# generated using pymatgen
data_Mg41Al67
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.94369059
_cell_length_b   46.78623286
_cell_length_c   52.61190639
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg41Al67
_chemical_formula_sum   'Mg246 Al402'
_cell_volume   29399.5484983
_cell_formula_units_Z   6
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  0.845395  0.752121  0.301451  1
  Mg  Mg2  1  0.849005  0.981280  0.432070  1
  Mg  Mg3  1  0.851985  0.364831  0.377770  1
  Mg  Mg4  1  0.858201  0.632151  0.375156  1
  Mg  Mg5  1  0.849739  0.011603  0.310157  1
  Mg  Mg6  1  0.844664  0.250524  0.455080  1
  Mg  Mg7  1  0.338855  0.530020  0.366117  1
  Mg  Mg8  1  0.336555  0.908430  0.298337  1
  Mg  Mg9  1  0.346214  0.148946  0.439788  1
  Mg  Mg10  1  0.158028  0.555458  0.330375  1
  Mg  Mg11  1  0.169659  0.792579  0.476281  1
  Mg  Mg12  1  0.170571  0.173439  0.408238  1
  Mg  Mg13  1  0.526089  0.465271  0.291534  1
  Mg  Mg14  1  0.501498  0.710648  0.430392  1
  Mg  Mg15  1  0.513505  0.092979  0.358246  1
  Mg  Mg16  1  0.680514  0.531208  0.367246  1
  Mg  Mg17  1  0.686075  0.908196  0.298397  1
  Mg  Mg18  1  0.675590  0.148352  0.440794  1
  Mg  Mg19  1  0.342441  0.558939  0.477780  1
  Mg  Mg20  1  0.340746  0.940960  0.409247  1
  Mg  Mg21  1  0.342454  0.326415  0.360248  1
  Mg  Mg22  1  0.847805  0.679024  0.315814  1
  Mg  Mg23  1  0.849502  0.916240  0.445761  1
  Mg  Mg24  1  0.845654  0.299703  0.389447  1
  Mg  Mg25  1  0.692715  0.723539  0.338297  1
  Mg  Mg26  1  0.678396  0.955458  0.466028  1
  Mg  Mg27  1  0.682998  0.341422  0.411418  1
  Mg  Mg28  1  0.673763  0.608658  0.410542  1
  Mg  Mg29  1  0.679784  0.987050  0.346448  1
  Mg  Mg30  1  0.675693  0.225418  0.488299  1
  Mg  Mg31  1  0.503336  0.698476  0.369010  1
  Mg  Mg32  1  0.536337  0.076524  0.297441  1
  Mg  Mg33  1  0.512955  0.315911  0.445667  1
  Mg  Mg34  1  0.853327  0.648220  0.433891  1
  Mg  Mg35  1  0.847005  0.028146  0.368582  1
  Mg  Mg36  1  0.828844  0.406660  0.306244  1
  Mg  Mg37  1  0.172455  0.490231  0.347979  1
  Mg  Mg38  1  0.167858  0.726831  0.486476  1
  Mg  Mg39  1  0.170757  0.108727  0.415353  1
  Mg  Mg40  1  0.342742  0.420721  0.453997  1
  Mg  Mg41  1  0.347590  0.801646  0.383413  1
  Mg  Mg42  1  0.327102  0.184460  0.317002  1
  Mg  Mg43  1  0.844112  0.445732  0.416840  1
  Mg  Mg44  1  0.853168  0.826386  0.354010  1
  Mg  Mg45  1  0.848462  0.059813  0.479837  1
  Mg  Mg46  1  0.507178  0.425902  0.362915  1
  Mg  Mg47  1  0.537544  0.816599  0.290799  1
  Mg  Mg48  1  0.508195  0.044568  0.423833  1
  Mg  Mg49  1  0.846560  0.459924  0.474231  1
  Mg  Mg50  1  0.842039  0.840719  0.408609  1
  Mg  Mg51  1  0.842084  0.225340  0.343310  1
  Mg  Mg52  1  0.336120  0.606692  0.412597  1
  Mg  Mg53  1  0.342552  0.988166  0.345298  1
  Mg  Mg54  1  0.345704  0.226013  0.487795  1
  Mg  Mg55  1  0.674719  0.421981  0.454151  1
  Mg  Mg56  1  0.664921  0.802071  0.384896  1
  Mg  Mg57  1  0.684650  0.188658  0.316679  1
  Mg  Mg58  1  0.344029  0.484165  0.437422  1
  Mg  Mg59  1  0.350637  0.865533  0.370944  1
  Mg  Mg60  1  0.343123  0.251186  0.308941  1
  Mg  Mg61  1  0.352140  0.722525  0.326006  1
  Mg  Mg62  1  0.341889  0.954983  0.466203  1
  Mg  Mg63  1  0.334900  0.341615  0.414803  1
  Mg  Mg64  1  0.840643  0.489312  0.349429  1
  Mg  Mg65  1  0.853569  0.726977  0.485590  1
  Mg  Mg66  1  0.846321  0.108231  0.416319  1
  Mg  Mg67  1  0.856741  0.557993  0.331753  1
  Mg  Mg68  1  0.850516  0.792132  0.475218  1
  Mg  Mg69  1  0.846028  0.173709  0.408301  1
  Mg  Mg70  1  0.665691  0.671747  0.405042  1
  Mg  Mg71  1  0.673938  0.051544  0.337126  1
  Mg  Mg72  1  0.678532  0.290946  0.479882  1
  Mg  Mg73  1  0.333595  0.356482  0.470377  1
  Mg  Mg74  1  0.331193  0.737912  0.394762  1
  Mg  Mg75  1  0.333749  0.118014  0.323373  1
  Mg  Mg76  1  0.172524  0.459216  0.474201  1
  Mg  Mg77  1  0.182802  0.841875  0.408236  1
  Mg  Mg78  1  0.184614  0.223349  0.345713  1
  Mg  Mg79  1  0.672304  0.484775  0.437527  1
  Mg  Mg80  1  0.667768  0.864402  0.371940  1
  Mg  Mg81  1  0.665239  0.255291  0.310362  1
  Mg  Mg82  1  0.507311  0.621113  0.320431  1
  Mg  Mg83  1  0.511768  0.856066  0.464257  1
  Mg  Mg84  1  0.508934  0.237263  0.398751  1
  Mg  Mg85  1  0.333470  0.672763  0.402459  1
  Mg  Mg86  1  0.354432  0.052312  0.332823  1
  Mg  Mg87  1  0.345565  0.290690  0.480194  1
  Mg  Mg88  1  0.174404  0.646319  0.437745  1
  Mg  Mg89  1  0.175888  0.029757  0.366631  1
  Mg  Mg90  1  0.186381  0.408929  0.305240  1
  Mg  Mg91  1  0.511218  0.381854  0.432478  1
  Mg  Mg92  1  0.504503  0.761959  0.357790  1
  Mg  Mg93  1  0.507905  0.995731  0.487633  1
  Mg  Mg94  1  0.351265  0.510260  0.309815  1
  Mg  Mg95  1  0.336956  0.751844  0.453674  1
  Mg  Mg96  1  0.346650  0.132443  0.382766  1
  Mg  Mg97  1  0.687194  0.357120  0.469218  1
  Mg  Mg98  1  0.676709  0.737539  0.395780  1
  Mg  Mg99  1  0.693250  0.121188  0.323393  1
  Mg  Mg100  1  0.175303  0.444470  0.416460  1
  Mg  Mg101  1  0.175528  0.826041  0.351404  1
  Mg  Mg102  1  0.174565  0.060553  0.478990  1
  Mg  Mg103  1  0.145845  0.747669  0.300755  1
  Mg  Mg104  1  0.172548  0.980917  0.432198  1
  Mg  Mg105  1  0.164935  0.365966  0.379154  1
  Mg  Mg106  1  0.143093  0.679094  0.310776  1
  Mg  Mg107  1  0.170835  0.916015  0.445918  1
  Mg  Mg108  1  0.170622  0.300237  0.392303  1
  Mg  Mg109  1  1.004223  0.356692  0.470129  1
  Mg  Mg110  1  0.026830  0.737492  0.391359  1
  Mg  Mg111  1  1.002490  0.121601  0.324684  1
  Mg  Mg112  1  0.676853  0.558992  0.477383  1
  Mg  Mg113  1  0.680391  0.941043  0.409118  1
  Mg  Mg114  1  0.677256  0.323587  0.353755  1
  Mg  Mg115  1  0.172015  0.633089  0.373973  1
  Mg  Mg116  1  0.162913  0.011941  0.309821  1
  Mg  Mg117  1  0.171288  0.250918  0.455448  1
  Mg  Mg118  1  0.509061  0.397652  0.491489  1
  Mg  Mg119  1  0.504685  0.777801  0.421319  1
  Mg  Mg120  1  0.510534  0.160183  0.348603  1
  Mg  Mg121  1  0.678449  0.512163  0.310846  1
  Mg  Mg122  1  0.679926  0.751626  0.452921  1
  Mg  Mg123  1  0.677640  0.133286  0.382497  1
  Mg  Mg124  1  0.844409  0.598729  0.500096  1
  Mg  Mg125  1  0.845105  0.834754  0.642593  1
  Mg  Mg126  1  0.848661  0.217079  0.576652  1
  Mg  Mg127  1  0.843932  0.484499  0.586402  1
  Mg  Mg128  1  0.847864  0.867919  0.519556  1
  Mg  Mg129  1  0.832707  0.101764  0.646012  1
  Mg  Mg130  1  0.339927  0.385562  0.583491  1
  Mg  Mg131  1  0.338432  0.767188  0.510471  1
  Mg  Mg132  1  0.338450  0.001634  0.640112  1
  Mg  Mg133  1  0.172684  0.410710  0.547352  1
  Mg  Mg134  1  0.171245  0.646988  0.673885  1
  Mg  Mg135  1  0.173141  0.026072  0.603041  1
  Mg  Mg136  1  0.512377  0.330228  0.504858  1
  Mg  Mg137  1  0.513415  0.565580  0.629849  1
  Mg  Mg138  1  0.506753  0.944629  0.561111  1
  Mg  Mg139  1  0.676703  0.385756  0.583220  1
  Mg  Mg140  1  0.679581  0.767421  0.509723  1
  Mg  Mg141  1  0.676561  0.998280  0.632702  1
  Mg  Mg142  1  0.336726  0.417750  0.693703  1
  Mg  Mg143  1  0.336313  0.793372  0.622010  1
  Mg  Mg144  1  0.343597  0.177609  0.551040  1
  Mg  Mg145  1  0.846144  0.533399  0.513478  1
  Mg  Mg146  1  0.871174  0.768726  0.657268  1
  Mg  Mg147  1  0.848835  0.152266  0.583610  1
  Mg  Mg148  1  0.677945  0.572742  0.534906  1
  Mg  Mg149  1  0.668540  0.811260  0.679021  1
  Mg  Mg150  1  0.672043  0.193188  0.609058  1
  Mg  Mg151  1  0.675753  0.460666  0.622121  1
  Mg  Mg152  1  0.675003  0.841895  0.554616  1
  Mg  Mg153  1  0.677493  0.073751  0.683312  1
  Mg  Mg154  1  0.513563  0.547233  0.570240  1
  Mg  Mg155  1  0.509448  0.928937  0.501950  1
  Mg  Mg156  1  0.508937  0.165042  0.643326  1
  Mg  Mg157  1  0.846944  0.501482  0.645557  1
  Mg  Mg158  1  0.841925  0.881660  0.577125  1
  Mg  Mg159  1  0.844598  0.265373  0.513295  1
  Mg  Mg160  1  0.170731  0.345041  0.560312  1
  Mg  Mg161  1  0.171298  0.576865  0.684996  1
  Mg  Mg162  1  0.167763  0.960453  0.615812  1
  Mg  Mg163  1  0.345967  0.273877  0.654790  1
  Mg  Mg164  1  0.352193  0.652782  0.580687  1
  Mg  Mg165  1  0.342789  0.035338  0.512231  1
  Mg  Mg166  1  0.843075  0.295828  0.625483  1
  Mg  Mg167  1  0.840000  0.678221  0.546701  1
  Mg  Mg168  1  0.831999  0.915784  0.688072  1
  Mg  Mg169  1  0.511059  0.281679  0.567904  1
  Mg  Mg170  1  0.510360  0.663593  0.490774  1
  Mg  Mg171  1  0.511064  0.899720  0.630612  1
  Mg  Mg172  1  0.856296  0.313067  0.682296  1
  Mg  Mg173  1  0.839143  0.692420  0.605614  1
  Mg  Mg174  1  0.846840  0.075033  0.536620  1
  Mg  Mg175  1  0.345050  0.462444  0.622571  1
  Mg  Mg176  1  0.346543  0.841523  0.554694  1
  Mg  Mg177  1  0.352795  0.069586  0.681878  1
  Mg  Mg178  1  0.664108  0.273068  0.659323  1
  Mg  Mg179  1  0.678523  0.652354  0.582207  1
  Mg  Mg180  1  0.673899  0.035264  0.512184  1
  Mg  Mg181  1  0.340150  0.338508  0.645824  1
  Mg  Mg182  1  0.351599  0.716966  0.572592  1
  Mg  Mg183  1  0.344533  0.100553  0.503731  1
  Mg  Mg184  1  0.344152  0.573856  0.534370  1
  Mg  Mg185  1  0.345929  0.810675  0.678615  1
  Mg  Mg186  1  0.341485  0.192137  0.609538  1
  Mg  Mg187  1  0.846909  0.345756  0.560265  1
  Mg  Mg188  1  0.875370  0.581989  0.686919  1
  Mg  Mg189  1  0.857686  0.959987  0.614552  1
  Mg  Mg190  1  0.848443  0.410813  0.547220  1
  Mg  Mg191  1  0.878159  0.648611  0.677699  1
  Mg  Mg192  1  0.851020  0.025013  0.600679  1
  Mg  Mg193  1  0.678029  0.524385  0.608515  1
  Mg  Mg194  1  0.676051  0.906013  0.539932  1
  Mg  Mg195  1  0.692218  0.140695  0.675008  1
  Mg  Mg196  1  0.325911  0.203881  0.668587  1
  Mg  Mg197  1  0.337352  0.588398  0.591359  1
  Mg  Mg198  1  0.331979  0.969254  0.523671  1
  Mg  Mg199  1  0.170887  0.313529  0.681949  1
  Mg  Mg200  1  0.172988  0.692984  0.603831  1
  Mg  Mg201  1  0.174130  0.075643  0.536758  1
  Mg  Mg202  1  0.676272  0.337242  0.646936  1
  Mg  Mg203  1  0.672784  0.718247  0.571643  1
  Mg  Mg204  1  0.673787  0.100143  0.503947  1
  Mg  Mg205  1  0.506333  0.472242  0.530435  1
  Mg  Mg206  1  0.507554  0.703118  0.664488  1
  Mg  Mg207  1  0.510822  0.087780  0.593718  1
  Mg  Mg208  1  0.348650  0.523833  0.607165  1
  Mg  Mg209  1  0.344394  0.904527  0.539505  1
  Mg  Mg210  1  0.335876  0.136331  0.675425  1
  Mg  Mg211  1  0.163570  0.500862  0.644346  1
  Mg  Mg212  1  0.175796  0.880216  0.576678  1
  Mg  Mg213  1  0.169213  0.266346  0.512013  1
  Mg  Mg214  1  0.505582  0.232464  0.633695  1
  Mg  Mg215  1  0.516185  0.613795  0.556083  1
  Mg  Mg216  1  0.503462  0.857110  0.699155  1
  Mg  Mg217  1  0.341251  0.370685  0.526638  1
  Mg  Mg218  1  0.319576  0.603665  0.647249  1
  Mg  Mg219  1  0.333467  0.984827  0.581277  1
  Mg  Mg220  1  0.685447  0.207228  0.668538  1
  Mg  Mg221  1  0.689651  0.588616  0.593658  1
  Mg  Mg222  1  0.685628  0.969528  0.522659  1
  Mg  Mg223  1  0.172860  0.297496  0.623436  1
  Mg  Mg224  1  0.171586  0.676298  0.548870  1
  Mg  Mg225  1  0.189210  0.916361  0.687596  1
  Mg  Mg226  1  0.167504  0.598587  0.501436  1
  Mg  Mg227  1  0.175585  0.835072  0.641882  1
  Mg  Mg228  1  0.173906  0.217700  0.575523  1
  Mg  Mg229  1  0.170590  0.534341  0.513862  1
  Mg  Mg230  1  0.148780  0.768503  0.656512  1
  Mg  Mg231  1  0.173658  0.151884  0.583694  1
  Mg  Mg232  1  0.017107  0.203536  0.667175  1
  Mg  Mg233  1  0.994287  0.587768  0.595187  1
  Mg  Mg234  1  0.014718  0.969417  0.522976  1
  Mg  Mg235  1  0.681296  0.416386  0.693888  1
  Mg  Mg236  1  0.683250  0.793541  0.622476  1
  Mg  Mg237  1  0.672335  0.176894  0.552209  1
  Mg  Mg238  1  0.168822  0.487204  0.587378  1
  Mg  Mg239  1  0.170548  0.867087  0.519473  1
  Mg  Mg240  1  0.178570  0.099968  0.648555  1
  Mg  Mg241  1  0.482040  0.248634  0.694651  1
  Mg  Mg242  1  0.514524  0.627813  0.617835  1
  Mg  Mg243  1  0.506688  0.010161  0.547057  1
  Mg  Mg244  1  0.676240  0.371686  0.526686  1
  Mg  Mg245  1  0.678514  0.606279  0.658798  1
  Mg  Mg246  1  0.684550  0.984252  0.578439  1
  Al  Al247  1  1.006465  0.558470  0.476498  1
  Al  Al248  1  0.011171  0.940046  0.408508  1
  Al  Al249  1  0.014341  0.323716  0.355901  1
  Al  Al250  1  0.671584  0.496474  0.493889  1
  Al  Al251  1  0.672899  0.879698  0.427548  1
  Al  Al252  1  0.675383  0.261342  0.366685  1
  Al  Al253  1  0.170579  0.507472  0.403310  1
  Al  Al254  1  0.175844  0.888090  0.336420  1
  Al  Al255  1  0.170845  0.125640  0.472038  1
  Al  Al256  1  0.776945  0.619383  0.320541  1
  Al  Al257  1  0.839138  0.854969  0.463574  1
  Al  Al258  1  0.836993  0.236663  0.399057  1
  Al  Al259  1  0.844311  0.398322  0.491174  1
  Al  Al260  1  0.849603  0.777503  0.417268  1
  Al  Al261  1  0.844990  0.161530  0.352761  1
  Al  Al262  1  0.650936  0.574103  0.306640  1
  Al  Al263  1  0.676566  0.816632  0.443026  1
  Al  Al264  1  0.674322  0.198597  0.375273  1
  Al  Al265  1  0.011611  0.671243  0.353625  1
  Al  Al266  1  0.009782  0.892054  0.482806  1
  Al  Al267  1  1.006906  0.274748  0.422844  1
  Al  Al268  1  0.162189  0.469623  0.297598  1
  Al  Al269  1  0.174505  0.711438  0.430855  1
  Al  Al270  1  0.173127  0.093562  0.359480  1
  Al  Al271  1  0.507110  0.568496  0.390691  1
  Al  Al272  1  0.511158  0.946726  0.323749  1
  Al  Al273  1  0.510186  0.187920  0.463280  1
  Al  Al274  1  0.232203  0.618310  0.320629  1
  Al  Al275  1  0.179954  0.854864  0.463547  1
  Al  Al276  1  0.182402  0.236839  0.400159  1
  Al  Al277  1  0.840568  0.697185  0.374668  1
  Al  Al278  1  0.847204  0.075163  0.309041  1
  Al  Al279  1  0.844417  0.314508  0.445750  1
  Al  Al280  1  0.024995  0.675858  0.403975  1
  Al  Al281  1  1.002897  0.055450  0.338380  1
  Al  Al282  1  1.002720  0.292872  0.479130  1
  Al  Al283  1  0.838233  0.426711  0.361768  1
  Al  Al284  1  0.844945  0.814489  0.300060  1
  Al  Al285  1  0.841220  0.044616  0.424101  1
  Al  Al286  1  0.343393  0.449307  0.328067  1
  Al  Al287  1  0.333454  0.686570  0.461870  1
  Al  Al288  1  0.340267  0.068467  0.390881  1
  Al  Al289  1  0.674414  0.624178  0.465827  1
  Al  Al290  1  0.672509  0.005378  0.400634  1
  Al  Al291  1  0.677210  0.386541  0.344698  1
  Al  Al292  1  0.341334  0.544613  0.422540  1
  Al  Al293  1  0.344350  0.925398  0.354053  1
  Al  Al294  1  0.338717  0.314048  0.307382  1
  Al  Al295  1  0.340081  0.404092  0.396685  1
  Al  Al296  1  0.347324  0.787897  0.321838  1
  Al  Al297  1  0.338633  0.020555  0.455088  1
  Al  Al298  1  1.006935  0.622638  0.468308  1
  Al  Al299  1  0.012926  0.004937  0.399817  1
  Al  Al300  1  0.010486  0.389142  0.341976  1
  Al  Al301  1  0.997619  0.506751  0.313661  1
  Al  Al302  1  0.011771  0.752205  0.448646  1
  Al  Al303  1  1.005331  0.133264  0.380506  1
  Al  Al304  1  1.005087  0.624001  0.324384  1
  Al  Al305  1  0.011223  0.817839  0.441757  1
  Al  Al306  1  1.008917  0.199986  0.376760  1
  Al  Al307  1  0.168813  0.521418  0.457022  1
  Al  Al308  1  0.172829  0.902919  0.389046  1
  Al  Al309  1  0.178336  0.287314  0.336942  1
  Al  Al310  1  0.994691  0.725438  0.338422  1
  Al  Al311  1  0.010769  0.956444  0.468572  1
  Al  Al312  1  1.007219  0.340454  0.415730  1
  Al  Al313  1  0.016843  0.605236  0.412967  1
  Al  Al314  1  1.009443  0.986103  0.345321  1
  Al  Al315  1  1.006379  0.223578  0.488540  1
  Al  Al316  1  0.191935  0.700938  0.363104  1
  Al  Al317  1  0.157113  0.075520  0.310177  1
  Al  Al318  1  0.168495  0.314296  0.448431  1
  Al  Al319  1  0.365102  0.573168  0.306832  1
  Al  Al320  1  0.342851  0.817379  0.443646  1
  Al  Al321  1  0.346790  0.196706  0.376763  1
  Al  Al322  1  0.669951  0.657363  0.350946  1
  Al  Al323  1  0.683445  0.892643  0.482945  1
  Al  Al324  1  0.675931  0.275235  0.422368  1
  Al  Al325  1  0.344452  0.621834  0.470015  1
  Al  Al326  1  0.345059  0.004833  0.400320  1
  Al  Al327  1  0.339044  0.387574  0.343531  1
  Al  Al328  1  0.506914  0.460923  0.475048  1
  Al  Al329  1  0.505655  0.842144  0.409657  1
  Al  Al330  1  0.503691  0.224038  0.344056  1
  Al  Al331  1  0.172176  0.397395  0.491092  1
  Al  Al332  1  0.177460  0.779212  0.420015  1
  Al  Al333  1  0.173208  0.158043  0.353477  1
  Al  Al334  1  0.494013  0.632124  0.376539  1
  Al  Al335  1  0.519122  0.009316  0.311639  1
  Al  Al336  1  0.512559  0.250792  0.454042  1
  Al  Al337  1  0.344277  0.496928  0.493927  1
  Al  Al338  1  0.348605  0.880476  0.427822  1
  Al  Al339  1  0.341374  0.262213  0.367823  1
  Al  Al340  1  1.009252  0.545267  0.423071  1
  Al  Al341  1  0.011674  0.925520  0.356067  1
  Al  Al342  1  0.022886  0.311006  0.305480  1
  Al  Al343  1  1.007420  0.406922  0.396685  1
  Al  Al344  1  1.008130  0.786274  0.331917  1
  Al  Al345  1  0.011350  0.020938  0.455498  1
  Al  Al346  1  1.006917  0.529429  0.370203  1
  Al  Al347  1  0.010528  0.909622  0.305234  1
  Al  Al348  1  1.007770  0.148926  0.442795  1
  Al  Al349  1  0.849316  0.521623  0.456482  1
  Al  Al350  1  0.849747  0.901565  0.389135  1
  Al  Al351  1  0.856425  0.286761  0.334553  1
  Al  Al352  1  0.347393  0.661455  0.343163  1
  Al  Al353  1  0.337718  0.891861  0.482769  1
  Al  Al354  1  0.345201  0.275775  0.423111  1
  Al  Al355  1  0.847449  0.508104  0.403844  1
  Al  Al356  1  0.847669  0.888028  0.337309  1
  Al  Al357  1  0.849407  0.124823  0.473054  1
  Al  Al358  1  1.006385  0.446630  0.329635  1
  Al  Al359  1  0.010084  0.686278  0.461920  1
  Al  Al360  1  0.009622  0.068478  0.392609  1
  Al  Al361  1  0.507284  0.444779  0.416041  1
  Al  Al362  1  0.506012  0.825287  0.345492  1
  Al  Al363  1  0.506955  0.061109  0.478308  1
  Al  Al364  1  0.513549  0.488328  0.347369  1
  Al  Al365  1  0.506594  0.727869  0.486068  1
  Al  Al366  1  0.513488  0.107616  0.416677  1
  Al  Al367  1  0.010167  0.496634  0.493706  1
  Al  Al368  1  0.010579  0.878094  0.426738  1
  Al  Al369  1  0.012221  0.260944  0.368019  1
  Al  Al370  1  0.013608  0.588458  0.362031  1
  Al  Al371  1  1.008792  0.966608  0.294303  1
  Al  Al372  1  1.008995  0.212247  0.431947  1
  Al  Al373  1  0.665805  0.593362  0.357332  1
  Al  Al374  1  0.673581  0.969863  0.294046  1
  Al  Al375  1  0.676014  0.212012  0.431682  1
  Al  Al376  1  0.543520  0.683432  0.315714  1
  Al  Al377  1  0.511513  0.916407  0.445151  1
  Al  Al378  1  0.513904  0.300295  0.390730  1
  Al  Al379  1  0.347581  0.591578  0.356908  1
  Al  Al380  1  0.349596  0.971036  0.294165  1
  Al  Al381  1  0.343326  0.212205  0.431899  1
  Al  Al382  1  0.545228  0.754843  0.304249  1
  Al  Al383  1  0.509460  0.980989  0.431286  1
  Al  Al384  1  0.512814  0.365047  0.377866  1
  Al  Al385  1  0.495578  0.645447  0.437059  1
  Al  Al386  1  0.507491  0.027139  0.369380  1
  Al  Al387  1  0.510483  0.407687  0.311215  1
  Al  Al388  1  0.510661  0.553276  0.337670  1
  Al  Al389  1  0.508764  0.793243  0.476932  1
  Al  Al390  1  0.513765  0.174275  0.406889  1
  Al  Al391  1  0.174795  0.566657  0.390108  1
  Al  Al392  1  0.176071  0.947592  0.323944  1
  Al  Al393  1  0.171888  0.186945  0.464854  1
  Al  Al394  1  0.846087  0.383774  0.432853  1
  Al  Al395  1  0.843703  0.763909  0.361796  1
  Al  Al396  1  0.847733  0.996141  0.488128  1
  Al  Al397  1  0.677086  0.447878  0.330202  1
  Al  Al398  1  0.685508  0.687823  0.460103  1
  Al  Al399  1  0.680250  0.068262  0.392754  1
  Al  Al400  1  0.181020  0.427506  0.360979  1
  Al  Al401  1  0.161993  0.811912  0.299166  1
  Al  Al402  1  0.180868  0.044767  0.423230  1
  Al  Al403  1  0.168053  0.383045  0.434201  1
  Al  Al404  1  0.190738  0.762350  0.354384  1
  Al  Al405  1  0.175897  0.996444  0.487691  1
  Al  Al406  1  0.839807  0.467107  0.297873  1
  Al  Al407  1  0.852386  0.712523  0.428060  1
  Al  Al408  1  0.842586  0.092958  0.360187  1
  Al  Al409  1  0.670217  0.467485  0.382531  1
  Al  Al410  1  0.685763  0.850041  0.319497  1
  Al  Al411  1  0.673333  0.083782  0.448383  1
  Al  Al412  1  0.676003  0.545801  0.422540  1
  Al  Al413  1  0.676861  0.924506  0.354381  1
  Al  Al414  1  0.675784  0.162869  0.496273  1
  Al  Al415  1  0.509358  0.583345  0.444540  1
  Al  Al416  1  0.509451  0.964209  0.377117  1
  Al  Al417  1  0.502519  0.351783  0.325867  1
  Al  Al418  1  1.008228  0.419159  0.453964  1
  Al  Al419  1  0.019890  0.800231  0.386724  1
  Al  Al420  1  0.014862  0.186753  0.325067  1
  Al  Al421  1  0.010841  0.485505  0.437071  1
  Al  Al422  1  0.015360  0.866802  0.371734  1
  Al  Al423  1  0.025218  0.252434  0.314876  1
  Al  Al424  1  0.168587  0.581347  0.445566  1
  Al  Al425  1  0.169225  0.964079  0.376049  1
  Al  Al426  1  0.171937  0.349140  0.324947  1
  Al  Al427  1  0.508435  0.522019  0.457285  1
  Al  Al428  1  0.510432  0.903971  0.390063  1
  Al  Al429  1  0.500017  0.285637  0.339104  1
  Al  Al430  1  0.679206  0.405658  0.397032  1
  Al  Al431  1  0.684117  0.789756  0.329760  1
  Al  Al432  1  0.680519  0.020460  0.455562  1
  Al  Al433  1  0.345572  0.467549  0.381410  1
  Al  Al434  1  0.341901  0.848035  0.315878  1
  Al  Al435  1  0.346352  0.085014  0.446861  1
  Al  Al436  1  0.847979  0.583298  0.443591  1
  Al  Al437  1  0.853860  0.962952  0.376534  1
  Al  Al438  1  0.859789  0.347397  0.324476  1
  Al  Al439  1  0.845200  0.568242  0.390635  1
  Al  Al440  1  0.845094  0.947102  0.324395  1
  Al  Al441  1  0.846855  0.186589  0.465213  1
  Al  Al442  1  0.009831  0.466968  0.382071  1
  Al  Al443  1  0.010302  0.851169  0.317785  1
  Al  Al444  1  0.010171  0.084839  0.448173  1
  Al  Al445  1  0.508348  0.507545  0.401474  1
  Al  Al446  1  0.510734  0.886784  0.333538  1
  Al  Al447  1  0.509361  0.124751  0.472189  1
  Al  Al448  1  1.008175  0.414077  0.687556  1
  Al  Al449  1  1.009221  0.794612  0.617942  1
  Al  Al450  1  0.012477  0.176988  0.549200  1
  Al  Al451  1  0.669657  0.353807  0.698174  1
  Al  Al452  1  0.670658  0.731767  0.628162  1
  Al  Al453  1  0.675174  0.113540  0.560121  1
  Al  Al454  1  0.166427  0.362756  0.615871  1
  Al  Al455  1  0.169232  0.741740  0.543851  1
  Al  Al456  1  0.158074  0.976177  0.669198  1
  Al  Al457  1  0.840224  0.472120  0.530365  1
  Al  Al458  1  0.814199  0.705867  0.658774  1
  Al  Al459  1  0.835989  0.088560  0.591841  1
  Al  Al460  1  0.862337  0.249654  0.681645  1
  Al  Al461  1  0.839868  0.629687  0.622414  1
  Al  Al462  1  0.850296  0.011618  0.544466  1
  Al  Al463  1  0.679407  0.435522  0.511169  1
  Al  Al464  1  0.674484  0.666144  0.641440  1
  Al  Al465  1  0.675081  0.049623  0.569568  1
  Al  Al466  1  1.008525  0.509204  0.549703  1
  Al  Al467  1  0.010692  0.710847  0.676740  1
  Al  Al468  1  0.010072  0.125324  0.615183  1
  Al  Al469  1  0.170937  0.329931  0.504394  1
  Al  Al470  1  0.175731  0.561592  0.625923  1
  Al  Al471  1  0.173155  0.942096  0.560328  1
  Al  Al472  1  0.507955  0.423294  0.603231  1
  Al  Al473  1  0.510200  0.804322  0.532250  1
  Al  Al474  1  0.518934  0.039411  0.653371  1
  Al  Al475  1  0.179566  0.472581  0.530755  1
  Al  Al476  1  0.204738  0.705777  0.657511  1
  Al  Al477  1  0.182674  0.088918  0.592897  1
  Al  Al478  1  0.841315  0.546492  0.569726  1
  Al  Al479  1  0.847391  0.929400  0.502281  1
  Al  Al480  1  0.845977  0.167253  0.638383  1
  Al  Al481  1  0.998404  0.526615  0.605947  1
  Al  Al482  1  0.010603  0.907345  0.539984  1
  Al  Al483  1  1.003433  0.137990  0.666830  1
  Al  Al484  1  0.838527  0.281370  0.568901  1
  Al  Al485  1  0.839350  0.662403  0.491128  1
  Al  Al486  1  0.837976  0.898123  0.632228  1
  Al  Al487  1  0.338199  0.305712  0.536427  1
  Al  Al488  1  0.343297  0.538368  0.661483  1
  Al  Al489  1  0.339691  0.920256  0.596684  1
  Al  Al490  1  0.667070  0.476888  0.675357  1
  Al  Al491  1  0.671386  0.857696  0.610666  1
  Al  Al492  1  0.672836  0.240860  0.545289  1
  Al  Al493  1  0.342140  0.401310  0.638120  1
  Al  Al494  1  0.341805  0.780121  0.565740  1
  Al  Al495  1  0.343510  0.163205  0.495586  1
  Al  Al496  1  0.339512  0.257596  0.599052  1
  Al  Al497  1  0.340161  0.638091  0.524004  1
  Al  Al498  1  0.342974  0.875880  0.662581  1
  Al  Al499  1  1.007307  0.470298  0.676182  1
  Al  Al500  1  1.008814  0.858255  0.610016  1
  Al  Al501  1  1.009246  0.241122  0.543917  1
  Al  Al502  1  0.009561  0.370661  0.524373  1
  Al  Al503  1  0.020373  0.606050  0.647673  1
  Al  Al504  1  0.014089  0.985344  0.577319  1
  Al  Al505  1  0.009981  0.435385  0.510868  1
  Al  Al506  1  0.011046  0.669552  0.637527  1
  Al  Al507  1  0.011987  0.051228  0.569282  1
  Al  Al508  1  0.175179  0.378198  0.668191  1
  Al  Al509  1  0.171321  0.756200  0.597319  1
  Al  Al510  1  0.172560  0.139388  0.526708  1
  Al  Al511  1  1.004157  0.573877  0.538230  1
  Al  Al512  1  0.014063  0.818244  0.677881  1
  Al  Al513  1  0.014677  0.192316  0.611360  1
  Al  Al514  1  1.004671  0.459142  0.623184  1
  Al  Al515  1  1.007440  0.840427  0.554982  1
  Al  Al516  1  0.994090  0.073800  0.676387  1
  Al  Al517  1  0.169650  0.548793  0.570463  1
  Al  Al518  1  0.174981  0.928397  0.502262  1
  Al  Al519  1  0.174239  0.163482  0.639334  1
  Al  Al520  1  0.336971  0.435084  0.511149  1
  Al  Al521  1  0.343289  0.667716  0.635824  1
  Al  Al522  1  0.342780  0.050893  0.569597  1
  Al  Al523  1  0.679592  0.508564  0.549842  1
  Al  Al524  1  0.670189  0.746746  0.678133  1
  Al  Al525  1  0.672208  0.128859  0.615030  1
  Al  Al526  1  0.351819  0.478103  0.674679  1
  Al  Al527  1  0.349580  0.857733  0.610119  1
  Al  Al528  1  0.345904  0.242495  0.543107  1
  Al  Al529  1  0.499439  0.316014  0.680705  1
  Al  Al530  1  0.517264  0.692942  0.608515  1
  Al  Al531  1  0.508578  0.075337  0.538216  1
  Al  Al532  1  0.172484  0.250055  0.682816  1
  Al  Al533  1  0.167516  0.631230  0.613277  1
  Al  Al534  1  0.174441  0.012184  0.546134  1
  Al  Al535  1  0.514385  0.484104  0.585663  1
  Al  Al536  1  0.512298  0.865963  0.518674  1
  Al  Al537  1  0.515938  0.100913  0.648182  1
  Al  Al538  1  0.345696  0.355743  0.698376  1
  Al  Al539  1  0.349465  0.731324  0.627506  1
  Al  Al540  1  0.344194  0.113755  0.560326  1
  Al  Al541  1  1.008663  0.400057  0.636731  1
  Al  Al542  1  1.008935  0.779945  0.565405  1
  Al  Al543  1  0.009627  0.162981  0.495989  1
  Al  Al544  1  0.009886  0.257354  0.599324  1
  Al  Al545  1  1.006641  0.638706  0.523795  1
  Al  Al546  1  0.010818  0.877416  0.663437  1
  Al  Al547  1  0.009993  0.386065  0.584024  1
  Al  Al548  1  0.010795  0.767409  0.512392  1
  Al  Al549  1  1.007806  0.001967  0.638203  1
  Al  Al550  1  0.843180  0.377280  0.668421  1
  Al  Al551  1  0.846877  0.756471  0.597549  1
  Al  Al552  1  0.847189  0.139011  0.527096  1
  Al  Al553  1  0.337628  0.510202  0.550152  1
  Al  Al554  1  0.346764  0.746374  0.677749  1
  Al  Al555  1  0.345448  0.126648  0.616721  1
  Al  Al556  1  0.850006  0.361641  0.616218  1
  Al  Al557  1  0.849689  0.743357  0.542373  1
  Al  Al558  1  0.849355  0.976406  0.668638  1
  Al  Al559  1  1.007549  0.305413  0.536718  1
  Al  Al560  1  1.008555  0.546168  0.655360  1
  Al  Al561  1  0.011923  0.918633  0.596777  1
  Al  Al562  1  0.511923  0.298578  0.622485  1
  Al  Al563  1  0.516823  0.678381  0.545824  1
  Al  Al564  1  0.509487  0.916666  0.682452  1
  Al  Al565  1  0.509446  0.345280  0.561124  1
  Al  Al566  1  0.478894  0.578992  0.681462  1
  Al  Al567  1  0.501077  0.960614  0.615692  1
  Al  Al568  1  0.011075  0.357784  0.698096  1
  Al  Al569  1  1.008321  0.729982  0.627550  1
  Al  Al570  1  0.010038  0.113554  0.560023  1
  Al  Al571  1  0.010869  0.448259  0.566997  1
  Al  Al572  1  1.008575  0.830251  0.497990  1
  Al  Al573  1  1.007123  0.064856  0.623903  1
  Al  Al574  1  0.671912  0.446855  0.565953  1
  Al  Al575  1  0.676950  0.830246  0.498333  1
  Al  Al576  1  0.678364  0.062162  0.624607  1
  Al  Al577  1  0.509734  0.533041  0.513139  1
  Al  Al578  1  0.508812  0.769207  0.650980  1
  Al  Al579  1  0.504783  0.151060  0.584963  1
  Al  Al580  1  0.343357  0.448957  0.567432  1
  Al  Al581  1  0.344565  0.830493  0.498672  1
  Al  Al582  1  0.343374  0.063575  0.625701  1
  Al  Al583  1  0.514975  0.599850  0.499218  1
  Al  Al584  1  0.508536  0.835573  0.642927  1
  Al  Al585  1  0.504576  0.218452  0.575180  1
  Al  Al586  1  0.515306  0.501924  0.645256  1
  Al  Al587  1  0.511872  0.881297  0.577186  1
  Al  Al588  1  0.514188  0.264928  0.513507  1
  Al  Al589  1  0.504933  0.411467  0.548089  1
  Al  Al590  1  0.478664  0.640231  0.670453  1
  Al  Al591  1  0.502674  0.024716  0.602174  1
  Al  Al592  1  0.169458  0.424394  0.604046  1
  Al  Al593  1  0.169412  0.804517  0.533542  1
  Al  Al594  1  0.160331  0.038589  0.658161  1
  Al  Al595  1  0.846107  0.231905  0.632423  1
  Al  Al596  1  0.842748  0.613973  0.555634  1
  Al  Al597  1  0.844135  0.854459  0.693826  1
  Al  Al598  1  0.681582  0.305725  0.537143  1
  Al  Al599  1  0.670777  0.541627  0.666150  1
  Al  Al600  1  0.678423  0.922696  0.597335  1
  Al  Al601  1  0.178095  0.281459  0.567851  1
  Al  Al602  1  0.177674  0.662261  0.493029  1
  Al  Al603  1  0.181037  0.898275  0.631810  1
  Al  Al604  1  0.177140  0.232591  0.631701  1
  Al  Al605  1  0.166240  0.613184  0.558218  1
  Al  Al606  1  0.181343  0.855234  0.693741  1
  Al  Al607  1  0.842894  0.329970  0.505082  1
  Al  Al608  1  0.829577  0.565847  0.632745  1
  Al  Al609  1  0.851675  0.943203  0.559395  1
  Al  Al610  1  0.674298  0.321511  0.591735  1
  Al  Al611  1  0.672236  0.703680  0.514520  1
  Al  Al612  1  0.680881  0.937931  0.650188  1
  Al  Al613  1  0.675688  0.400142  0.638225  1
  Al  Al614  1  0.678052  0.780692  0.565562  1
  Al  Al615  1  0.674991  0.010910  0.685071  1
  Al  Al616  1  0.509576  0.437782  0.657359  1
  Al  Al617  1  0.510551  0.817506  0.588872  1
  Al  Al618  1  0.509872  0.201318  0.519630  1
  Al  Al619  1  0.016853  0.269884  0.653511  1
  Al  Al620  1  0.996194  0.650705  0.582443  1
  Al  Al621  1  0.014195  0.033209  0.512977  1
  Al  Al622  1  0.010364  0.339267  0.646912  1
  Al  Al623  1  1.003271  0.718928  0.572622  1
  Al  Al624  1  0.011538  0.102364  0.503446  1
  Al  Al625  1  0.174346  0.437556  0.656256  1
  Al  Al626  1  0.169994  0.817155  0.586573  1
  Al  Al627  1  0.169919  0.201351  0.518674  1
  Al  Al628  1  0.508374  0.378583  0.668590  1
  Al  Al629  1  0.510573  0.756919  0.596500  1
  Al  Al630  1  0.509145  0.138225  0.528395  1
  Al  Al631  1  0.678568  0.257406  0.601028  1
  Al  Al632  1  0.679792  0.638634  0.522480  1
  Al  Al633  1  0.675999  0.875443  0.663674  1
  Al  Al634  1  0.346872  0.320863  0.591467  1
  Al  Al635  1  0.345753  0.702042  0.516777  1
  Al  Al636  1  0.339794  0.938202  0.649854  1
  Al  Al637  1  0.842092  0.436902  0.656412  1
  Al  Al638  1  0.848344  0.817554  0.586770  1
  Al  Al639  1  0.848435  0.200145  0.520146  1
  Al  Al640  1  0.848912  0.422378  0.603703  1
  Al  Al641  1  0.849599  0.804603  0.532757  1
  Al  Al642  1  0.842752  0.037313  0.656151  1
  Al  Al643  1  1.006440  0.320995  0.592382  1
  Al  Al644  1  0.010088  0.702139  0.517978  1
  Al  Al645  1  1.009143  0.934828  0.651483  1
  Al  Al646  1  0.509879  0.362021  0.615369  1
  Al  Al647  1  0.509545  0.742993  0.540457  1
  Al  Al648  1  0.515017  0.972763  0.667342  1
