# generated using pymatgen
data_Mg3Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.56090354
_cell_length_b   26.74213239
_cell_length_c   48.39154845
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.89738821
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg3Al
_chemical_formula_sum   'Mg324 Al108'
_cell_volume   19825.0349008
_cell_formula_units_Z   108
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  0.144506  0.674251  0.343663  1
  Mg  Mg2  1  0.815196  0.506902  0.340584  1
  Mg  Mg3  1  0.900893  0.704913  0.293474  1
  Mg  Mg4  1  0.142759  0.172473  0.343895  1
  Mg  Mg5  1  0.234196  0.365563  0.293307  1
  Mg  Mg6  1  0.190050  0.520582  0.316450  1
  Mg  Mg7  1  0.476882  0.339359  0.343560  1
  Mg  Mg8  1  0.555669  0.533996  0.293187  1
  Mg  Mg9  1  0.525617  0.687466  0.316036  1
  Mg  Mg10  1  0.810610  1.006082  0.343655  1
  Mg  Mg11  1  0.899369  0.201031  0.293357  1
  Mg  Mg12  1  0.857768  0.354538  0.316064  1
  Mg  Mg13  1  0.233227  0.869670  0.293653  1
  Mg  Mg14  1  0.191484  0.019560  0.316127  1
  Mg  Mg15  1  0.476117  0.840734  0.343638  1
  Mg  Mg16  1  0.567202  0.035244  0.293700  1
  Mg  Mg17  1  0.526056  0.185316  0.316259  1
  Mg  Mg18  1  0.858477  0.852456  0.316021  1
  Mg  Mg19  1  -0.000176  0.764529  0.331541  1
  Mg  Mg20  1  0.666299  0.595361  0.327954  1
  Mg  Mg21  1  0.617236  0.751646  0.354668  1
  Mg  Mg22  1  -0.002688  0.263024  0.331375  1
  Mg  Mg23  1  0.952646  0.415965  0.354886  1
  Mg  Mg24  1  0.049046  0.611315  0.305653  1
  Mg  Mg25  1  0.330614  0.429637  0.330821  1
  Mg  Mg26  1  0.284568  0.584188  0.354617  1
  Mg  Mg27  1  0.381785  0.777077  0.305435  1
  Mg  Mg28  1  0.666271  0.096555  0.331306  1
  Mg  Mg29  1  0.618207  0.250355  0.354420  1
  Mg  Mg30  1  0.713873  0.446490  0.304685  1
  Mg  Mg31  1  0.951459  0.916392  0.354642  1
  Mg  Mg32  1  0.048130  0.109053  0.305511  1
  Mg  Mg33  1  0.332062  0.931253  0.331383  1
  Mg  Mg34  1  0.284845  0.083167  0.354773  1
  Mg  Mg35  1  0.383594  0.274591  0.305529  1
  Mg  Mg36  1  0.715441  0.942552  0.305557  1
  Mg  Mg37  1  0.193460  0.769668  0.317409  1
  Mg  Mg38  1  0.859710  0.604998  0.316675  1
  Mg  Mg39  1  0.807129  0.759691  0.342069  1
  Mg  Mg40  1  0.195637  0.265183  0.317318  1
  Mg  Mg41  1  0.136609  0.425480  0.339824  1
  Mg  Mg42  1  0.250611  0.620877  0.295443  1
  Mg  Mg43  1  0.525482  0.433870  0.316954  1
  Mg  Mg44  1  0.471660  0.593488  0.340949  1
  Mg  Mg45  1  0.581209  0.789098  0.295155  1
  Mg  Mg46  1  0.859783  0.101034  0.317107  1
  Mg  Mg47  1  0.804794  0.259775  0.340581  1
  Mg  Mg48  1  0.938062  0.448295  0.295646  1
  Mg  Mg49  1  0.139737  0.926047  0.341679  1
  Mg  Mg50  1  0.248595  0.120872  0.295565  1
  Mg  Mg51  1  0.526569  0.935189  0.317190  1
  Mg  Mg52  1  0.474198  0.091962  0.341815  1
  Mg  Mg53  1  0.584350  0.286670  0.295460  1
  Mg  Mg54  1  0.916201  0.953475  0.295347  1
  Mg  Mg55  1  0.000892  0.637204  0.413375  1
  Mg  Mg56  1  0.666234  0.470637  0.412864  1
  Mg  Mg57  1  0.761969  0.661171  0.365366  1
  Mg  Mg58  1  0.000530  0.137226  0.412872  1
  Mg  Mg59  1  0.099341  0.326907  0.365814  1
  Mg  Mg60  1  0.047715  0.482675  0.389741  1
  Mg  Mg61  1  0.334041  0.303821  0.412864  1
  Mg  Mg62  1  0.430621  0.494583  0.365476  1
  Mg  Mg63  1  0.380310  0.649252  0.390115  1
  Mg  Mg64  1  0.667757  0.970333  0.413147  1
  Mg  Mg65  1  0.764831  0.161394  0.365796  1
  Mg  Mg66  1  0.713930  0.316640  0.389497  1
  Mg  Mg67  1  0.098473  0.828196  0.366362  1
  Mg  Mg68  1  0.046732  0.981989  0.390401  1
  Mg  Mg69  1  0.334565  0.803971  0.413252  1
  Mg  Mg70  1  0.432065  0.994531  0.366194  1
  Mg  Mg71  1  0.381262  0.148357  0.390632  1
  Mg  Mg72  1  0.714030  0.815780  0.390615  1
  Mg  Mg73  1  0.857447  0.725849  0.400957  1
  Mg  Mg74  1  0.523753  0.560002  0.400413  1
  Mg  Mg75  1  0.476765  0.713419  0.425016  1
  Mg  Mg76  1  0.857721  0.227240  0.400354  1
  Mg  Mg77  1  0.809524  0.381357  0.424778  1
  Mg  Mg78  1  0.904705  0.573786  0.377549  1
  Mg  Mg79  1  0.191478  0.393562  0.400081  1
  Mg  Mg80  1  0.143217  0.547104  0.425491  1
  Mg  Mg81  1  0.238953  0.739988  0.378119  1
  Mg  Mg82  1  0.525361  0.059771  0.401204  1
  Mg  Mg83  1  0.476207  0.213986  0.425607  1
  Mg  Mg84  1  0.571482  0.406283  0.377639  1
  Mg  Mg85  1  0.809422  0.880527  0.425731  1
  Mg  Mg86  1  0.905144  0.072534  0.377828  1
  Mg  Mg87  1  0.191444  0.893396  0.401250  1
  Mg  Mg88  1  0.142520  0.047084  0.425610  1
  Mg  Mg89  1  0.239388  0.238289  0.378110  1
  Mg  Mg90  1  0.572315  0.905984  0.377962  1
  Mg  Mg91  1  0.048314  0.733204  0.390421  1
  Mg  Mg92  1  0.714675  0.564934  0.387944  1
  Mg  Mg93  1  0.667242  0.719262  0.413572  1
  Mg  Mg94  1  0.048090  0.233261  0.390250  1
  Mg  Mg95  1  0.002441  0.385716  0.413771  1
  Mg  Mg96  1  0.096265  0.579383  0.365788  1
  Mg  Mg97  1  0.381376  0.400045  0.389878  1
  Mg  Mg98  1  0.334416  0.552132  0.413623  1
  Mg  Mg99  1  0.429559  0.744768  0.365334  1
  Mg  Mg100  1  0.715152  0.066574  0.390207  1
  Mg  Mg101  1  0.668015  0.219791  0.413683  1
  Mg  Mg102  1  0.761750  0.413572  0.364721  1
  Mg  Mg103  1  0.001143  0.885577  0.414142  1
  Mg  Mg104  1  0.095851  0.077073  0.365435  1
  Mg  Mg105  1  0.381445  0.900379  0.390442  1
  Mg  Mg106  1  0.334876  0.052055  0.414086  1
  Mg  Mg107  1  0.429901  0.243717  0.365470  1
  Mg  Mg108  1  0.763262  0.910564  0.365458  1
  Mg  Mg109  1  0.855293  0.598523  0.485656  1
  Mg  Mg110  1  0.522127  0.432189  0.485938  1
  Mg  Mg111  1  0.618805  0.623542  0.436528  1
  Mg  Mg112  1  0.854943  0.099290  0.486003  1
  Mg  Mg113  1  0.951040  0.291339  0.437527  1
  Mg  Mg114  1  0.904056  0.444818  0.461090  1
  Mg  Mg115  1  0.188353  0.265758  0.486311  1
  Mg  Mg116  1  0.284572  0.457349  0.437540  1
  Mg  Mg117  1  0.237724  0.611081  0.461677  1
  Mg  Mg118  1  0.521970  0.932463  0.486354  1
  Mg  Mg119  1  0.618160  0.124598  0.437780  1
  Mg  Mg120  1  0.570513  0.278049  0.461750  1
  Mg  Mg121  1  0.950763  0.790517  0.437884  1
  Mg  Mg122  1  0.903838  0.944712  0.461834  1
  Mg  Mg123  1  0.188776  0.765398  0.486412  1
  Mg  Mg124  1  0.284424  0.957619  0.438133  1
  Mg  Mg125  1  0.237483  0.111270  0.461787  1
  Mg  Mg126  1  0.570236  0.777871  0.461605  1
  Mg  Mg127  1  0.712613  0.688027  0.473581  1
  Mg  Mg128  1  0.379590  0.521438  0.473910  1
  Mg  Mg129  1  0.331027  0.675051  0.497672  1
  Mg  Mg130  1  0.712774  0.188858  0.473926  1
  Mg  Mg131  1  0.664034  0.342090  0.497570  1
  Mg  Mg132  1  0.761368  0.534455  0.448897  1
  Mg  Mg133  1  0.046043  0.355235  0.474117  1
  Mg  Mg134  1  -0.002281  0.508352  0.497474  1
  Mg  Mg135  1  0.094716  0.701189  0.450264  1
  Mg  Mg136  1  0.379734  0.021832  0.474297  1
  Mg  Mg137  1  0.330723  0.175459  0.497955  1
  Mg  Mg138  1  0.427923  0.367890  0.449851  1
  Mg  Mg139  1  0.663987  0.841969  0.497658  1
  Mg  Mg140  1  0.761129  0.034784  0.449969  1
  Mg  Mg141  1  0.045990  0.854897  0.474229  1
  Mg  Mg142  1  -0.002797  0.008937  0.497709  1
  Mg  Mg143  1  0.094531  0.201420  0.449962  1
  Mg  Mg144  1  0.427685  0.868244  0.450245  1
  Mg  Mg145  1  0.903454  0.694326  0.461357  1
  Mg  Mg146  1  0.570105  0.528350  0.461137  1
  Mg  Mg147  1  0.521945  0.681529  0.485203  1
  Mg  Mg148  1  0.903469  0.195136  0.461001  1
  Mg  Mg149  1  0.854275  0.349619  0.485388  1
  Mg  Mg150  1  0.952495  0.541229  0.437490  1
  Mg  Mg151  1  0.236834  0.361377  0.461073  1
  Mg  Mg152  1  0.188668  0.515506  0.485864  1
  Mg  Mg153  1  0.285731  0.708218  0.438052  1
  Mg  Mg154  1  0.570675  0.028248  0.461567  1
  Mg  Mg155  1  0.521525  0.182519  0.485996  1
  Mg  Mg156  1  0.618908  0.374545  0.437648  1
  Mg  Mg157  1  0.854713  0.848996  0.485915  1
  Mg  Mg158  1  0.951640  0.041548  0.437868  1
  Mg  Mg159  1  0.237073  0.861239  0.461617  1
  Mg  Mg160  1  0.188115  0.015961  0.486035  1
  Mg  Mg161  1  0.285616  0.208081  0.438154  1
  Mg  Mg162  1  0.618425  0.874897  0.438075  1
  Mg  Mg163  1  0.711029  0.560990  0.557591  1
  Mg  Mg164  1  0.377651  0.394225  0.558222  1
  Mg  Mg165  1  0.473935  0.585992  0.509631  1
  Mg  Mg166  1  0.710684  0.061340  0.558013  1
  Mg  Mg167  1  0.807501  0.253306  0.509420  1
  Mg  Mg168  1  0.756461  0.406605  0.533504  1
  Mg  Mg169  1  0.044342  0.227870  0.557774  1
  Mg  Mg170  1  0.141288  0.419517  0.509644  1
  Mg  Mg171  1  0.090400  0.572493  0.533861  1
  Mg  Mg172  1  0.377724  0.894525  0.558167  1
  Mg  Mg173  1  0.474338  0.086451  0.509994  1
  Mg  Mg174  1  0.423490  0.239874  0.533935  1
  Mg  Mg175  1  0.807490  0.752690  0.509548  1
  Mg  Mg176  1  0.756694  0.906503  0.533787  1
  Mg  Mg177  1  0.044777  0.727586  0.557903  1
  Mg  Mg178  1  0.140860  0.919747  0.509843  1
  Mg  Mg179  1  0.089948  0.073252  0.533790  1
  Mg  Mg180  1  0.424046  0.739420  0.533439  1
  Mg  Mg181  1  0.568148  0.650346  0.545850  1
  Mg  Mg182  1  0.234991  0.483624  0.546404  1
  Mg  Mg183  1  0.184735  0.636424  0.569842  1
  Mg  Mg184  1  0.567976  0.150897  0.546500  1
  Mg  Mg185  1  0.517913  0.303536  0.569972  1
  Mg  Mg186  1  0.615858  0.496968  0.521520  1
  Mg  Mg187  1  0.901101  0.317632  0.545899  1
  Mg  Mg188  1  0.851106  0.470392  0.569516  1
  Mg  Mg189  1  0.949655  0.663240  0.521565  1
  Mg  Mg190  1  0.234595  0.984246  0.546510  1
  Mg  Mg191  1  0.184917  0.136847  0.569722  1
  Mg  Mg192  1  0.282756  0.330380  0.521737  1
  Mg  Mg193  1  0.518000  0.803423  0.569583  1
  Mg  Mg194  1  0.615975  0.997191  0.521865  1
  Mg  Mg195  1  0.901349  0.817203  0.546217  1
  Mg  Mg196  1  0.851064  0.970564  0.569758  1
  Mg  Mg197  1  0.949184  0.163948  0.521464  1
  Mg  Mg198  1  0.282995  0.830286  0.521806  1
  Mg  Mg199  1  0.758771  0.657368  0.533885  1
  Mg  Mg200  1  0.425451  0.490549  0.534256  1
  Mg  Mg201  1  0.376676  0.642993  0.557707  1
  Mg  Mg202  1  0.758374  0.158006  0.534227  1
  Mg  Mg203  1  0.709900  0.309810  0.557672  1
  Mg  Mg204  1  0.806548  0.502203  0.509220  1
  Mg  Mg205  1  0.091882  0.324694  0.534553  1
  Mg  Mg206  1  0.043586  0.475890  0.557709  1
  Mg  Mg207  1  0.140615  0.668400  0.509930  1
  Mg  Mg208  1  0.425331  0.991146  0.534541  1
  Mg  Mg209  1  0.376794  0.143346  0.558024  1
  Mg  Mg210  1  0.473525  0.335764  0.509922  1
  Mg  Mg211  1  0.709905  0.809645  0.557518  1
  Mg  Mg212  1  0.806524  1.002603  0.509831  1
  Mg  Mg213  1  0.092044  0.824434  0.534417  1
  Mg  Mg214  1  0.043168  0.976623  0.557771  1
  Mg  Mg215  1  0.140142  0.168967  0.509786  1
  Mg  Mg216  1  0.473483  0.835780  0.509873  1
  Mg  Mg217  1  0.564477  0.523800  0.630750  1
  Mg  Mg218  1  0.231347  0.356894  0.630956  1
  Mg  Mg219  1  0.328927  0.548096  0.582893  1
  Mg  Mg220  1  0.564876  0.023838  0.630998  1
  Mg  Mg221  1  0.661937  0.215093  0.583076  1
  Mg  Mg222  1  0.612206  0.368593  0.604544  1
  Mg  Mg223  1  0.897253  0.190149  0.630451  1
  Mg  Mg224  1  0.994569  0.381712  0.583181  1
  Mg  Mg225  1  0.946019  0.535198  0.604193  1
  Mg  Mg226  1  0.232085  0.857181  0.630708  1
  Mg  Mg227  1  0.328875  0.048541  0.583115  1
  Mg  Mg228  1  0.278959  0.201914  0.604702  1
  Mg  Mg229  1  0.662006  0.714797  0.582538  1
  Mg  Mg230  1  0.612345  0.868561  0.604246  1
  Mg  Mg231  1  0.898222  0.690465  0.630556  1
  Mg  Mg232  1  0.995122  0.881800  0.582901  1
  Mg  Mg233  1  0.945781  0.035455  0.604454  1
  Mg  Mg234  1  0.278762  0.701614  0.604416  1
  Mg  Mg235  1  0.424527  0.613373  0.618416  1
  Mg  Mg236  1  0.091201  0.446447  0.618689  1
  Mg  Mg237  1  0.041466  0.598301  0.640210  1
  Mg  Mg238  1  0.424704  0.113637  0.618779  1
  Mg  Mg239  1  0.374858  0.264770  0.640633  1
  Mg  Mg240  1  0.470939  0.459167  0.594261  1
  Mg  Mg241  1  0.757622  0.280280  0.618468  1
  Mg  Mg242  1  0.707588  0.431693  0.640451  1
  Mg  Mg243  1  0.804473  0.625829  0.593847  1
  Mg  Mg244  1  0.091397  0.946897  0.618441  1
  Mg  Mg245  1  0.041047  0.098516  0.640436  1
  Mg  Mg246  1  0.136997  0.292719  0.594546  1
  Mg  Mg247  1  0.374642  0.764684  0.640143  1
  Mg  Mg248  1  0.471202  0.959462  0.594305  1
  Mg  Mg249  1  0.758007  0.780079  0.618126  1
  Mg  Mg250  1  0.707895  0.931512  0.640253  1
  Mg  Mg251  1  0.804110  0.125815  0.594066  1
  Mg  Mg252  1  0.137974  0.792719  0.594144  1
  Mg  Mg253  1  0.616243  0.618388  0.606394  1
  Mg  Mg254  1  0.282955  0.451870  0.607048  1
  Mg  Mg255  1  0.232234  0.607112  0.630002  1
  Mg  Mg256  1  0.616338  0.118491  0.606946  1
  Mg  Mg257  1  0.565398  0.274602  0.630249  1
  Mg  Mg258  1  0.659822  0.465693  0.581613  1
  Mg  Mg259  1  0.948680  0.284951  0.606185  1
  Mg  Mg260  1  0.898244  0.441725  0.630075  1
  Mg  Mg261  1  0.993591  0.632121  0.581536  1
  Mg  Mg262  1  0.283229  0.952147  0.606922  1
  Mg  Mg263  1  0.232263  0.107584  0.630105  1
  Mg  Mg264  1  0.326541  0.298714  0.581853  1
  Mg  Mg265  1  0.565464  0.774219  0.629634  1
  Mg  Mg266  1  0.660041  0.965797  0.581740  1
  Mg  Mg267  1  0.949972  0.785071  0.606533  1
  Mg  Mg268  1  0.898716  0.941214  0.629847  1
  Mg  Mg269  1  0.993231  0.132404  0.581516  1
  Mg  Mg270  1  0.327130  0.798546  0.581551  1
  Mg  Mg271  1  0.430006  0.486815  0.701277  1
  Mg  Mg272  1  0.094456  0.318851  0.701850  1
  Mg  Mg273  1  0.188814  0.512402  0.653577  1
  Mg  Mg274  1  0.431315  0.986311  0.701396  1
  Mg  Mg275  1  0.522850  0.179386  0.653336  1
  Mg  Mg276  1  0.463940  0.329799  0.677365  1
  Mg  Mg277  1  0.763882  0.153538  0.701265  1
  Mg  Mg278  1  0.855621  0.346519  0.652418  1
  Mg  Mg279  1  0.796381  0.496959  0.676999  1
  Mg  Mg280  1  0.097456  0.819632  0.701279  1
  Mg  Mg281  1  0.188874  0.012785  0.653178  1
  Mg  Mg282  1  0.131313  0.163017  0.677149  1
  Mg  Mg283  1  0.522493  0.679406  0.652746  1
  Mg  Mg284  1  0.463757  0.829649  0.676687  1
  Mg  Mg285  1  0.763646  0.653438  0.700897  1
  Mg  Mg286  1  0.855855  0.846108  0.652634  1
  Mg  Mg287  1  0.797465  0.996171  0.677007  1
  Mg  Mg288  1  0.130420  0.663533  0.676692  1
  Mg  Mg289  1  0.281895  0.580640  0.690805  1
  Mg  Mg290  1  0.948246  0.414937  0.691088  1
  Mg  Mg291  1  0.901422  0.556729  0.711273  1
  Mg  Mg292  1  0.282395  0.079591  0.690807  1
  Mg  Mg293  1  0.234927  0.223036  0.711858  1
  Mg  Mg294  1  0.328119  0.421541  0.667277  1
  Mg  Mg295  1  0.615958  0.246856  0.690817  1
  Mg  Mg296  1  0.568909  0.390222  0.711537  1
  Mg  Mg297  1  0.661359  0.588794  0.666726  1
  Mg  Mg298  1  0.948897  0.912890  0.690432  1
  Mg  Mg299  1  0.901188  0.056549  0.711457  1
  Mg  Mg300  1  -0.003942  0.253765  0.665627  1
  Mg  Mg301  1  0.235197  0.722541  0.711399  1
  Mg  Mg302  1  0.328434  0.921919  0.667160  1
  Mg  Mg303  1  0.615304  0.746774  0.690355  1
  Mg  Mg304  1  0.568474  0.888932  0.711338  1
  Mg  Mg305  1  0.661911  0.088287  0.667285  1
  Mg  Mg306  1  0.994842  0.755426  0.666854  1
  Mg  Mg307  1  0.470670  0.586900  0.679586  1
  Mg  Mg308  1  0.137217  0.418720  0.679798  1
  Mg  Mg309  1  0.087187  0.564800  0.700598  1
  Mg  Mg310  1  0.471107  0.086549  0.679857  1
  Mg  Mg311  1  0.421317  0.229969  0.700734  1
  Mg  Mg312  1  0.516268  0.424871  0.652751  1
  Mg  Mg313  1  0.804998  0.253258  0.679403  1
  Mg  Mg314  1  0.755722  0.396961  0.700674  1
  Mg  Mg315  1  0.849884  0.591691  0.652364  1
  Mg  Mg316  1  0.137594  0.919639  0.679478  1
  Mg  Mg317  1  0.087177  0.063779  0.700503  1
  Mg  Mg318  1  0.183561  0.258344  0.652992  1
  Mg  Mg319  1  0.421149  0.729950  0.700235  1
  Mg  Mg320  1  0.516590  0.924949  0.652627  1
  Mg  Mg321  1  0.803946  0.753547  0.679286  1
  Mg  Mg322  1  0.754527  0.896196  0.700219  1
  Mg  Mg323  1  0.849840  0.091703  0.652718  1
  Mg  Mg324  1  0.183277  0.758555  0.652576  1
  Al  Al325  1  0.093638  0.705168  0.288991  1
  Al  Al326  1  0.616553  0.501846  0.352033  1
  Al  Al327  1  0.714562  0.695067  0.310377  1
  Al  Al328  1  0.090459  0.203734  0.289005  1
  Al  Al329  1  0.051802  0.352367  0.309996  1
  Al  Al330  1  0.001862  0.517018  0.333244  1
  Al  Al331  1  0.425342  0.369153  0.288801  1
  Al  Al332  1  0.378582  0.523723  0.310293  1
  Al  Al333  1  0.333286  0.682498  0.332522  1
  Al  Al334  1  0.758964  0.036762  0.288889  1
  Al  Al335  1  0.715225  0.190134  0.309951  1
  Al  Al336  1  0.666889  0.349756  0.332042  1
  Al  Al337  1  0.048775  0.858153  0.310245  1
  Al  Al338  1  0.000009  0.014213  0.332622  1
  Al  Al339  1  0.424130  0.871802  0.288857  1
  Al  Al340  1  0.381995  0.024913  0.310265  1
  Al  Al341  1  0.335074  0.179852  0.333009  1
  Al  Al342  1  0.667065  0.847998  0.332681  1
  Al  Al343  1  0.952132  0.669011  0.352346  1
  Al  Al344  1  0.476492  0.463763  0.425922  1
  Al  Al345  1  0.572130  0.655042  0.375820  1
  Al  Al346  1  0.951733  0.167925  0.352190  1
  Al  Al347  1  0.903731  0.323031  0.376815  1
  Al  Al348  1  0.858563  0.476996  0.401030  1
  Al  Al349  1  0.285903  0.334034  0.352043  1
  Al  Al350  1  0.236829  0.489288  0.376602  1
  Al  Al351  1  0.192117  0.643465  0.402602  1
  Al  Al352  1  0.619903  1.001193  0.352469  1
  Al  Al353  1  0.571696  0.155846  0.377249  1
  Al  Al354  1  0.524946  0.309754  0.402239  1
  Al  Al355  1  0.904708  0.822395  0.377514  1
  Al  Al356  1  0.858231  0.976124  0.402399  1
  Al  Al357  1  0.286117  0.835553  0.352504  1
  Al  Al358  1  0.237614  0.989173  0.377401  1
  Al  Al359  1  0.191732  0.142618  0.402519  1
  Al  Al360  1  0.524484  0.810191  0.402488  1
  Al  Al361  1  0.809119  0.630005  0.425508  1
  Al  Al362  1  0.331472  0.425891  0.497881  1
  Al  Al363  1  0.427817  0.617299  0.449422  1
  Al  Al364  1  0.809776  0.130882  0.425946  1
  Al  Al365  1  0.761279  0.284778  0.449225  1
  Al  Al366  1  0.712232  0.438763  0.473166  1
  Al  Al367  1  0.143604  0.297125  0.426134  1
  Al  Al368  1  0.095147  0.450824  0.449444  1
  Al  Al369  1  0.046336  0.604844  0.473583  1
  Al  Al370  1  0.476907  0.963842  0.426388  1
  Al  Al371  1  0.428239  0.117535  0.449965  1
  Al  Al372  1  0.379181  0.272073  0.473614  1
  Al  Al373  1  0.760952  0.784029  0.449701  1
  Al  Al374  1  0.712509  0.938715  0.473664  1
  Al  Al375  1  0.143229  0.797068  0.426454  1
  Al  Al376  1  0.094434  0.950888  0.449893  1
  Al  Al377  1  0.045699  0.105455  0.473437  1
  Al  Al378  1  0.379796  0.771681  0.473483  1
  Al  Al379  1  0.664832  0.592456  0.497305  1
  Al  Al380  1  0.186801  0.388393  0.570427  1
  Al  Al381  1  0.282554  0.579096  0.522102  1
  Al  Al382  1  0.664564  0.093114  0.498000  1
  Al  Al383  1  0.615518  0.246311  0.522147  1
  Al  Al384  1  0.567005  0.400366  0.545604  1
  Al  Al385  1  -0.002182  0.259769  0.497775  1
  Al  Al386  1  0.948636  0.412944  0.521889  1
  Al  Al387  1  0.900406  0.566807  0.545228  1
  Al  Al388  1  0.331208  0.926310  0.498231  1
  Al  Al389  1  0.282491  0.079577  0.522217  1
  Al  Al390  1  0.233276  0.233931  0.545809  1
  Al  Al391  1  0.615542  0.745862  0.521707  1
  Al  Al392  1  0.566926  0.900544  0.545618  1
  Al  Al393  1  -0.001963  0.759183  0.498036  1
  Al  Al394  1  0.948695  0.912969  0.522125  1
  Al  Al395  1  0.899983  0.067381  0.545480  1
  Al  Al396  1  0.233839  0.733514  0.545608  1
  Al  Al397  1  0.519814  0.555050  0.570134  1
  Al  Al398  1  0.042842  0.351765  0.644258  1
  Al  Al399  1  0.137853  0.540854  0.593735  1
  Al  Al400  1  0.519911  0.055388  0.570495  1
  Al  Al401  1  0.471204  0.208110  0.593872  1
  Al  Al402  1  0.420870  0.361924  0.618306  1
  Al  Al403  1  0.852896  0.221920  0.569984  1
  Al  Al404  1  0.803550  0.375142  0.593123  1
  Al  Al405  1  0.754268  0.528835  0.617872  1
  Al  Al406  1  0.186869  0.888633  0.570338  1
  Al  Al407  1  0.137556  0.041621  0.593685  1
  Al  Al408  1  0.088668  0.194830  0.617626  1
  Al  Al409  1  0.471072  0.707773  0.593298  1
  Al  Al410  1  0.421365  0.862045  0.617998  1
  Al  Al411  1  0.853461  0.721663  0.570001  1
  Al  Al412  1  0.804243  0.874761  0.593388  1
  Al  Al413  1  0.754525  0.028823  0.618176  1
  Al  Al414  1  0.088105  0.695366  0.617969  1
  Al  Al415  1  0.378091  0.518726  0.643460  1
  Al  Al416  1  0.908878  0.317651  0.707405  1
  Al  Al417  1  0.992852  0.505875  0.663077  1
  Al  Al418  1  0.378467  0.018831  0.643496  1
  Al  Al419  1  0.325839  0.171803  0.663451  1
  Al  Al420  1  0.278386  0.320111  0.685996  1
  Al  Al421  1  0.711157  0.185263  0.643282  1
  Al  Al422  1  0.660341  0.338608  0.663566  1
  Al  Al423  1  0.611145  0.487531  0.685631  1
  Al  Al424  1  0.045155  0.852153  0.643168  1
  Al  Al425  1  0.992354  1.005194  0.663157  1
  Al  Al426  1  0.945044  0.154574  0.685840  1
  Al  Al427  1  0.325535  0.671918  0.662966  1
  Al  Al428  1  0.278684  0.820202  0.685601  1
  Al  Al429  1  0.711613  0.685487  0.642948  1
  Al  Al430  1  0.658906  0.838465  0.662801  1
  Al  Al431  1  0.612210  0.986672  0.685750  1
  Al  Al432  1  0.944820  0.654102  0.685398  1
