  0.578497  1
  Al  Al162  1  0.679163  0.887230  0.562633  1
  Al  Al163  1  0.886580  0.972087  0.525560  1
  Al  Al164  1  0.137738  0.800598  0.600381  1
  Al  Al165  1  0.113344  0.086658  0.542577  1
  Al  Al166  1  0.131526  0.457691  0.599444  1
  Al  Al167  1  0.693660  0.915820  0.619054  1
  Al  Al168  1  0.462752  0.136108  0.595996  1
  Al  Al169  1  0.224306  0.975832  0.525603  1
  Al  Al170  1  0.463516  0.455651  0.597984  1
  Al  Al171  1  0.144579  0.134372  0.595855  1
  Al  Al172  1  0.541905  0.295559  0.527142  1
  Al  Al173  1  0.226467  0.295709  0.527281  1
  Al  Al174  1  0.240653  0.342049  0.583293  1
  Al  Al175  1  0.550458  0.629571  0.523793  1
  Al  Al176  1  0.994698  0.515704  0.506758  1
  Al  Al177  1  0.573741  0.343427  0.581993  1
  Al  Al178  1  0.450925  0.428603  0.544525  1
  Al  Al179  1  0.799714  0.457860  0.599026  1
  Al  Al180  1  0.446112  0.087081  0.542618  1
  Al  Al181  1  0.008501  0.543578  0.561011  1
  Al  Al182  1  0.773599  0.762344  0.541127  1
  Al  Al183  1  0.910987  0.348531  0.583003  1
  Al  Al184  1  0.778245  0.083335  0.542462  1
  Al  Al185  1  0.461080  0.761794  0.541290  1
  Al  Al186  1  0.227993  0.668149  0.582680  1
  Al  Al187  1  0.913661  0.668393  0.582545  1
  Al  Al188  1  0.558594  0.972003  0.525810  1
  Al  Al189  1  0.621283  0.764961  0.687374  1
  Al  Al190  1  0.052788  0.636586  0.669796  1
  Al  Al191  1  0.259184  0.718689  0.637320  1
  Al  Al192  1  0.534008  0.567253  0.707178  1
  Al  Al193  1  0.490016  0.835332  0.653676  1
  Al  Al194  1  0.492879  0.216479  0.704083  1
  Al  Al195  1  0.055628  0.644322  0.717799  1
  Al  Al196  1  0.847373  0.889937  0.702844  1
  Al  Al197  1  0.597435  0.722336  0.636935  1
  Al  Al198  1  0.836146  0.201147  0.703625  1
  Al  Al199  1  0.514437  0.886972  0.703286  1
  Al  Al200  1  0.911757  0.037605  0.638194  1
  Al  Al201  1  0.599632  0.039116  0.638964  1
  Al  Al202  1  0.609004  0.097076  0.690104  1
  Al  Al203  1  0.925236  0.378928  0.637934  1
  Al  Al204  1  0.367054  0.263152  0.617135  1
  Al  Al205  1  0.961183  0.100827  0.688567  1
  Al  Al206  1  0.829791  0.184490  0.655305  1
  Al  Al207  1  0.198279  0.220172  0.703038  1
  Al  Al208  1  0.819348  0.837523  0.653150  1
  Al  Al209  1  0.381098  0.288166  0.670204  1
  Al  Al210  1  0.150029  0.514204  0.653943  1
  Al  Al211  1  0.282262  0.091939  0.690782  1
  Al  Al212  1  0.151409  0.830401  0.654031  1
  Al  Al213  1  0.833940  0.512330  0.653658  1
  Al  Al214  1  0.576438  0.415051  0.692018  1
  Al  Al215  1  0.320841  0.419910  0.694059  1
  Al  Al216  1  0.933035  0.719079  0.636742  1
