# generated using pymatgen
data_Mg41Al67
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.03441330
_cell_length_b   39.32412050
_cell_length_c   49.84692798
_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   23589.6957123
_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  0.825296  0.755701  0.308477  1
  Mg  Mg2  1  0.840385  0.460499  0.394586  1
  Mg  Mg3  1  0.841477  0.166200  0.474119  1
  Mg  Mg4  1  0.854069  0.585777  0.314327  1
  Mg  Mg5  1  0.847144  0.291327  0.391325  1
  Mg  Mg6  1  0.846638  -0.005105  0.475215  1
  Mg  Mg7  1  0.336593  0.611836  0.496557  1
  Mg  Mg8  1  0.339426  0.207009  0.323393  1
  Mg  Mg9  1  0.336722  0.908667  0.407361  1
  Mg  Mg10  1  0.171835  0.664184  0.481144  1
  Mg  Mg11  1  0.185146  0.258509  0.310196  1
  Mg  Mg12  1  0.166995  0.959558  0.392273  1
  Mg  Mg13  1  0.500673  0.621549  0.397458  1
  Mg  Mg14  1  0.500765  0.326206  0.478587  1
  Mg  Mg15  1  0.495077  0.918617  0.307304  1
  Mg  Mg16  1  0.669525  0.613210  0.496050  1
  Mg  Mg17  1  0.663091  0.208627  0.321998  1
  Mg  Mg18  1  0.668707  0.909681  0.406981  1
  Mg  Mg19  1  0.371903  0.739141  0.267232  1
  Mg  Mg20  1  0.344179  0.439017  0.351862  1
  Mg  Mg21  1  0.341225  0.144350  0.431148  1
  Mg  Mg22  1  0.821988  0.684379  0.278214  1
  Mg  Mg23  1  0.840598  0.389487  0.365360  1
  Mg  Mg24  1  0.839523  0.094263  0.445019  1
  Mg  Mg25  1  0.670508  0.702762  0.323267  1
  Mg  Mg26  1  0.678514  0.408763  0.408556  1
  Mg  Mg27  1  0.678262  0.114855  0.487963  1
  Mg  Mg28  1  0.671093  0.537754  0.326680  1
  Mg  Mg29  1  0.669811  0.242531  0.405150  1
  Mg  Mg30  1  0.669018  0.946376  0.489238  1
  Mg  Mg31  1  0.506902  0.651875  0.339641  1
  Mg  Mg32  1  0.506435  0.359465  0.420635  1
  Mg  Mg33  1  0.506500  0.065266  0.500964  1
  Mg  Mg34  1  0.848772  0.554092  0.369542  1
  Mg  Mg35  1  0.848837  0.261364  0.448029  1
  Mg  Mg36  1  0.853932  0.845852  0.281615  1
  Mg  Mg37  1  0.171283  0.592027  0.453917  1
  Mg  Mg38  1  0.178522  0.189991  0.278524  1
  Mg  Mg39  1  0.169168  0.887961  0.366184  1
  Mg  Mg40  1  0.340689  0.743522  0.409695  1
  Mg  Mg41  1  0.340927  0.448347  0.493537  1
  Mg  Mg42  1  0.349266  0.039253  0.325137  1
  Mg  Mg43  1  0.841350  0.793428  0.393995  1
  Mg  Mg44  1  0.841112  0.497989  0.479898  1
  Mg  Mg45  1  0.844299  0.093276  0.313936  1
  Mg  Mg46  1  0.504592  0.822095  0.341052  1
  Mg  Mg47  1  0.504963  0.526215  0.424389  1
  Mg  Mg48  1  0.480238  0.121236  0.253620  1
  Mg  Mg49  1  0.840107  0.761196  0.452364  1
  Mg  Mg50  1  0.834556  0.354240  0.280611  1
  Mg  Mg51  1  0.834312  0.055511  0.366819  1
  Mg  Mg52  1  0.334913  0.536428  0.326587  1
  Mg  Mg53  1  0.335926  0.240714  0.405533  1
  Mg  Mg54  1  0.336876  0.944835  0.489415  1
  Mg  Mg55  1  0.680832  0.741342  0.409959  1
  Mg  Mg56  1  0.678169  0.446107  0.494043  1
  Mg  Mg57  1  0.671625  0.038528  0.324420  1
  Mg  Mg58  1  0.341985  0.811036  0.436972  1
  Mg  Mg59  1  0.354111  0.403261  0.266980  1
  Mg  Mg60  1  0.345560  0.107030  0.352378  1
  Mg  Mg61  1  0.349849  0.704667  0.323033  1
  Mg  Mg62  1  0.341298  0.410994  0.407972  1
  Mg  Mg63  1  0.341515  0.116885  0.487379  1
  Mg  Mg64  1  0.848415  0.594071  0.453266  1
  Mg  Mg65  1  0.854734  0.191914  0.278106  1
  Mg  Mg66  1  0.850001  0.888687  0.365381  1
  Mg  Mg67  1  0.845595  0.662016  0.481794  1
  Mg  Mg68  1  0.841107  0.254603  0.311857  1
  Mg  Mg69  1  0.847141  0.957048  0.393022  1
  Mg  Mg70  1  0.677394  0.603579  0.355362  1
  Mg  Mg71  1  0.671485  0.308581  0.435118  1
  Mg  Mg72  1  0.670675  0.893427  0.267879  1
  Mg  Mg73  1  0.328544  0.675516  0.380869  1
  Mg  Mg74  1  0.329631  0.379824  0.464247  1
  Mg  Mg75  1  0.327432  0.975384  0.291089  1
  Mg  Mg76  1  0.164190  0.762686  0.451870  1
  Mg  Mg77  1  0.158669  0.359193  0.278542  1
  Mg  Mg78  1  0.168705  0.054787  0.366188  1
  Mg  Mg79  1  0.675153  0.813439  0.436121  1
  Mg  Mg80  1  0.671466  0.407988  0.266371  1
  Mg  Mg81  1  0.668583  0.110013  0.349771  1
  Mg  Mg82  1  0.502723  0.614014  0.255687  1
  Mg  Mg83  1  0.503070  0.324551  0.336943  1
  Mg  Mg84  1  0.507218  0.024941  0.420874  1
  Mg  Mg85  1  0.328293  0.605860  0.354713  1
  Mg  Mg86  1  0.332540  0.311271  0.434424  1
  Mg  Mg87  1  0.315067  0.903516  0.266314  1
  Mg  Mg88  1  0.169633  0.553136  0.369937  1
  Mg  Mg89  1  0.171376  0.259105  0.448622  1
  Mg  Mg90  1  0.176667  0.845052  0.283196  1
  Mg  Mg91  1  0.513159  0.724454  0.367262  1
  Mg  Mg92  1  0.511190  0.430412  0.450585  1
  Mg  Mg93  1  0.521082  0.025367  0.277795  1
  Mg  Mg94  1  0.333056  0.644329  0.438637  1
  Mg  Mg95  1  0.354274  0.243869  0.263831  1
  Mg  Mg96  1  0.330975  0.941155  0.349197  1
  Mg  Mg97  1  0.685288  0.671940  0.382101  1
  Mg  Mg98  1  0.682533  0.376613  0.465034  1
  Mg  Mg99  1  0.688088  0.966781  0.291786  1
  Mg  Mg100  1  0.161275  0.790192  0.395350  1
  Mg  Mg101  1  0.164051  0.495871  0.480540  1
  Mg  Mg102  1  0.162016  0.089728  0.315259  1
  Mg  Mg103  1  0.176906  0.751336  0.310722  1
  Mg  Mg104  1  0.165407  0.458094  0.395158  1
  Mg  Mg105  1  0.162915  0.163680  0.474762  1
  Mg  Mg106  1  0.187229  0.684635  0.278362  1
  Mg  Mg107  1  0.165200  0.391084  0.364471  1
  Mg  Mg108  1  0.164551  0.096081  0.444765  1
  Mg  Mg109  1  1.002535  0.675707  0.380126  1
  Mg  Mg110  1  0.005995  0.378223  0.464602  1
  Mg  Mg111  1  0.997166  0.972010  0.290844  1
  Mg  Mg112  1  0.640891  0.740211  0.266598  1
  Mg  Mg113  1  0.672854  0.441261  0.351734  1
  Mg  Mg114  1  0.677031  0.146948  0.430591  1
  Mg  Mg115  1  0.161364  0.586856  0.313640  1
  Mg  Mg116  1  0.172662  0.293941  0.390586  1
  Mg  Mg117  1  0.170087  -0.003188  0.474444  1
  Mg  Mg118  1  0.507187  0.693206  0.425502  1
  Mg  Mg119  1  0.534917  0.299369  0.252588  1
  Mg  Mg120  1  0.511046  0.987361  0.336088  1
  Mg  Mg121  1  0.670239  0.641184  0.439629  1
  Mg  Mg122  1  0.650711  0.234472  0.265676  1
  Mg  Mg123  1  0.674103  0.936120  0.349567  1
  Mg  Mg124  1  0.839599  0.871201  0.559695  1
  Mg  Mg125  1  0.848206  0.572034  0.647018  1
  Mg  Mg126  1  0.848869  0.274282  0.730245  1
  Mg  Mg127  1  0.844601  0.699947  0.560802  1
  Mg  Mg128  1  0.839792  0.405921  0.645844  1
  Mg  Mg129  1  0.835710  0.109952  0.728821  1
  Mg  Mg130  1  0.373287  0.722232  0.744935  1
  Mg  Mg131  1  0.337465  0.317318  0.578333  1
  Mg  Mg132  1  0.342208  0.026155  0.657089  1
  Mg  Mg133  1  0.188108  0.776631  0.732449  1
  Mg  Mg134  1  0.170176  0.368179  0.564285  1
  Mg  Mg135  1  0.167717  0.074487  0.644755  1
  Mg  Mg136  1  0.508719  0.735696  0.644302  1
  Mg  Mg137  1  0.519743  0.437841  0.733011  1
  Mg  Mg138  1  0.502330  0.033326  0.558904  1
  Mg  Mg139  1  0.642609  0.721558  0.745381  1
  Mg  Mg140  1  0.671388  0.318039  0.578027  1
  Mg  Mg141  1  0.667342  0.025168  0.656493  1
  Mg  Mg142  1  0.342168  0.849337  0.517218  1
  Mg  Mg143  1  0.339921  0.551460  0.605085  1
  Mg  Mg144  1  0.340710  0.256405  0.685829  1
  Mg  Mg145  1  0.840537  0.799843  0.532403  1
  Mg  Mg146  1  0.845565  0.503178  0.619292  1
  Mg  Mg147  1  0.839682  0.209468  0.697874  1
  Mg  Mg148  1  0.674943  0.820761  0.574957  1
  Mg  Mg149  1  0.675409  0.523930  0.662747  1
  Mg  Mg150  1  0.654899  0.228273  0.743553  1
  Mg  Mg151  1  0.672784  0.648863  0.576198  1
  Mg  Mg152  1  0.672456  0.353490  0.660059  1
  Mg  Mg153  1  0.677241  0.054473  0.743005  1
  Mg  Mg154  1  0.505946  0.769484  0.587078  1
  Mg  Mg155  1  0.509554  0.473786  0.675759  1
  Mg  Mg156  1  0.534524  0.164630  0.757334  1
  Mg  Mg157  1  0.844780  0.668604  0.617662  1
  Mg  Mg158  1  0.844931  0.367902  0.699718  1
  Mg  Mg159  1  0.845491  0.965752  0.531610  1
  Mg  Mg160  1  0.179552  0.708901  0.701585  1
  Mg  Mg161  1  0.170005  0.297180  0.534959  1
  Mg  Mg162  1  0.166942  0.005852  0.614567  1
  Mg  Mg163  1  0.320163  0.856499  0.659334  1
  Mg  Mg164  1  0.316132  0.557891  0.746267  1
  Mg  Mg165  1  0.338553  0.154158  0.574169  1
  Mg  Mg166  1  0.855964  0.907996  0.645170  1
  Mg  Mg167  1  0.854590  0.615096  0.730686  1
  Mg  Mg168  1  0.841825  0.203891  0.560596  1
  Mg  Mg169  1  0.505000  0.937463  0.587771  1
  Mg  Mg170  1  0.507046  0.638068  0.671391  1
  Mg  Mg171  1  0.505481  0.231520  0.504472  1
  Mg  Mg172  1  0.864472  0.875118  0.703535  1
  Mg  Mg173  1  0.840844  0.464904  0.536928  1
  Mg  Mg174  1  0.842068  0.170932  0.618226  1
  Mg  Mg175  1  0.338435  0.648782  0.576151  1
  Mg  Mg176  1  0.341668  0.355216  0.658409  1
  Mg  Mg177  1  0.353716  0.061264  0.742748  1
  Mg  Mg178  1  0.685304  0.857143  0.658832  1
  Mg  Mg179  1  0.671268  0.567743  0.744770  1
  Mg  Mg180  1  0.677301  0.153039  0.574622  1
  Mg  Mg181  1  0.330334  0.926415  0.682477  1
  Mg  Mg182  1  0.342400  0.514935  0.523303  1
  Mg  Mg183  1  0.340152  0.221537  0.603848  1
  Mg  Mg184  1  0.339467  0.821226  0.574203  1
  Mg  Mg185  1  0.332981  0.520796  0.662613  1
  Mg  Mg186  1  0.351841  0.220051  0.746009  1
  Mg  Mg187  1  0.823905  0.705034  0.703130  1
  Mg  Mg188  1  0.847912  0.298896  0.534418  1
  Mg  Mg189  1  0.846965  0.006624  0.614260  1
  Mg  Mg190  1  0.823301  0.777128  0.731830  1
  Mg  Mg191  1  0.845659  0.366803  0.564607  1
  Mg  Mg192  1  0.844293  0.073999  0.644388  1
  Mg  Mg193  1  0.676034  0.718913  0.602204  1
  Mg  Mg194  1  0.674085  0.423698  0.686954  1
  Mg  Mg195  1  0.671538  0.014246  0.517047  1
  Mg  Mg196  1  0.328569  0.787425  0.630853  1
  Mg  Mg197  1  0.327423  0.486874  0.720804  1
  Mg  Mg198  1  0.329975  0.086528  0.543975  1
  Mg  Mg199  1  0.151519  0.875477  0.705116  1
  Mg  Mg200  1  0.165926  0.466295  0.536696  1
  Mg  Mg201  1  0.169499  0.170815  0.618180  1
  Mg  Mg202  1  0.668350  0.925338  0.679532  1
  Mg  Mg203  1  0.674106  0.516656  0.522579  1
  Mg  Mg204  1  0.673225  0.222132  0.603608  1
  Mg  Mg205  1  0.506341  0.731916  0.506677  1
  Mg  Mg206  1  0.507433  0.435695  0.591025  1
  Mg  Mg207  1  0.501635  0.139744  0.673125  1
  Mg  Mg208  1  0.336045  0.719140  0.602001  1
  Mg  Mg209  1  0.345754  0.422734  0.686490  1
  Mg  Mg210  1  0.333407  0.016492  0.516267  1
  Mg  Mg211  1  0.165340  0.669036  0.617200  1
  Mg  Mg212  1  0.163580  0.370371  0.698893  1
  Mg  Mg213  1  0.170487  0.964369  0.531668  1
  Mg  Mg214  1  0.504054  0.841920  0.617072  1
  Mg  Mg215  1  0.496091  0.542666  0.704949  1
  Mg  Mg216  1  0.510378  0.137175  0.530348  1
  Mg  Mg217  1  0.352859  0.755026  0.688785  1
  Mg  Mg218  1  0.333430  0.348229  0.521014  1
  Mg  Mg219  1  0.334482  0.054825  0.600578  1
  Mg  Mg220  1  0.682953  0.788306  0.630648  1
  Mg  Mg221  1  0.688289  0.495145  0.720259  1
  Mg  Mg222  1  0.682667  0.084297  0.544632  1
  Mg  Mg223  1  0.161993  0.908445  0.642834  1
  Mg  Mg224  1  0.176144  0.616000  0.729308  1
  Mg  Mg225  1  0.165675  0.202467  0.561065  1
  Mg  Mg226  1  0.165868  0.869692  0.559461  1
  Mg  Mg227  1  0.167382  0.572466  0.646204  1
  Mg  Mg228  1  0.178693  0.274848  0.730133  1
  Mg  Mg229  1  0.165897  0.800816  0.531963  1
  Mg  Mg230  1  0.165784  0.502414  0.619433  1
  Mg  Mg231  1  0.184269  0.206054  0.699522  1
  Mg  Mg232  1  0.005939  0.786357  0.633767  1
  Mg  Mg233  1  1.001810  0.488037  0.721836  1
  Mg  Mg234  1  1.004081  0.085911  0.544301  1
  Mg  Mg235  1  0.673597  0.850968  0.516843  1
  Mg  Mg236  1  0.671603  0.551578  0.605066  1
  Mg  Mg237  1  0.663229  0.254578  0.686772  1
  Mg  Mg238  1  0.168771  0.700733  0.560571  1
  Mg  Mg239  1  0.167339  0.406394  0.646505  1
  Mg  Mg240  1  0.154372  0.104727  0.731635  1
  Mg  Mg241  1  0.504772  0.808421  0.671810  1
  Mg  Mg242  1  0.505914  0.397350  0.508415  1
  Mg  Mg243  1  0.505822  0.104329  0.588391  1
  Mg  Mg244  1  0.667456  0.757055  0.688124  1
  Mg  Mg245  1  0.671622  0.346099  0.521530  1
  Mg  Mg246  1  0.673176  0.054046  0.600831  1
  Al  Al247  1  1.003283  0.735365  0.274934  1
  Al  Al248  1  1.000038  0.440905  0.349826  1
  Al  Al249  1  0.998388  0.146073  0.429181  1
  Al  Al250  1  0.672756  0.781418  0.491591  1
  Al  Al251  1  0.677541  0.373334  0.323145  1
  Al  Al252  1  0.670828  0.076241  0.405488  1
  Al  Al253  1  0.166198  0.858607  0.423508  1
  Al  Al254  1  0.168103  0.452833  0.262891  1
  Al  Al255  1  0.169289  0.159295  0.337692  1
  Al  Al256  1  0.833798  0.613327  0.261533  1
  Al  Al257  1  0.835782  0.323511  0.336435  1
  Al  Al258  1  0.833404  0.025068  0.420692  1
  Al  Al259  1  0.844440  0.690016  0.426434  1
  Al  Al260  1  0.835491  0.284493  0.261126  1
  Al  Al261  1  0.839859  0.986466  0.336555  1
  Al  Al262  1  0.672878  0.710286  0.467738  1
  Al  Al263  1  0.674420  0.302228  0.299187  1
  Al  Al264  1  0.671170  0.003596  0.380551  1
  Al  Al265  1  1.005475  0.638682  0.295545  1
  Al  Al266  1  0.006249  0.341070  0.376999  1
  Al  Al267  1  1.005068  0.045358  0.459517  1
  Al  Al268  1  0.168143  0.623024  0.397588  1
  Al  Al269  1  0.171569  0.327016  0.478489  1
  Al  Al270  1  0.170836  0.918684  0.310793  1
  Al  Al271  1  0.504172  0.522247  0.285481  1
  Al  Al272  1  0.504182  0.226325  0.363795  1
  Al  Al273  1  0.503750  0.929215  0.447749  1
  Al  Al274  1  0.179936  0.613712  0.260805  1
  Al  Al275  1  0.180371  0.325721  0.334609  1
  Al  Al276  1  0.176048  0.026534  0.420281  1
  Al  Al277  1  0.841969  0.655032  0.336134  1
  Al  Al278  1  0.845003  0.356787  0.421262  1
  Al  Al279  1  0.843436  0.063002  0.501429  1
  Al  Al280  1  0.010682  0.608317  0.356228  1
  Al  Al281  1  0.014264  0.312518  0.434612  1
  Al  Al282  1  0.017920  0.899899  0.275937  1
  Al  Al283  1  0.835018  0.821446  0.338407  1
  Al  Al284  1  0.837890  0.526441  0.424773  1
  Al  Al285  1  0.851500  0.121561  0.261489  1
  Al  Al286  1  0.332284  0.573104  0.411541  1
  Al  Al287  1  0.331959  0.278411  0.491638  1
  Al  Al288  1  0.329826  0.869091  0.324814  1
  Al  Al289  1  0.660712  0.807668  0.298524  1
  Al  Al290  1  0.666614  0.509066  0.381709  1
  Al  Al291  1  0.668670  0.215093  0.461132  1
  Al  Al292  1  0.339190  0.878693  0.462085  1
  Al  Al293  1  0.337415  0.470215  0.298188  1
  Al  Al294  1  0.338584  0.175226  0.377149  1
  Al  Al295  1  0.336330  0.771252  0.354660  1
  Al  Al296  1  0.334327  0.477435  0.437921  1
  Al  Al297  1  0.330081  0.071248  0.275136  1
  Al  Al298  1  0.009346  0.800795  0.304325  1
  Al  Al299  1  0.007054  0.505861  0.381825  1
  Al  Al300  1  0.006322  0.212478  0.461108  1
  Al  Al301  1  0.013729  0.645028  0.437044  1
  Al  Al302  1  0.015099  0.244493  0.272104  1
  Al  Al303  1  0.008562  0.940429  0.346872  1
  Al  Al304  1  1.005278  0.712568  0.467287  1
  Al  Al305  1  0.005711  0.306839  0.299228  1
  Al  Al306  1  1.002026  0.007441  0.379585  1
  Al  Al307  1  0.166193  0.831597  0.476735  1
  Al  Al308  1  0.170040  0.421987  0.310319  1
  Al  Al309  1  0.166620  0.126384  0.389268  1
  Al  Al310  1  0.995203  0.703086  0.322699  1
  Al  Al311  1  0.998476  0.407711  0.409393  1
  Al  Al312  1  0.997495  0.113231  0.488889  1
  Al  Al313  1  0.011843  0.533057  0.325723  1
  Al  Al314  1  0.013824  0.240093  0.404310  1
  Al  Al315  1  0.011230  0.943607  0.488269  1
  Al  Al316  1  0.166970  0.659019  0.335085  1
  Al  Al317  1  0.166886  0.362513  0.419884  1
  Al  Al318  1  0.166870  0.067928  0.500315  1
  Al  Al319  1  0.339132  0.714954  0.466388  1
  Al  Al320  1  0.343383  0.312366  0.292131  1
  Al  Al321  1  0.343132  0.007523  0.380024  1
  Al  Al322  1  0.670087  0.630207  0.298604  1
  Al  Al323  1  0.671842  0.339352  0.378243  1
  Al  Al324  1  0.673535  0.043247  0.460539  1
  Al  Al325  1  0.344027  0.799516  0.303173  1
  Al  Al326  1  0.343905  0.504790  0.382528  1
  Al  Al327  1  0.343048  0.209864  0.462326  1
  Al  Al328  1  0.514258  0.761923  0.452462  1
  Al  Al329  1  0.524494  0.357039  0.286308  1
  Al  Al330  1  0.514270  0.056407  0.367625  1
  Al  Al331  1  0.165257  0.695757  0.424051  1
  Al  Al332  1  0.162599  0.290615  0.259659  1
  Al  Al333  1  0.161189  0.990404  0.335165  1
  Al  Al334  1  0.500901  0.585996  0.311345  1
  Al  Al335  1  0.498308  0.292665  0.391218  1
  Al  Al336  1  0.499205  -0.004025  0.474412  1
  Al  Al337  1  0.339976  0.781424  0.491597  1
  Al  Al338  1  0.337889  0.374171  0.321374  1
  Al  Al339  1  0.341576  0.075541  0.405736  1
  Al  Al340  1  0.005833  0.879247  0.462565  1
  Al  Al341  1  0.005712  0.471392  0.299570  1
  Al  Al342  1  0.006213  0.176016  0.376685  1
  Al  Al343  1  1.002463  0.769062  0.352455  1
  Al  Al344  1  1.003919  0.477107  0.437863  1
  Al  Al345  1  1.003762  0.072621  0.273663  1
  Al  Al346  1  0.012313  0.611534  0.497597  1
  Al  Al347  1  0.018606  0.207368  0.323723  1
  Al  Al348  1  0.011954  0.907013  0.409942  1
  Al  Al349  1  0.843168  0.832291  0.476585  1
  Al  Al350  1  0.837157  0.423036  0.310604  1
  Al  Al351  1  0.841330  0.127903  0.388737  1
  Al  Al352  1  0.340876  0.632028  0.298203  1
  Al  Al353  1  0.340316  0.344595  0.377112  1
  Al  Al354  1  0.338381  0.047700  0.459166  1
  Al  Al355  1  0.845691  0.862842  0.422373  1
  Al  Al356  1  0.842175  0.458973  0.262433  1
  Al  Al357  1  0.844196  0.163407  0.335546  1
  Al  Al358  1  0.008702  0.573347  0.411597  1
  Al  Al359  1  0.008505  0.279909  0.491282  1
  Al  Al360  1  0.010567  0.866992  0.324777  1
  Al  Al361  1  0.514471  0.793062  0.395242  1
  Al  Al362  1  0.513432  0.498239  0.480184  1
  Al  Al363  1  0.507977  0.093072  0.308615  1
  Al  Al364  1  0.496460  0.592282  0.454420  1
  Al  Al365  1  0.486634  0.184930  0.284043  1
  Al  Al366  1  0.495856  0.889638  0.364883  1
  Al  Al367  1  1.003350  0.781160  0.492067  1
  Al  Al368  1  1.002107  0.372630  0.322640  1
  Al  Al369  1  1.003059  0.075395  0.405198  1
  Al  Al370  1  0.007686  0.567634  0.271850  1
  Al  Al371  1  0.010510  0.274504  0.349752  1
  Al  Al372  1  0.006976  0.976926  0.434132  1
  Al  Al373  1  0.674858  0.566919  0.273755  1
  Al  Al374  1  0.669623  0.274641  0.351469  1
  Al  Al375  1  0.673680  0.976072  0.434680  1
  Al  Al376  1  0.508660  0.679440  0.283720  1
  Al  Al377  1  0.513417  0.389616  0.364533  1
  Al  Al378  1  0.513966  0.094417  0.444898  1
  Al  Al379  1  0.333965  0.566322  0.273474  1
  Al  Al380  1  0.341092  0.275319  0.351367  1
  Al  Al381  1  0.336611  0.976807  0.434265  1
  Al  Al382  1  0.513618  0.756383  0.313620  1
  Al  Al383  1  0.512953  0.460031  0.394351  1
  Al  Al384  1  0.514755  0.165635  0.473215  1
  Al  Al385  1  0.497887  0.554879  0.368162  1
  Al  Al386  1  0.496603  0.259171  0.448130  1
  Al  Al387  1  0.481388  0.850490  0.286602  1
  Al  Al388  1  0.498934  0.663572  0.482001  1
  Al  Al389  1  0.497078  0.259832  0.308578  1
  Al  Al390  1  0.501020  0.958657  0.392820  1
  Al  Al391  1  0.168653  0.518010  0.285017  1
  Al  Al392  1  0.169101  0.223699  0.364788  1
  Al  Al393  1  0.168237  0.926389  0.448444  1
  Al  Al394  1  0.835530  0.725033  0.364426  1
  Al  Al395  1  0.840327  0.429793  0.450758  1
  Al  Al396  1  0.832864  0.028405  0.284441  1
  Al  Al397  1  0.677906  0.574240  0.411025  1
  Al  Al398  1  0.679255  0.279816  0.491255  1
  Al  Al399  1  0.675348  0.869747  0.323288  1
  Al  Al400  1  0.177066  0.819283  0.340219  1
  Al  Al401  1  0.174785  0.524850  0.425118  1
  Al  Al402  1  0.175509  0.118463  0.262262  1
  Al  Al403  1  0.168367  0.724403  0.365728  1
  Al  Al404  1  0.167008  0.429808  0.450792  1
  Al  Al405  1  0.160023  0.027184  0.287410  1
  Al  Al406  1  0.847906  0.622052  0.397717  1
  Al  Al407  1  0.845460  0.326930  0.478457  1
  Al  Al408  1  0.846714  0.914669  0.309542  1
  Al  Al409  1  0.669952  0.843446  0.379342  1
  Al  Al410  1  0.668766  0.547421  0.466082  1
  Al  Al411  1  0.667947  0.144185  0.294264  1
  Al  Al412  1  0.671609  0.880090  0.461917  1
  Al  Al413  1  0.672846  0.472344  0.298343  1
  Al  Al414  1  0.672564  0.176904  0.376415  1
  Al  Al415  1  0.505332  0.897831  0.502847  1
  Al  Al416  1  0.504843  0.488664  0.338105  1
  Al  Al417  1  0.505567  0.193517  0.417815  1
  Al  Al418  1  0.995728  0.739887  0.409668  1
  Al  Al419  1  0.999003  0.444435  0.493768  1
  Al  Al420  1  0.992258  0.036142  0.324813  1
  Al  Al421  1  0.998921  0.814533  0.437683  1
  Al  Al422  1  0.991628  0.410200  0.273558  1
  Al  Al423  1  1.001401  0.111110  0.353723  1
  Al  Al424  1  0.165167  0.895727  0.502451  1
  Al  Al425  1  0.167115  0.485663  0.338308  1
  Al  Al426  1  0.164155  0.190503  0.417747  1
  Al  Al427  1  0.507524  0.830081  0.476747  1
  Al  Al428  1  0.509013  0.421157  0.310688  1
  Al  Al429  1  0.508711  0.126393  0.391618  1
  Al  Al430  1  0.677026  0.774222  0.352884  1
  Al  Al431  1  0.678430  0.479047  0.437443  1
  Al  Al432  1  0.677149  0.080673  0.274142  1
  Al  Al433  1  0.339369  0.838110  0.381444  1
  Al  Al434  1  0.342484  0.542628  0.467669  1
  Al  Al435  1  0.335975  0.136853  0.299330  1
  Al  Al436  1  0.845993  0.899077  0.501672  1
  Al  Al437  1  0.845324  0.489153  0.337455  1
  Al  Al438  1  0.848244  0.195302  0.416534  1
  Al  Al439  1  0.844145  0.520221  0.285943  1
  Al  Al440  1  0.845427  0.223762  0.364573  1
  Al  Al441  1  0.844454  0.926709  0.448544  1
  Al  Al442  1  0.006997  0.839527  0.380189  1
  Al  Al443  1  0.006247  0.545019  0.467342  1
  Al  Al444  1  0.010618  0.142029  0.299160  1
  Al  Al445  1  0.504771  0.860589  0.421347  1
  Al  Al446  1  0.505023  0.460399  0.263514  1
  Al  Al447  1  0.503761  0.158653  0.337807  1
  Al  Al448  1  1.000030  0.851096  0.515737  1
  Al  Al449  1  0.006283  0.553687  0.602383  1
  Al  Al450  1  0.016384  0.255759  0.685100  1
  Al  Al451  1  0.657441  0.894984  0.731894  1
  Al  Al452  1  0.674691  0.484539  0.577450  1
  Al  Al453  1  0.669684  0.188684  0.657925  1
  Al  Al454  1  0.169190  0.979018  0.671000  1
  Al  Al455  1  0.165900  0.562451  0.511073  1
  Al  Al456  1  0.164602  0.269594  0.592257  1
  Al  Al457  1  0.833938  0.731103  0.506760  1
  Al  Al458  1  0.834562  0.435258  0.591326  1
  Al  Al459  1  0.835951  0.140357  0.673236  1
  Al  Al460  1  0.837075  0.805236  0.674963  1
  Al  Al461  1  0.844432  0.395144  0.509075  1
  Al  Al462  1  0.844695  0.103103  0.588910  1
  Al  Al463  1  0.666031  0.829805  0.712428  1
  Al  Al464  1  0.672378  0.414602  0.551055  1
  Al  Al465  1  0.670529  0.121594  0.632117  1
  Al  Al466  1  1.005290  0.750292  0.545950  1
  Al  Al467  1  1.004039  0.454104  0.632545  1
  Al  Al468  1  1.005156  0.157850  0.710221  1
  Al  Al469  1  0.172701  0.736158  0.646579  1
  Al  Al470  1  0.167867  0.434486  0.724130  1
  Al  Al471  1  0.169425  0.034265  0.558545  1
  Al  Al472  1  0.504812  0.631591  0.536269  1
  Al  Al473  1  0.506598  0.337956  0.618157  1
  Al  Al474  1  0.508282  0.043750  0.698626  1
  Al  Al475  1  0.176695  0.732305  0.506526  1
  Al  Al476  1  0.175551  0.435589  0.591395  1
  Al  Al477  1  0.179733  0.139041  0.675095  1
  Al  Al478  1  0.845795  0.769032  0.588150  1
  Al  Al479  1  0.843561  0.474964  0.675953  1
  Al  Al480  1  0.837711  0.179177  0.748594  1
  Al  Al481  1  0.005942  0.721892  0.603297  1
  Al  Al482  1  0.996342  0.425072  0.687524  1
  Al  Al483  1  0.011470  0.018095  0.517007  1
  Al  Al484  1  0.837035  0.937999  0.588198  1
  Al  Al485  1  0.834460  0.639399  0.673498  1
  Al  Al486  1  0.839267  0.232266  0.504352  1
  Al  Al487  1  0.337075  0.687933  0.657392  1
  Al  Al488  1  0.339886  0.388273  0.735766  1
  Al  Al489  1  0.333014  0.984871  0.572902  1
  Al  Al490  1  0.667651  0.919349  0.545784  1
  Al  Al491  1  0.671544  0.618498  0.632244  1
  Al  Al492  1  0.662903  0.319272  0.712961  1
  Al  Al493  1  0.340945  -0.004555  0.709955  1
  Al  Al494  1  0.339235  0.581478  0.550682  1
  Al  Al495  1  0.339554  0.287636  0.632223  1
  Al  Al496  1  0.331496  0.889759  0.602230  1
  Al  Al497  1  0.330489  0.591734  0.687746  1
  Al  Al498  1  0.332389  0.183292  0.517904  1
  Al  Al499  1  1.005275  0.917586  0.545131  1
  Al  Al500  1  0.005911  0.621025  0.632103  1
  Al  Al501  1  0.009380  0.319256  0.708425  1
  Al  Al502  1  0.995839  0.754722  0.687348  1
  Al  Al503  1  0.012502  0.349674  0.520036  1
  Al  Al504  1  0.009011  0.057064  0.599673  1
  Al  Al505  1  0.006642  0.816030  0.708166  1
  Al  Al506  1  1.005670  0.416688  0.550862  1
  Al  Al507  1  0.006302  0.123137  0.632294  1
  Al  Al508  1  0.191961  0.948028  0.724278  1
  Al  Al509  1  0.167233  0.534334  0.563859  1
  Al  Al510  1  0.168567  0.239334  0.644384  1
  Al  Al511  1  1.001815  0.818276  0.576345  1
  Al  Al512  1  0.007740  0.520885  0.665427  1
  Al  Al513  1  0.011905  0.221177  0.737156  1
  Al  Al514  1  0.006347  0.646848  0.574840  1
  Al  Al515  1  1.003233  0.351278  0.657325  1
  Al  Al516  1  0.987467  0.051904  0.736448  1
  Al  Al517  1  0.165695  0.770345  0.587434  1
  Al  Al518  1  0.162721  0.472250  0.676455  1
  Al  Al519  1  0.158102  0.173952  0.749956  1
  Al  Al520  1  0.346320  0.828576  0.713319  1
  Al  Al521  1  0.339823  0.418287  0.550232  1
  Al  Al522  1  0.339982  0.121848  0.631436  1
  Al  Al523  1  0.673766  0.750136  0.546327  1
  Al  Al524  1  0.671820  0.456339  0.631563  1
  Al  Al525  1  0.674246  0.161545  0.710504  1
  Al  Al526  1  0.343120  0.915841  0.546442  1
  Al  Al527  1  0.340721  0.620167  0.631734  1
  Al  Al528  1  0.344552  0.325408  0.710946  1
  Al  Al529  1  0.501263  0.875764  0.695837  1
  Al  Al530  1  0.512231  0.465298  0.537156  1
  Al  Al531  1  0.507298  0.170839  0.618134  1
  Al  Al532  1  0.176243  0.801737  0.676475  1
  Al  Al533  1  0.167545  0.399892  0.507855  1
  Al  Al534  1  0.166724  0.105059  0.587977  1
  Al  Al535  1  0.504729  0.700077  0.560318  1
  Al  Al536  1  0.512076  0.405248  0.644523  1
  Al  Al537  1  0.526982  0.106716  0.723878  1
  Al  Al538  1  0.356698  0.894424  0.734166  1
  Al  Al539  1  0.337948  0.484312  0.577726  1
  Al  Al540  1  0.340684  0.188608  0.657966  1
  Al  Al541  1  0.007579  0.991604  0.709796  1
  Al  Al542  1  0.006017  0.582075  0.549986  1
  Al  Al543  1  0.006349  0.287214  0.632488  1
  Al  Al544  1  1.004601  0.890227  0.600404  1
  Al  Al545  1  0.010045  0.593871  0.687601  1
  Al  Al546  1  1.004106  0.183071  0.517962  1
  Al  Al547  1  1.003035  0.725962  0.736148  1
  Al  Al548  1  0.009724  0.316868  0.579852  1
  Al  Al549  1  0.006968  0.024052  0.659858  1
  Al  Al550  1  0.823239  0.944590  0.716867  1
  Al  Al551  1  0.843665  0.534718  0.563575  1
  Al  Al552  1  0.844289  0.239629  0.644315  1
  Al  Al553  1  0.338018  0.752036  0.545640  1
  Al  Al554  1  0.341955  0.454365  0.631703  1
  Al  Al555  1  0.341712  0.151585  0.718224  1
  Al  Al556  1  0.844213  0.978078  0.669545  1
  Al  Al557  1  0.846276  0.566127  0.509904  1
  Al  Al558  1  0.847653  0.271286  0.591670  1
  Al  Al559  1  1.004176  0.691252  0.659445  1
  Al  Al560  1  1.002555  0.393751  0.737488  1
  Al  Al561  1  0.007071  0.985868  0.572612  1
  Al  Al562  1  0.495269  0.908118  0.642527  1
  Al  Al563  1  0.482606  0.610482  0.726065  1
  Al  Al564  1  0.510535  0.204017  0.560893  1
  Al  Al565  1  0.514161  0.703759  0.698608  1
  Al  Al566  1  0.499064  0.297658  0.535536  1
  Al  Al567  1  0.502207  0.004624  0.614696  1
  Al  Al568  1  1.000053  0.927557  0.740051  1
  Al  Al569  1  1.004630  0.484124  0.577731  1
  Al  Al570  1  0.008799  0.189290  0.659512  1
  Al  Al571  1  0.007169  0.681605  0.521159  1
  Al  Al572  1  0.005877  0.386744  0.605461  1
  Al  Al573  1  1.002755  0.091472  0.687083  1
  Al  Al574  1  0.670860  0.681328  0.521854  1
  Al  Al575  1  0.673528  0.386000  0.605260  1
  Al  Al576  1  0.677589  0.090804  0.686501  1
  Al  Al577  1  0.511101  0.799755  0.531436  1
  Al  Al578  1  0.505630  0.502072  0.619114  1
  Al  Al579  1  0.496828  0.204314  0.701587  1
  Al  Al580  1  0.340088  0.682009  0.521743  1
  Al  Al581  1  0.338387  0.386862  0.605091  1
  Al  Al582  1  0.336469  0.090655  0.688574  1
  Al  Al583  1  0.511063  0.870940  0.559499  1
  Al  Al584  1  0.501733  0.570884  0.647352  1
  Al  Al585  1  0.490515  0.277262  0.725381  1
  Al  Al586  1  0.507045  0.667312  0.617007  1
  Al  Al587  1  0.508765  0.370769  0.700531  1
  Al  Al588  1  0.498819  0.964347  0.531597  1
  Al  Al589  1  0.509316  0.781844  0.727960  1
  Al  Al590  1  0.501146  0.368295  0.564465  1
  Al  Al591  1  0.504352  0.075480  0.644615  1
  Al  Al592  1  0.167452  0.630053  0.536491  1
  Al  Al593  1  0.167131  0.336109  0.619887  1
  Al  Al594  1  0.170141  0.042569  0.699451  1
  Al  Al595  1  0.848234  0.840224  0.615870  1
  Al  Al596  1  0.848441  0.545989  0.703008  1
  Al  Al597  1  0.839763  0.136791  0.530692  1
  Al  Al598  1  0.676541  0.686503  0.658562  1
  Al  Al599  1  0.673016  0.381904  0.736003  1
  Al  Al600  1  0.676745  0.985624  0.573087  1
  Al  Al601  1  0.174179  0.937441  0.587435  1
  Al  Al602  1  0.177090  0.640959  0.672295  1
  Al  Al603  1  0.173156  0.230787  0.504703  1
  Al  Al604  1  0.164335  0.839553  0.614972  1
  Al  Al605  1  0.171288  0.542661  0.701569  1
  Al  Al606  1  0.167316  0.136198  0.530629  1
  Al  Al607  1  0.836411  0.735850  0.646829  1
  Al  Al608  1  0.830239  0.434558  0.726845  1
  Al  Al609  1  0.844446  0.033739  0.558559  1
  Al  Al610  1  0.671830  0.958279  0.627521  1
  Al  Al611  1  0.661496  0.653234  0.713903  1
  Al  Al612  1  0.668078  0.252334  0.546828  1
  Al  Al613  1  0.668328  0.992530  0.708839  1
  Al  Al614  1  0.672390  0.582156  0.550474  1
  Al  Al615  1  0.671974  0.287348  0.632500  1
  Al  Al616  1  0.504952  0.003532  0.745640  1
  Al  Al617  1  0.505775  0.600180  0.590969  1
  Al  Al618  1  0.504837  0.304958  0.671367  1
  Al  Al619  1  0.010906  0.852905  0.658715  1
  Al  Al620  1  0.018439  0.560779  0.736571  1
  Al  Al621  1  1.002142  0.151320  0.574630  1
  Al  Al622  1  0.015102  0.931304  0.685013  1
  Al  Al623  1  1.000412  0.517935  0.523856  1
  Al  Al624  1  1.004229  0.223129  0.604753  1
  Al  Al625  1  0.168641  0.010945  0.746693  1
  Al  Al626  1  0.166161  0.599800  0.589509  1
  Al  Al627  1  0.170627  0.303290  0.671327  1
  Al  Al628  1  0.503730  0.944059  0.720174  1
  Al  Al629  1  0.506765  0.531822  0.564491  1
  Al  Al630  1  0.505361  0.237001  0.645413  1
  Al  Al631  1  0.679168  0.890689  0.604001  1
  Al  Al632  1  0.676972  0.590692  0.689212  1
  Al  Al633  1  0.679568  0.184839  0.517391  1
  Al  Al634  1  0.338285  0.958358  0.627996  1
  Al  Al635  1  0.345514  0.660918  0.709328  1
  Al  Al636  1  0.343475  0.249151  0.547760  1
  Al  Al637  1  0.844502  -0.000866  0.746589  1
  Al  Al638  1  0.845723  0.599698  0.589730  1
  Al  Al639  1  0.842988  0.300092  0.672626  1
  Al  Al640  1  0.845265  0.629967  0.536431  1
  Al  Al641  1  0.843698  0.335342  0.620107  1
  Al  Al642  1  0.837330  0.040226  0.698647  1
  Al  Al643  1  0.006048  0.958285  0.628477  1
  Al  Al644  1  0.008827  0.660172  0.707678  1
  Al  Al645  1  0.006084  0.250605  0.548001  1
  Al  Al646  1  0.502130  0.975334  0.669043  1
  Al  Al647  1  0.505500  0.564217  0.509997  1
  Al  Al648  1  0.505793  0.269940  0.591354  1
