# generated using pymatgen
data_Mg13Al14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.75313967
_cell_length_b   20.18140956
_cell_length_c   56.82749877
_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   'Mg156 Al168'
_cell_volume   14626.0533483
_cell_formula_units_Z   12
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  0.502787  0.699469  0.394652  1
  Mg  Mg2  1  0.502787  0.306532  0.324632  1
  Mg  Mg3  1  0.170625  0.566908  0.370247  1
  Mg  Mg4  1  0.160752  0.168960  0.297236  1
  Mg  Mg5  1  0.336990  0.933244  0.405311  1
  Mg  Mg6  1  0.342656  0.533318  0.335825  1
  Mg  Mg7  1  0.333317  0.867081  0.334423  1
  Mg  Mg8  1  0.336465  0.266679  0.406325  1
  Mg  Mg9  1  0.165451  0.833357  0.296879  1
  Mg  Mg10  1  0.166977  0.233413  0.370133  1
  Mg  Mg11  1  0.002787  0.946194  0.287009  1
  Mg  Mg12  1  0.002787  0.335385  0.358614  1
  Mg  Mg13  1  0.002787  0.664056  0.358463  1
  Mg  Mg14  1  0.002787  0.065744  0.429274  1
  Mg  Mg15  1  0.671600  0.066332  0.308342  1
  Mg  Mg16  1  0.669977  0.464978  0.382933  1
  Mg  Mg17  1  0.333973  0.066332  0.308342  1
  Mg  Mg18  1  0.335596  0.464978  0.382933  1
  Mg  Mg19  1  0.335647  0.729898  0.309326  1
  Mg  Mg20  1  0.338293  0.131408  0.382012  1
  Mg  Mg21  1  0.669926  0.729898  0.309326  1
  Mg  Mg22  1  0.667281  0.131408  0.382012  1
  Mg  Mg23  1  0.002787  0.598441  0.406240  1
  Mg  Mg24  1  0.002787  0.201722  0.334286  1
  Mg  Mg25  1  0.502787  0.499997  0.418044  1
  Mg  Mg26  1  0.502787  0.099417  0.345683  1
  Mg  Mg27  1  0.002787  0.998332  0.359407  1
  Mg  Mg28  1  0.002787  0.600497  0.286158  1
  Mg  Mg29  1  0.672256  0.867081  0.334423  1
  Mg  Mg30  1  0.669108  0.266679  0.406325  1
  Mg  Mg31  1  0.840122  0.833357  0.296879  1
  Mg  Mg32  1  0.838596  0.233413  0.370133  1
  Mg  Mg33  1  0.834948  0.566908  0.370247  1
  Mg  Mg34  1  0.844821  0.168960  0.297236  1
  Mg  Mg35  1  0.668584  0.933244  0.405311  1
  Mg  Mg36  1  0.662917  0.533318  0.335825  1
  Mg  Mg37  1  0.502787  0.631015  0.322252  1
  Mg  Mg38  1  0.502787  0.032442  0.394113  1
  Mg  Mg39  1  0.502787  0.966724  0.320669  1
  Mg  Mg40  1  0.502787  0.365342  0.393516  1
  Mg  Mg41  1  0.170351  0.764811  0.346237  1
  Mg  Mg42  1  0.168950  0.165408  0.418194  1
  Mg  Mg43  1  0.835223  0.764811  0.346237  1
  Mg  Mg44  1  0.836623  0.165408  0.418194  1
  Mg  Mg45  1  0.836632  0.831608  0.417829  1
  Mg  Mg46  1  0.839251  0.431139  0.347088  1
  Mg  Mg47  1  0.168941  0.831608  0.417829  1
  Mg  Mg48  1  0.166322  0.431139  0.347088  1
  Mg  Mg49  1  0.502787  0.898194  0.369480  1
  Mg  Mg50  1  0.502787  0.491456  0.296454  1
  Mg  Mg51  1  0.002787  0.799501  0.381765  1
  Mg  Mg52  1  0.002787  0.394102  0.307196  1
  Mg  Mg53  1  0.502787  0.499980  0.537763  1
  Mg  Mg54  1  0.502787  0.099567  0.465757  1
  Mg  Mg55  1  0.168909  0.367625  0.513785  1
  Mg  Mg56  1  0.169311  0.967134  0.441929  1
  Mg  Mg57  1  0.336772  0.733776  0.549492  1
  Mg  Mg58  1  0.336851  0.333418  0.477657  1
  Mg  Mg59  1  0.336633  0.667474  0.478041  1
  Mg  Mg60  1  0.337178  0.067429  0.549626  1
  Mg  Mg61  1  0.168481  0.633690  0.441795  1
  Mg  Mg62  1  0.169139  0.033443  0.513203  1
  Mg  Mg63  1  0.002787  0.733174  0.430268  1
  Mg  Mg64  1  0.002787  0.133391  0.501791  1
  Mg  Mg65  1  0.002787  0.466247  0.501580  1
  Mg  Mg66  1  0.002787  0.866394  0.573219  1
  Mg  Mg67  1  0.668821  0.865841  0.454007  1
  Mg  Mg68  1  0.668652  0.265941  0.525952  1
  Mg  Mg69  1  0.336752  0.865841  0.454007  1
  Mg  Mg70  1  0.336921  0.265941  0.525952  1
  Mg  Mg71  1  0.336839  0.532081  0.453910  1
  Mg  Mg72  1  0.336749  0.932079  0.525453  1
  Mg  Mg73  1  0.668734  0.532081  0.453910  1
  Mg  Mg74  1  0.668824  0.932079  0.525453  1
  Mg  Mg75  1  0.002787  0.399145  0.549788  1
  Mg  Mg76  1  0.002787  0.998802  0.477667  1
  Mg  Mg77  1  0.502787  0.301032  0.561507  1
  Mg  Mg78  1  0.502787  0.900521  0.489608  1
  Mg  Mg79  1  0.002787  0.799771  0.501745  1
  Mg  Mg80  1  0.002787  0.399866  0.430311  1
  Mg  Mg81  1  0.668940  0.667474  0.478041  1
  Mg  Mg82  1  0.668396  0.067429  0.549626  1
  Mg  Mg83  1  0.837092  0.633690  0.441795  1
  Mg  Mg84  1  0.836435  0.033443  0.513203  1
  Mg  Mg85  1  0.836664  0.367625  0.513785  1
  Mg  Mg86  1  0.836263  0.967134  0.441929  1
  Mg  Mg87  1  0.668801  0.733776  0.549492  1
  Mg  Mg88  1  0.668722  0.333418  0.477657  1
  Mg  Mg89  1  0.502787  0.433196  0.466365  1
  Mg  Mg90  1  0.502787  0.833430  0.537915  1
  Mg  Mg91  1  0.502787  0.766116  0.465561  1
  Mg  Mg92  1  0.502787  0.166242  0.537247  1
  Mg  Mg93  1  0.169025  0.566098  0.490220  1
  Mg  Mg94  1  0.168944  0.965902  0.561635  1
  Mg  Mg95  1  0.836548  0.566098  0.490220  1
  Mg  Mg96  1  0.836629  0.965902  0.561635  1
  Mg  Mg97  1  0.836176  0.632397  0.561533  1
  Mg  Mg98  1  0.836693  0.232048  0.489578  1
  Mg  Mg99  1  0.169397  0.632397  0.561533  1
  Mg  Mg100  1  0.168880  0.232048  0.489578  1
  Mg  Mg101  1  0.502787  0.699055  0.513883  1
  Mg  Mg102  1  0.502787  0.298501  0.442019  1
  Mg  Mg103  1  0.002787  0.600712  0.525782  1
  Mg  Mg104  1  0.002787  0.200431  0.453586  1
  Mg  Mg105  1  0.502787  0.291303  0.679083  1
  Mg  Mg106  1  0.502787  0.900429  0.609081  1
  Mg  Mg107  1  0.164578  0.169914  0.655604  1
  Mg  Mg108  1  0.169068  0.767947  0.585654  1
  Mg  Mg109  1  0.334201  0.533304  0.695075  1
  Mg  Mg110  1  0.334503  0.133537  0.621221  1
  Mg  Mg111  1  0.338606  0.468327  0.621497  1
  Mg  Mg112  1  0.330530  0.874077  0.694853  1
  Mg  Mg113  1  0.169062  0.434101  0.585223  1
  Mg  Mg114  1  0.169460  0.834328  0.656746  1
  Mg  Mg115  1  0.002787  0.533695  0.574176  1
  Mg  Mg116  1  0.002787  0.934761  0.644078  1
  Mg  Mg117  1  0.002787  0.264783  0.644569  1
  Mg  Mg118  1  0.002787  0.651479  0.716454  1
  Mg  Mg119  1  0.668377  0.666484  0.598206  1
  Mg  Mg120  1  0.666887  0.064350  0.668861  1
  Mg  Mg121  1  0.337196  0.666484  0.598206  1
  Mg  Mg122  1  0.338686  0.064350  0.668861  1
  Mg  Mg123  1  0.336868  0.332910  0.597185  1
  Mg  Mg124  1  0.332075  0.734297  0.669276  1
  Mg  Mg125  1  0.668706  0.332910  0.597185  1
  Mg  Mg126  1  0.673498  0.734297  0.669276  1
  Mg  Mg127  1  0.002787  0.207336  0.695848  1
  Mg  Mg128  1  0.002787  0.799627  0.621501  1
  Mg  Mg129  1  0.502787  0.111507  0.705782  1
  Mg  Mg130  1  0.502787  0.701882  0.634237  1
  Mg  Mg131  1  0.002787  0.600938  0.643935  1
  Mg  Mg132  1  0.002787  0.200029  0.572809  1
  Mg  Mg133  1  0.666967  0.468327  0.621497  1
  Mg  Mg134  1  0.675044  0.874077  0.694853  1
  Mg  Mg135  1  0.836511  0.434101  0.585223  1
  Mg  Mg136  1  0.836113  0.834328  0.656746  1
  Mg  Mg137  1  0.840995  0.169914  0.655604  1
  Mg  Mg138  1  0.836506  0.767947  0.585654  1
  Mg  Mg139  1  0.671372  0.533304  0.695075  1
  Mg  Mg140  1  0.671070  0.133537  0.621221  1
  Mg  Mg141  1  0.502787  0.233768  0.609940  1
  Mg  Mg142  1  0.502787  0.633792  0.682875  1
  Mg  Mg143  1  0.502787  0.567437  0.609423  1
  Mg  Mg144  1  0.502787  0.969927  0.682718  1
  Mg  Mg145  1  0.167620  0.365869  0.633229  1
  Mg  Mg146  1  0.163430  0.764295  0.706252  1
  Mg  Mg147  1  0.837953  0.365869  0.633229  1
  Mg  Mg148  1  0.842143  0.764295  0.706252  1
  Mg  Mg149  1  0.844574  0.430494  0.706158  1
  Mg  Mg150  1  0.836337  0.032684  0.632641  1
  Mg  Mg151  1  0.160999  0.430494  0.706158  1
  Mg  Mg152  1  0.169236  0.032684  0.632641  1
  Mg  Mg153  1  0.502787  0.500530  0.657836  1
  Mg  Mg154  1  0.502787  0.099425  0.585738  1
  Mg  Mg155  1  0.002787  0.397364  0.669111  1
  Mg  Mg156  1  0.002787  1.001045  0.596797  1
  Al  Al157  1  0.335428  0.732750  0.429765  1
  Al  Al158  1  0.332796  0.331516  0.358683  1
  Al  Al159  1  0.334820  0.600534  0.406265  1
  Al  Al160  1  0.333898  0.199106  0.335844  1
  Al  Al161  1  0.336926  0.666604  0.358635  1
  Al  Al162  1  0.333443  0.271435  0.293705  1
  Al  Al163  1  0.168905  0.966887  0.323997  1
  Al  Al164  1  0.168927  0.366449  0.394898  1
  Al  Al165  1  0.169019  0.631869  0.323408  1
  Al  Al166  1  0.171233  0.032638  0.393622  1
  Al  Al167  1  0.835426  0.499098  0.418382  1
  Al  Al168  1  0.833794  0.099486  0.346575  1
  Al  Al169  1  0.170147  0.499098  0.418382  1
  Al  Al170  1  0.171779  0.099486  0.346575  1
  Al  Al171  1  0.172947  0.699493  0.394080  1
  Al  Al172  1  0.170158  0.299401  0.323847  1
  Al  Al173  1  0.502787  0.833136  0.417813  1
  Al  Al174  1  0.502787  0.434287  0.346992  1
  Al  Al175  1  0.502787  0.567012  0.371056  1
  Al  Al176  1  0.502787  0.177459  0.302787  1
  Al  Al177  1  0.502787  0.828310  0.303285  1
  Al  Al178  1  0.502787  0.232435  0.369868  1
  Al  Al179  1  0.502787  0.763069  0.347046  1
  Al  Al180  1  0.502787  0.165853  0.417993  1
  Al  Al181  1  0.832627  0.699493  0.394080  1
  Al  Al182  1  0.835415  0.299401  0.323847  1
  Al  Al183  1  0.670753  0.600534  0.406265  1
  Al  Al184  1  0.671676  0.199106  0.335844  1
  Al  Al185  1  0.836554  0.631869  0.323408  1
  Al  Al186  1  0.834341  0.032638  0.393622  1
  Al  Al187  1  0.836042  0.899566  0.370274  1
  Al  Al188  1  0.834392  0.503135  0.302993  1
  Al  Al189  1  0.836668  0.966887  0.323997  1
  Al  Al190  1  0.836646  0.366449  0.394898  1
  Al  Al191  1  0.668648  0.666604  0.358635  1
  Al  Al192  1  0.672131  0.271435  0.293705  1
  Al  Al193  1  0.670145  0.732750  0.429765  1
  Al  Al194  1  0.672777  0.331516  0.358683  1
  Al  Al195  1  0.335827  0.798599  0.381928  1
  Al  Al196  1  0.331672  0.400950  0.313492  1
  Al  Al197  1  0.669746  0.798599  0.381928  1
  Al  Al198  1  0.673901  0.400950  0.313492  1
  Al  Al199  1  0.671759  0.999632  0.357728  1
  Al  Al200  1  0.677900  0.596321  0.290379  1
  Al  Al201  1  0.002787  0.731522  0.312138  1
  Al  Al202  1  0.002787  0.132808  0.381666  1
  Al  Al203  1  0.002787  0.865872  0.334747  1
  Al  Al204  1  0.002787  0.266741  0.406058  1
  Al  Al205  1  0.002787  0.932122  0.406351  1
  Al  Al206  1  0.002787  0.530497  0.334930  1
  Al  Al207  1  0.002787  0.068027  0.315100  1
  Al  Al208  1  0.002787  0.467049  0.382445  1
  Al  Al209  1  0.333814  0.999632  0.357728  1
  Al  Al210  1  0.327673  0.596321  0.290379  1
  Al  Al211  1  0.169531  0.899566  0.370274  1
  Al  Al212  1  0.171181  0.503135  0.302993  1
  Al  Al213  1  0.336040  0.533399  0.573341  1
  Al  Al214  1  0.335638  0.132631  0.501356  1
  Al  Al215  1  0.335248  0.400929  0.549493  1
  Al  Al216  1  0.335556  1.000285  0.477597  1
  Al  Al217  1  0.335584  0.466928  0.502163  1
  Al  Al218  1  0.335967  0.066240  0.430164  1
  Al  Al219  1  0.169925  0.766722  0.466188  1
  Al  Al220  1  0.170442  0.166704  0.537616  1
  Al  Al221  1  0.170334  0.432878  0.465704  1
  Al  Al222  1  0.169979  0.832844  0.537300  1
  Al  Al223  1  0.835053  0.299457  0.561313  1
  Al  Al224  1  0.835265  0.898882  0.489743  1
  Al  Al225  1  0.170520  0.299457  0.561313  1
  Al  Al226  1  0.170308  0.898882  0.489743  1
  Al  Al227  1  0.172378  0.500076  0.537727  1
  Al  Al228  1  0.172373  0.099508  0.465703  1
  Al  Al229  1  0.502787  0.633494  0.561789  1
  Al  Al230  1  0.502787  0.232916  0.489725  1
  Al  Al231  1  0.502787  0.366534  0.513836  1
  Al  Al232  1  0.502787  0.966172  0.441718  1
  Al  Al233  1  0.502787  0.632761  0.442195  1
  Al  Al234  1  0.502787  0.033136  0.513551  1
  Al  Al235  1  0.502787  0.566408  0.489974  1
  Al  Al236  1  0.502787  0.966719  0.561384  1
  Al  Al237  1  0.833195  0.500076  0.537727  1
  Al  Al238  1  0.833200  0.099508  0.465703  1
  Al  Al239  1  0.670325  0.400929  0.549493  1
  Al  Al240  1  0.670017  1.000285  0.477597  1
  Al  Al241  1  0.835239  0.432878  0.465704  1
  Al  Al242  1  0.835594  0.832844  0.537300  1
  Al  Al243  1  0.835259  0.700657  0.513736  1
  Al  Al244  1  0.835211  0.300281  0.442018  1
  Al  Al245  1  0.835648  0.766722  0.466188  1
  Al  Al246  1  0.835131  0.166704  0.537616  1
  Al  Al247  1  0.669989  0.466928  0.502163  1
  Al  Al248  1  0.669606  0.066240  0.430164  1
  Al  Al249  1  0.669533  0.533399  0.573341  1
  Al  Al250  1  0.669936  0.132631  0.501356  1
  Al  Al251  1  0.335563  0.599284  0.525887  1
  Al  Al252  1  0.335203  0.198602  0.454006  1
  Al  Al253  1  0.670010  0.599284  0.525887  1
  Al  Al254  1  0.670370  0.198602  0.454006  1
  Al  Al255  1  0.672466  0.799787  0.501747  1
  Al  Al256  1  0.672115  0.399241  0.430266  1
  Al  Al257  1  0.002787  0.533115  0.454174  1
  Al  Al258  1  0.002787  0.933031  0.525461  1
  Al  Al259  1  0.002787  0.666528  0.477988  1
  Al  Al260  1  0.002787  0.066498  0.549104  1
  Al  Al261  1  0.002787  0.733447  0.549526  1
  Al  Al262  1  0.002787  0.333058  0.477809  1
  Al  Al263  1  0.002787  0.866043  0.453932  1
  Al  Al264  1  0.002787  0.266712  0.525474  1
  Al  Al265  1  0.333107  0.799787  0.501747  1
  Al  Al266  1  0.333458  0.399241  0.430266  1
  Al  Al267  1  0.170314  0.700657  0.513736  1
  Al  Al268  1  0.170362  0.300281  0.442018  1
  Al  Al269  1  0.333285  0.327659  0.709665  1
  Al  Al270  1  0.336128  0.933425  0.645249  1
  Al  Al271  1  0.327889  0.197764  0.689699  1
  Al  Al272  1  0.336078  0.801279  0.621614  1
  Al  Al273  1  0.333664  0.267556  0.644830  1
  Al  Al274  1  0.335816  0.866869  0.573768  1
  Al  Al275  1  0.171375  0.566718  0.609801  1
  Al  Al276  1  0.163160  0.968097  0.679571  1
  Al  Al277  1  0.169224  0.233354  0.608238  1
  Al  Al278  1  0.168948  0.632370  0.679282  1
  Al  Al279  1  0.842886  0.095881  0.699030  1
  Al  Al280  1  0.835794  0.699748  0.633090  1
  Al  Al281  1  0.162687  0.095881  0.699030  1
  Al  Al282  1  0.169779  0.699748  0.633090  1
  Al  Al283  1  0.170458  0.300410  0.679427  1
  Al  Al284  1  0.173814  0.900098  0.609294  1
  Al  Al285  1  0.502787  0.421539  0.700498  1
  Al  Al286  1  0.502787  0.032709  0.632923  1
  Al  Al287  1  0.502787  0.164360  0.656194  1
  Al  Al288  1  0.502787  0.766586  0.585720  1
  Al  Al289  1  0.502787  0.433792  0.585562  1
  Al  Al290  1  0.502787  0.837653  0.656386  1
  Al  Al291  1  0.502787  0.366975  0.633814  1
  Al  Al292  1  0.502787  0.773329  0.699595  1
  Al  Al293  1  0.835115  0.300410  0.679427  1
  Al  Al294  1  0.831759  0.900098  0.609294  1
  Al  Al295  1  0.677684  0.197764  0.689699  1
  Al  Al296  1  0.669495  0.801279  0.621614  1
  Al  Al297  1  0.836349  0.233354  0.608238  1
  Al  Al298  1  0.836625  0.632370  0.679282  1
  Al  Al299  1  0.833512  0.499598  0.656790  1
  Al  Al300  1  0.835193  0.100598  0.584868  1
  Al  Al301  1  0.834198  0.566718  0.609801  1
  Al  Al302  1  0.842413  0.968097  0.679571  1
  Al  Al303  1  0.671910  0.267556  0.644830  1
  Al  Al304  1  0.669757  0.866869  0.573768  1
  Al  Al305  1  0.672288  0.327659  0.709665  1
  Al  Al306  1  0.669445  0.933425  0.645249  1
  Al  Al307  1  0.334302  0.400218  0.667588  1
  Al  Al308  1  0.335203  0.999048  0.597386  1
  Al  Al309  1  0.671271  0.400218  0.667588  1
  Al  Al310  1  0.670370  0.999048  0.597386  1
  Al  Al311  1  0.671688  0.600488  0.645832  1
  Al  Al312  1  0.672051  0.199920  0.573484  1
  Al  Al313  1  0.002787  0.332839  0.597312  1
  Al  Al314  1  0.002787  0.733312  0.668464  1
  Al  Al315  1  0.002787  0.466415  0.621771  1
  Al  Al316  1  0.002787  0.866948  0.690361  1
  Al  Al317  1  0.002787  0.530936  0.688114  1
  Al  Al318  1  0.002787  0.133149  0.620243  1
  Al  Al319  1  0.002787  0.667165  0.597040  1
  Al  Al320  1  0.002787  0.069977  0.666518  1
  Al  Al321  1  0.333885  0.600488  0.645832  1
  Al  Al322  1  0.333522  0.199920  0.573484  1
  Al  Al323  1  0.172062  0.499598  0.656790  1
  Al  Al324  1  0.170380  0.100598  0.584868  1
