# generated using pymatgen
data_Mg13Al14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.03194178
_cell_length_b   22.05789284
_cell_length_c   52.29518671
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg13Al14
_chemical_formula_sum   'Mg104 Al112'
_cell_volume   10418.5401541
_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  0.503448  0.839259  0.356942  1
  Mg  Mg2  1  0.502081  0.507473  0.453349  1
  Mg  Mg3  1  0.835293  0.952392  0.419719  1
  Mg  Mg4  1  0.828374  0.283294  0.318125  1
  Mg  Mg5  1  0.003015  0.839445  0.403670  1
  Mg  Mg6  1  0.989444  0.164627  0.303766  1
  Mg  Mg7  1  0.332657  0.064687  0.333021  1
  Mg  Mg8  1  0.332069  0.729782  0.436043  1
  Mg  Mg9  1  0.503542  0.063323  0.385019  1
  Mg  Mg10  1  0.502514  0.729215  0.486871  1
  Mg  Mg11  1  0.335375  0.063834  0.435719  1
  Mg  Mg12  1  0.329147  0.398449  0.334257  1
  Mg  Mg13  1  0.670831  0.951828  0.469901  1
  Mg  Mg14  1  0.670728  0.284963  0.369693  1
  Mg  Mg15  1  1.002168  0.175600  0.503083  1
  Mg  Mg16  1  1.001776  0.509241  0.402807  1
  Mg  Mg17  1  0.003463  0.952757  0.368584  1
  Mg  Mg18  1  0.002312  0.619379  0.469539  1
  Mg  Mg19  1  0.678104  0.065106  0.333062  1
  Mg  Mg20  1  0.672865  0.729748  0.436066  1
  Mg  Mg21  1  0.670965  0.285673  0.469940  1
  Mg  Mg22  1  0.669109  0.617523  0.369245  1
  Mg  Mg23  1  0.669915  0.063835  0.435723  1
  Mg  Mg24  1  0.669974  0.398434  0.334450  1
  Mg  Mg25  1  0.835695  0.948898  0.317455  1
  Mg  Mg26  1  0.833301  0.618575  0.419484  1
  Mg  Mg27  1  0.002670  0.173934  0.403439  1
  Mg  Mg28  1  0.002527  0.501446  0.302453  1
  Mg  Mg29  1  0.332823  0.285685  0.469909  1
  Mg  Mg30  1  0.335302  0.617630  0.369258  1
  Mg  Mg31  1  0.501798  0.173568  0.453354  1
  Mg  Mg32  1  0.501497  0.506201  0.355448  1
  Mg  Mg33  1  0.833291  0.063477  0.486173  1
  Mg  Mg34  1  0.828808  0.396273  0.385799  1
  Mg  Mg35  1  0.002226  0.736914  0.332633  1
  Mg  Mg36  1  1.001980  0.396226  0.436140  1
  Mg  Mg37  1  0.836686  0.730242  0.385239  1
  Mg  Mg38  1  0.833872  0.397200  0.486401  1
  Mg  Mg39  1  0.172668  0.948711  0.317495  1
  Mg  Mg40  1  0.171121  0.618588  0.419492  1
  Mg  Mg41  1  0.502634  0.842105  0.453124  1
  Mg  Mg42  1  0.502624  0.175075  0.350313  1
  Mg  Mg43  1  0.502352  0.627914  0.316968  1
  Mg  Mg44  1  0.501740  0.286089  0.418840  1
  Mg  Mg45  1  0.171608  0.063475  0.486182  1
  Mg  Mg46  1  0.173666  0.396421  0.385716  1
  Mg  Mg47  1  0.170445  0.952429  0.419692  1
  Mg  Mg48  1  0.168727  0.282537  0.317839  1
  Mg  Mg49  1  0.168383  0.730248  0.385221  1
  Mg  Mg50  1  0.170109  0.397191  0.486400  1
  Mg  Mg51  1  0.334402  0.951845  0.469888  1
  Mg  Mg52  1  0.330726  0.284789  0.369609  1
  Mg  Mg53  1  0.501992  0.174896  0.553578  1
  Mg  Mg54  1  0.503572  0.843059  0.649696  1
  Mg  Mg55  1  0.829032  0.286028  0.620853  1
  Mg  Mg56  1  0.833260  0.618749  0.520543  1
  Mg  Mg57  1  1.001741  0.173350  0.604290  1
  Mg  Mg58  1  0.002219  0.506737  0.503967  1
  Mg  Mg59  1  0.332902  0.396568  0.536967  1
  Mg  Mg60  1  0.335637  0.064425  0.635966  1
  Mg  Mg61  1  0.501773  0.395600  0.588268  1
  Mg  Mg62  1  0.502301  0.060949  0.689461  1
  Mg  Mg63  1  0.330785  0.396380  0.637425  1
  Mg  Mg64  1  0.334472  0.730175  0.536848  1
  Mg  Mg65  1  0.671187  0.281680  0.673408  1
  Mg  Mg66  1  0.669947  0.618162  0.571059  1
  Mg  Mg67  1  0.988997  0.518053  0.702924  1
  Mg  Mg68  1  0.003029  0.842815  0.603029  1
  Mg  Mg69  1  1.001962  0.286190  0.570676  1
  Mg  Mg70  1  1.002073  0.943895  0.674280  1
  Mg  Mg71  1  0.670924  0.396577  0.536938  1
  Mg  Mg72  1  0.668611  0.064489  0.635989  1
  Mg  Mg73  1  0.678125  0.617269  0.673721  1
  Mg  Mg74  1  0.673077  0.952483  0.570657  1
  Mg  Mg75  1  0.670587  0.396082  0.637348  1
  Mg  Mg76  1  0.670834  0.730195  0.536836  1
  Mg  Mg77  1  0.833795  0.285051  0.520492  1
  Mg  Mg78  1  0.836106  0.951755  0.621522  1
  Mg  Mg79  1  0.002819  0.507950  0.603461  1
  Mg  Mg80  1  0.002625  0.841036  0.503352  1
  Mg  Mg81  1  0.332770  0.617631  0.673779  1
  Mg  Mg82  1  0.331770  0.952430  0.570678  1
  Mg  Mg83  1  0.502789  0.507409  0.656231  1
  Mg  Mg84  1  0.502625  0.840038  0.553556  1
  Mg  Mg85  1  0.828108  0.400231  0.688379  1
  Mg  Mg86  1  0.835394  0.729770  0.586987  1
  Mg  Mg87  1  0.002261  0.063016  0.537065  1
  Mg  Mg88  1  0.003563  0.729968  0.638201  1
  Mg  Mg89  1  0.833131  0.063983  0.586732  1
  Mg  Mg90  1  0.835653  0.733938  0.689266  1
  Mg  Mg91  1  0.170176  0.285063  0.520492  1
  Mg  Mg92  1  0.168752  0.951767  0.621533  1
  Mg  Mg93  1  0.501160  0.173866  0.655100  1
  Mg  Mg94  1  0.501856  0.508306  0.553612  1
  Mg  Mg95  1  0.502482  0.952948  0.519881  1
  Mg  Mg96  1  0.503696  0.618918  0.621689  1
  Mg  Mg97  1  0.168259  0.400925  0.688700  1
  Mg  Mg98  1  0.170443  0.729740  0.587015  1
  Mg  Mg99  1  0.173651  0.285948  0.620930  1
  Mg  Mg100  1  0.171735  0.618754  0.520534  1
  Mg  Mg101  1  0.171214  0.063983  0.586722  1
  Mg  Mg102  1  0.173181  0.734266  0.689237  1
  Mg  Mg103  1  0.328835  0.281768  0.673544  1
  Mg  Mg104  1  0.335481  0.618168  0.571065  1
  Al  Al105  1  0.336460  0.953086  0.370167  1
  Al  Al106  1  0.336831  0.618603  0.470199  1
  Al  Al107  1  0.670716  0.953111  0.370210  1
  Al  Al108  1  0.667851  0.618578  0.470202  1
  Al  Al109  1  0.671254  0.842037  0.403880  1
  Al  Al110  1  0.667335  0.508351  0.503442  1
  Al  Al111  1  0.170768  0.063117  0.385644  1
  Al  Al112  1  0.167949  0.729939  0.486337  1
  Al  Al113  1  0.837940  0.840317  0.453478  1
  Al  Al114  1  0.837605  0.173922  0.354596  1
  Al  Al115  1  0.835851  0.175209  0.452939  1
  Al  Al116  1  0.839782  0.508051  0.353765  1
  Al  Al117  1  0.836106  0.063063  0.385648  1
  Al  Al118  1  0.837133  0.729942  0.486345  1
  Al  Al119  1  0.502935  0.951490  0.418635  1
  Al  Al120  1  0.499046  0.289015  0.321669  1
  Al  Al121  1  0.168895  0.843014  0.354331  1
  Al  Al122  1  0.167877  0.507887  0.453305  1
  Al  Al123  1  0.837644  0.843152  0.354446  1
  Al  Al124  1  0.836255  0.507889  0.453321  1
  Al  Al125  1  0.504639  0.947855  0.324656  1
  Al  Al126  1  0.502249  0.618486  0.419815  1
  Al  Al127  1  0.502563  0.727789  0.386886  1
  Al  Al128  1  0.501920  0.396470  0.486708  1
  Al  Al129  1  0.502434  0.064285  0.486985  1
  Al  Al130  1  0.501118  0.397015  0.386352  1
  Al  Al131  1  0.662539  0.837732  0.309383  1
  Al  Al132  1  0.668808  0.506915  0.403459  1
  Al  Al133  1  0.840778  0.619389  0.322148  1
  Al  Al134  1  0.836885  0.285439  0.419889  1
  Al  Al135  1  0.163983  0.619562  0.322135  1
  Al  Al136  1  0.166807  0.285387  0.419838  1
  Al  Al137  1  0.168389  0.175184  0.452943  1
  Al  Al138  1  0.163648  0.508323  0.353758  1
  Al  Al139  1  0.668267  0.730434  0.337821  1
  Al  Al140  1  0.666514  0.396803  0.436004  1
  Al  Al141  1  0.346589  0.837889  0.309326  1
  Al  Al142  1  0.334835  0.506956  0.403474  1
  Al  Al143  1  0.334649  0.842058  0.403826  1
  Al  Al144  1  0.336974  0.508328  0.503405  1
  Al  Al145  1  0.336377  0.730559  0.337799  1
  Al  Al146  1  0.337209  0.396825  0.435953  1
  Al  Al147  1  1.001959  0.284823  0.469313  1
  Al  Al148  1  1.002162  0.618880  0.369049  1
  Al  Al149  1  0.666657  0.174366  0.402660  1
  Al  Al150  1  0.668002  0.515995  0.309055  1
  Al  Al151  1  0.337453  0.174208  0.402372  1
  Al  Al152  1  0.336526  0.516097  0.308990  1
  Al  Al153  1  0.002635  0.952367  0.469933  1
  Al  Al154  1  1.001018  0.284992  0.369756  1
  Al  Al155  1  0.002621  0.063272  0.435927  1
  Al  Al156  1  1.000042  0.394345  0.338169  1
  Al  Al157  1  0.005089  0.063077  0.338832  1
  Al  Al158  1  0.002490  0.730455  0.436837  1
  Al  Al159  1  0.167425  0.840345  0.453481  1
  Al  Al160  1  0.165037  0.173496  0.353835  1
  Al  Al161  1  0.337317  0.285589  0.570824  1
  Al  Al162  1  0.339366  0.953429  0.668781  1
  Al  Al163  1  0.666409  0.285600  0.570769  1
  Al  Al164  1  0.665014  0.953492  0.668785  1
  Al  Al165  1  0.666543  0.175873  0.603915  1
  Al  Al166  1  0.663025  0.845980  0.697184  1
  Al  Al167  1  0.167128  0.396773  0.587082  1
  Al  Al168  1  0.161907  0.060491  0.681558  1
  Al  Al169  1  0.839354  0.173442  0.653526  1
  Al  Al170  1  0.835827  0.506978  0.553964  1
  Al  Al171  1  0.837354  0.508428  0.652037  1
  Al  Al172  1  0.837885  0.841788  0.553211  1
  Al  Al173  1  0.836636  0.396709  0.587042  1
  Al  Al174  1  0.842734  0.060630  0.681557  1
  Al  Al175  1  0.501217  0.283795  0.620869  1
  Al  Al176  1  0.502481  0.617695  0.519735  1
  Al  Al177  1  0.168433  0.174649  0.553847  1
  Al  Al178  1  0.170060  0.839611  0.652329  1
  Al  Al179  1  0.835542  0.174641  0.553841  1
  Al  Al180  1  0.836616  0.839423  0.652192  1
  Al  Al181  1  0.501914  0.285799  0.520108  1
  Al  Al182  1  0.502477  0.954184  0.619669  1
  Al  Al183  1  0.502200  0.063894  0.586405  1
  Al  Al184  1  0.504814  0.735043  0.682176  1
  Al  Al185  1  0.498800  0.394563  0.685008  1
  Al  Al186  1  0.502985  0.730645  0.588052  1
  Al  Al187  1  0.667380  0.173879  0.503461  1
  Al  Al188  1  0.671243  0.840007  0.602768  1
  Al  Al189  1  0.837172  0.952229  0.520352  1
  Al  Al190  1  0.836399  0.619382  0.621084  1
  Al  Al191  1  0.167841  0.952232  0.520360  1
  Al  Al192  1  0.170716  0.619336  0.621092  1
  Al  Al193  1  0.165263  0.508954  0.652832  1
  Al  Al194  1  0.167480  0.841752  0.553208  1
  Al  Al195  1  0.667878  0.063774  0.536382  1
  Al  Al196  1  0.670630  0.729069  0.636520  1
  Al  Al197  1  0.336831  0.173901  0.503495  1
  Al  Al198  1  0.334683  0.839989  0.602834  1
  Al  Al199  1  0.336955  0.175851  0.603912  1
  Al  Al200  1  0.346889  0.845931  0.697252  1
  Al  Al201  1  0.336709  0.063746  0.536387  1
  Al  Al202  1  0.336733  0.729082  0.636568  1
  Al  Al203  1  0.005154  0.619427  0.667874  1
  Al  Al204  1  0.002455  0.951607  0.569774  1
  Al  Al205  1  0.666782  0.507435  0.604265  1
  Al  Al206  1  0.669042  0.841045  0.503365  1
  Al  Al207  1  0.337510  0.507624  0.604556  1
  Al  Al208  1  0.336179  0.841043  0.503363  1
  Al  Al209  1  1.000188  0.286559  0.668422  1
  Al  Al210  1  0.002683  0.618776  0.570887  1
  Al  Al211  1  1.001011  0.396323  0.637313  1
  Al  Al212  1  0.002669  0.729718  0.536796  1
  Al  Al213  1  1.001970  0.397450  0.537588  1
  Al  Al214  1  1.002086  0.062116  0.635674  1
  Al  Al215  1  0.163294  0.173237  0.653529  1
  Al  Al216  1  0.168529  0.507014  0.553953  1
