# generated using pymatgen
data_AlCu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.00010654
_cell_length_b   17.82762135
_cell_length_c   49.49321258
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   75.31160092
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCu3
_chemical_formula_sum   'Al126 Cu378'
_cell_volume   13656.2572421
_cell_formula_units_Z   126
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
  Al  Al1  1  0.971359  0.479406  0.269547  1
  Al  Al2  1  0.304693  0.146073  0.269547  1
  Al  Al3  1  0.232690  0.421873  0.311982  1
  Al  Al4  1  0.600655  0.453548  0.288889  1
  Al  Al5  1  0.933988  0.120214  0.288889  1
  Al  Al6  1  0.267322  0.786881  0.288889  1
  Al  Al7  1  0.638026  0.812739  0.269547  1
  Al  Al8  1  0.566023  0.088540  0.311982  1
  Al  Al9  1  0.899357  0.755206  0.311982  1
  Al  Al10  1  0.040135  0.279173  0.292142  1
  Al  Al11  1  0.373468  0.945840  0.292142  1
  Al  Al12  1  0.409868  0.310299  0.273069  1
  Al  Al13  1  0.665662  0.251302  0.317464  1
  Al  Al14  1  0.998995  0.917968  0.317464  1
  Al  Al15  1  0.332329  0.584635  0.317464  1
  Al  Al16  1  0.706801  0.612506  0.292142  1
  Al  Al17  1  0.743201  0.976965  0.273069  1
  Al  Al18  1  0.076534  0.643632  0.273069  1
  Al  Al19  1  0.857688  0.393218  0.335442  1
  Al  Al20  1  0.191022  0.059885  0.335442  1
  Al  Al21  1  0.114080  0.335130  0.379531  1
  Al  Al22  1  0.486750  0.363951  0.357473  1
  Al  Al23  1  0.820083  0.030618  0.357473  1
  Al  Al24  1  0.153416  0.697284  0.357473  1
  Al  Al25  1  0.524355  0.726552  0.335442  1
  Al  Al26  1  0.447413  1.001797  0.379531  1
  Al  Al27  1  0.780746  0.668463  0.379531  1
  Al  Al28  1  0.922270  0.193823  0.361187  1
  Al  Al29  1  0.255603  0.860489  0.361187  1
  Al  Al30  1  0.294700  0.222330  0.338791  1
  Al  Al31  1  0.550237  0.164297  0.383093  1
  Al  Al32  1  0.883570  0.830964  0.383093  1
  Al  Al33  1  0.216903  0.497631  0.383093  1
  Al  Al34  1  0.588936  0.527156  0.361187  1
  Al  Al35  1  0.628034  0.888997  0.338791  1
  Al  Al36  1  0.961367  0.555663  0.338791  1
  Al  Al37  1  0.742381  0.306004  0.402101  1
  Al  Al38  1  0.075715  0.972670  0.402101  1
  Al  Al39  1  0.997926  0.247854  0.446520  1
  Al  Al40  1  0.369935  0.276789  0.424244  1
  Al  Al41  1  0.703269  0.943456  0.424244  1
  Al  Al42  1  0.036602  0.610122  0.424244  1
  Al  Al43  1  0.409048  0.639337  0.402101  1
  Al  Al44  1  0.331259  0.914521  0.446520  1
  Al  Al45  1  0.664593  0.581187  0.446520  1
  Al  Al46  1  0.805929  0.106158  0.427689  1
  Al  Al47  1  0.139262  0.772824  0.427689  1
  Al  Al48  1  0.178130  0.135201  0.405424  1
  Al  Al49  1  0.433902  0.077129  0.449925  1
  Al  Al50  1  0.767235  0.743796  0.449925  1
  Al  Al51  1  0.100569  0.410462  0.449925  1
  Al  Al52  1  0.472595  0.439491  0.427689  1
  Al  Al53  1  0.511463  0.801868  0.405424  1
  Al  Al54  1  0.844796  0.468534  0.405424  1
  Al  Al55  1  0.625677  0.218652  0.468780  1
  Al  Al56  1  0.959010  0.885318  0.468780  1
  Al  Al57  1  0.881408  0.160487  0.513338  1
  Al  Al58  1  0.253563  0.189652  0.491041  1
  Al  Al59  1  0.586896  0.856318  0.491041  1
  Al  Al60  1  0.920230  0.522985  0.491041  1
  Al  Al61  1  0.292344  0.551985  0.468780  1
  Al  Al62  1  0.214741  0.827153  0.513338  1
  Al  Al63  1  0.548075  0.493820  0.513338  1
  Al  Al64  1  0.689541  0.018906  0.494495  1
  Al  Al65  1  0.022874  0.685573  0.494495  1
  Al  Al66  1  0.061743  0.047987  0.472242  1
  Al  Al67  1  0.317427  0.989758  0.516794  1
  Al  Al68  1  0.650760  0.656425  0.516794  1
  Al  Al69  1  0.984093  0.323092  0.516794  1
  Al  Al70  1  0.356208  0.352240  0.494495  1
  Al  Al71  1  0.395077  0.714654  0.472242  1
  Al  Al72  1  0.728410  0.381320  0.472242  1
  Al  Al73  1  0.509413  0.131412  0.535571  1
  Al  Al74  1  0.842746  0.798079  0.535571  1
  Al  Al75  1  0.765388  0.073269  0.580145  1
  Al  Al76  1  0.136865  0.102293  0.557882  1
  Al  Al77  1  0.470198  0.768959  0.557882  1
  Al  Al78  1  0.803531  0.435626  0.557882  1
  Al  Al79  1  0.176080  0.464746  0.535571  1
  Al  Al80  1  0.098722  0.739935  0.580145  1
  Al  Al81  1  0.432055  0.406602  0.580145  1
  Al  Al82  1  0.573120  0.931665  0.561296  1
  Al  Al83  1  0.906453  0.598331  0.561296  1
  Al  Al84  1  0.945311  0.960707  0.539072  1
  Al  Al85  1  0.200848  0.902381  0.583637  1
  Al  Al86  1  0.534182  0.569047  0.583637  1
  Al  Al87  1  0.867515  0.235714  0.583637  1
  Al  Al88  1  0.239786  0.264998  0.561296  1
  Al  Al89  1  0.278645  0.627374  0.539072  1
  Al  Al90  1  0.611978  0.294041  0.539072  1
  Al  Al91  1  0.392706  0.044257  0.602319  1
  Al  Al92  1  0.726039  0.710924  0.602319  1
  Al  Al93  1  0.648987  0.985464  0.646494  1
  Al  Al94  1  0.020722  0.015253  0.624771  1
  Al  Al95  1  0.354055  0.681919  0.624771  1
  Al  Al96  1  0.687389  0.348586  0.624771  1
  Al  Al97  1  0.059373  0.377591  0.602319  1
  Al  Al98  1  0.982320  0.652131  0.646494  1
  Al  Al99  1  0.315653  0.318798  0.646494  1
  Al  Al100  1  0.456271  0.844271  0.628132  1
  Al  Al101  1  0.789604  0.510938  0.628132  1
  Al  Al102  1  0.829057  0.873642  0.605879  1
  Al  Al103  1  0.085655  0.815220  0.650770  1
  Al  Al104  1  0.418988  0.481887  0.650770  1
  Al  Al105  1  0.752322  0.148554  0.650770  1
  Al  Al106  1  0.122937  0.177605  0.628132  1
  Al  Al107  1  0.162391  0.540308  0.605879  1
  Al  Al108  1  0.495724  0.206975  0.605879  1
  Al  Al109  1  0.276303  0.957323  0.668834  1
  Al  Al110  1  0.609636  0.623990  0.668834  1
  Al  Al111  1  0.530487  0.903631  0.715044  1
  Al  Al112  1  0.906492  0.924726  0.692075  1
  Al  Al113  1  0.239825  0.591393  0.692075  1
  Al  Al114  1  0.573159  0.258060  0.692075  1
  Al  Al115  1  0.942970  0.290656  0.668834  1
  Al  Al116  1  0.863821  0.570297  0.715044  1
  Al  Al117  1  0.197154  0.236964  0.715044  1
  Al  Al118  1  0.340549  0.757453  0.695835  1
  Al  Al119  1  0.673883  0.424120  0.695835  1
  Al  Al120  1  0.712176  0.786494  0.671565  1
  Al  Al121  1  0.967971  0.728047  0.717237  1
  Al  Al122  1  0.301304  0.394714  0.717237  1
  Al  Al123  1  0.634637  0.061381  0.717237  1
  Al  Al124  1  0.007216  0.090786  0.695835  1
  Al  Al125  1  0.045509  0.453161  0.671565  1
  Al  Al126  1  0.378842  0.119828  0.671565  1
  Cu  Cu127  1  0.895186  0.255621  0.312787  1
  Cu  Cu128  1  0.228519  0.922288  0.312787  1
  Cu  Cu129  1  0.265093  0.284053  0.290175  1
  Cu  Cu130  1  0.639239  0.312599  0.270154  1
  Cu  Cu131  1  0.972572  0.979265  0.270154  1
  Cu  Cu132  1  0.305906  0.645932  0.270154  1
  Cu  Cu133  1  0.561853  0.588955  0.312787  1
  Cu  Cu134  1  0.598426  0.950720  0.290175  1
  Cu  Cu135  1  0.931760  0.617386  0.290175  1
  Cu  Cu136  1  0.002886  0.416641  0.316929  1
  Cu  Cu137  1  0.336219  0.083308  0.316929  1
  Cu  Cu138  1  0.377039  0.448505  0.294122  1
  Cu  Cu139  1  0.752408  0.470749  0.273942  1
  Cu  Cu140  1  0.085742  0.137416  0.273942  1
  Cu  Cu141  1  0.419075  0.804083  0.273942  1
  Cu  Cu142  1  0.669553  0.749974  0.316929  1
  Cu  Cu143  1  0.710372  0.115172  0.294122  1
  Cu  Cu144  1  0.043705  0.781838  0.294122  1
  Cu  Cu145  1  0.081578  0.520928  0.301690  1
  Cu  Cu146  1  0.414912  0.187595  0.301690  1
  Cu  Cu147  1  0.452847  0.553757  0.280622  1
  Cu  Cu148  1  0.709961  0.491761  0.323969  1
  Cu  Cu149  1  0.043294  0.158428  0.323969  1
  Cu  Cu150  1  0.376627  0.825094  0.323969  1
  Cu  Cu151  1  0.748245  0.854262  0.301690  1
  Cu  Cu152  1  0.786180  0.220424  0.280622  1
  Cu  Cu153  1  0.119513  0.887091  0.280622  1
  Cu  Cu154  1  0.120703  0.384997  0.280246  1
  Cu  Cu155  1  0.454036  0.051663  0.280246  1
  Cu  Cu156  1  0.378231  0.324395  0.323979  1
  Cu  Cu157  1  0.748593  0.353894  0.302154  1
  Cu  Cu158  1  0.081926  0.020561  0.302154  1
  Cu  Cu159  1  0.415259  0.687228  0.302154  1
  Cu  Cu160  1  0.787369  0.718330  0.280246  1
  Cu  Cu161  1  0.711564  0.991061  0.323979  1
  Cu  Cu162  1  0.044897  0.657728  0.323979  1
  Cu  Cu163  1  0.852878  0.515749  0.305842  1
  Cu  Cu164  1  0.186211  0.182415  0.305842  1
  Cu  Cu165  1  0.224214  0.545917  0.283353  1
  Cu  Cu166  1  0.481563  0.487137  0.327610  1
  Cu  Cu167  1  0.814896  0.153804  0.327610  1
  Cu  Cu168  1  0.148230  0.820470  0.327610  1
  Cu  Cu169  1  0.519545  0.849082  0.305842  1
  Cu  Cu170  1  0.557548  0.212583  0.283353  1
  Cu  Cu171  1  0.890881  0.879250  0.283353  1
  Cu  Cu172  1  0.891944  0.375764  0.283940  1
  Cu  Cu173  1  0.225278  0.042431  0.283940  1
  Cu  Cu174  1  0.146866  0.320462  0.327372  1
  Cu  Cu175  1  0.518798  0.350646  0.305395  1
  Cu  Cu176  1  0.852131  0.017312  0.305395  1
  Cu  Cu177  1  0.185465  0.683979  0.305395  1
  Cu  Cu178  1  0.558611  0.709098  0.283940  1
  Cu  Cu179  1  0.480200  0.987128  0.327372  1
  Cu  Cu180  1  0.813533  0.653795  0.327372  1
  Cu  Cu181  1  0.777130  0.169076  0.379140  1
  Cu  Cu182  1  0.110463  0.835742  0.379140  1
  Cu  Cu183  1  0.149276  0.198175  0.356998  1
  Cu  Cu184  1  0.521003  0.226765  0.334553  1
  Cu  Cu185  1  0.854337  0.893432  0.334553  1
  Cu  Cu186  1  0.187670  0.560099  0.334553  1
  Cu  Cu187  1  0.443797  0.502409  0.379140  1
  Cu  Cu188  1  0.482609  0.864842  0.356998  1
  Cu  Cu189  1  0.815942  0.531508  0.356998  1
  Cu  Cu190  1  0.887461  0.330376  0.383745  1
  Cu  Cu191  1  0.220795  0.997043  0.383745  1
  Cu  Cu192  1  0.258943  0.359558  0.361135  1
  Cu  Cu193  1  0.630498  0.389831  0.338682  1
  Cu  Cu194  1  0.963831  0.056498  0.338682  1
  Cu  Cu195  1  0.297164  0.723164  0.338682  1
  Cu  Cu196  1  0.554128  0.663709  0.383745  1
  Cu  Cu197  1  0.592276  0.026225  0.361135  1
  Cu  Cu198  1  0.925610  0.692891  0.361135  1
  Cu  Cu199  1  0.966840  0.433047  0.368496  1
  Cu  Cu200  1  0.300174  0.099714  0.368496  1
  Cu  Cu201  1  0.339013  0.461609  0.346207  1
  Cu  Cu202  1  0.594543  0.404166  0.390817  1
  Cu  Cu203  1  0.927876  0.070832  0.390817  1
  Cu  Cu204  1  0.261209  0.737499  0.390817  1
  Cu  Cu205  1  0.633507  0.766380  0.368496  1
  Cu  Cu206  1  0.672346  0.128276  0.346207  1
  Cu  Cu207  1  0.005680  0.794943  0.346207  1
  Cu  Cu208  1  0.006169  0.295056  0.345552  1
  Cu  Cu209  1  0.339502  0.961723  0.345552  1
  Cu  Cu210  1  0.261310  0.237306  0.390782  1
  Cu  Cu211  1  0.633340  0.266562  0.368867  1
  Cu  Cu212  1  0.966673  0.933228  0.368867  1
  Cu  Cu213  1  0.300007  0.599895  0.368867  1
  Cu  Cu214  1  0.672836  0.628390  0.345552  1
  Cu  Cu215  1  0.594644  0.903972  0.390782  1
  Cu  Cu216  1  0.927977  0.570639  0.390782  1
  Cu  Cu217  1  0.736113  0.428653  0.372075  1
  Cu  Cu218  1  0.069446  0.095319  0.372075  1
  Cu  Cu219  1  0.109435  0.457218  0.349326  1
  Cu  Cu220  1  0.364337  0.399371  0.394245  1
  Cu  Cu221  1  0.697670  0.066037  0.394245  1
  Cu  Cu222  1  0.031003  0.732704  0.394245  1
  Cu  Cu223  1  0.402779  0.761986  0.372075  1
  Cu  Cu224  1  0.442769  0.123885  0.349326  1
  Cu  Cu225  1  0.776102  0.790551  0.349326  1
  Cu  Cu226  1  0.774836  0.291598  0.350015  1
  Cu  Cu227  1  0.108169  0.958265  0.350015  1
  Cu  Cu228  1  0.031010  0.233428  0.394318  1
  Cu  Cu229  1  0.402951  0.262223  0.372077  1
  Cu  Cu230  1  0.736284  0.928890  0.372077  1
  Cu  Cu231  1  0.069617  0.595557  0.372077  1
  Cu  Cu232  1  0.441503  0.624931  0.350015  1
  Cu  Cu233  1  0.364343  0.900095  0.394318  1
  Cu  Cu234  1  0.697676  0.566761  0.394318  1
  Cu  Cu235  1  0.660951  0.081752  0.445920  1
  Cu  Cu236  1  0.994284  0.748418  0.445920  1
  Cu  Cu237  1  0.033130  0.111049  0.423695  1
  Cu  Cu238  1  0.405297  0.140028  0.401253  1
  Cu  Cu239  1  0.738630  0.806695  0.401253  1
  Cu  Cu240  1  0.071963  0.473361  0.401253  1
  Cu  Cu241  1  0.327617  0.415085  0.445920  1
  Cu  Cu242  1  0.366463  0.777716  0.423695  1
  Cu  Cu243  1  0.699796  0.444383  0.423695  1
  Cu  Cu244  1  0.770700  0.242996  0.450590  1
  Cu  Cu245  1  0.104034  0.909663  0.450590  1
  Cu  Cu246  1  0.142839  0.272184  0.428206  1
  Cu  Cu247  1  0.514752  0.301189  0.406069  1
  Cu  Cu248  1  0.848086  0.967856  0.406069  1
  Cu  Cu249  1  0.181419  0.634523  0.406069  1
  Cu  Cu250  1  0.437367  0.576329  0.450590  1
  Cu  Cu251  1  0.476173  0.938850  0.428206  1
  Cu  Cu252  1  0.809506  0.605517  0.428206  1
  Cu  Cu253  1  0.850431  0.346066  0.435423  1
  Cu  Cu254  1  0.183764  0.012732  0.435423  1
  Cu  Cu255  1  0.222336  0.375033  0.412986  1
  Cu  Cu256  1  0.478118  0.316842  0.457654  1
  Cu  Cu257  1  0.811452  0.983509  0.457654  1
  Cu  Cu258  1  0.144785  0.650176  0.457654  1
  Cu  Cu259  1  0.517097  0.679399  0.435423  1
  Cu  Cu260  1  0.555670  0.041699  0.412986  1
  Cu  Cu261  1  0.889003  0.708366  0.412986  1
  Cu  Cu262  1  0.889351  0.208110  0.413160  1
  Cu  Cu263  1  0.222684  0.874777  0.413160  1
  Cu  Cu264  1  0.145096  0.149959  0.457596  1
  Cu  Cu265  1  0.517150  0.178910  0.435279  1
  Cu  Cu266  1  0.850483  0.845577  0.435279  1
  Cu  Cu267  1  0.183817  0.512244  0.435279  1
  Cu  Cu268  1  0.556018  0.541444  0.413160  1
  Cu  Cu269  1  0.478429  0.816626  0.457596  1
  Cu  Cu270  1  0.811763  0.483293  0.457596  1
  Cu  Cu271  1  0.620184  0.341346  0.438832  1
  Cu  Cu272  1  0.953518  0.008012  0.438832  1
  Cu  Cu273  1  0.992497  0.370526  0.416578  1
  Cu  Cu274  1  0.248026  0.312230  0.461075  1
  Cu  Cu275  1  0.581360  0.978897  0.461075  1
  Cu  Cu276  1  0.914693  0.645564  0.461075  1
  Cu  Cu277  1  0.286851  0.674679  0.438832  1
  Cu  Cu278  1  0.325830  0.037193  0.416578  1
  Cu  Cu279  1  0.659164  0.703859  0.416578  1
  Cu  Cu280  1  0.658768  0.203971  0.416685  1
  Cu  Cu281  1  0.992101  0.870638  0.416685  1
  Cu  Cu282  1  0.914539  0.145856  0.461193  1
  Cu  Cu283  1  0.286664  0.174946  0.438872  1
  Cu  Cu284  1  0.619997  0.841612  0.438872  1
  Cu  Cu285  1  0.953331  0.508279  0.438872  1
  Cu  Cu286  1  0.325434  0.537305  0.416685  1
  Cu  Cu287  1  0.247872  0.812523  0.461193  1
  Cu  Cu288  1  0.581206  0.479190  0.461193  1
  Cu  Cu289  1  0.544573  0.994577  0.512752  1
  Cu  Cu290  1  0.877907  0.661243  0.512752  1
  Cu  Cu291  1  0.916757  0.023607  0.490495  1
  Cu  Cu292  1  0.288927  0.052802  0.468243  1
  Cu  Cu293  1  0.622261  0.719468  0.468243  1
  Cu  Cu294  1  0.955594  0.386135  0.468243  1
  Cu  Cu295  1  0.211240  0.327910  0.512752  1
  Cu  Cu296  1  0.250090  0.690273  0.490495  1
  Cu  Cu297  1  0.583424  0.356940  0.490495  1
  Cu  Cu298  1  0.654333  0.155776  0.517335  1
  Cu  Cu299  1  0.987666  0.822443  0.517335  1
  Cu  Cu300  1  0.026417  0.184839  0.495077  1
  Cu  Cu301  1  0.398565  0.213941  0.472794  1
  Cu  Cu302  1  0.731898  0.880607  0.472794  1
  Cu  Cu303  1  0.065232  0.547274  0.472794  1
  Cu  Cu304  1  0.321000  0.489109  0.517335  1
  Cu  Cu305  1  0.359751  0.851505  0.495077  1
  Cu  Cu306  1  0.693084  0.518172  0.495077  1
  Cu  Cu307  1  0.733837  0.258678  0.502197  1
  Cu  Cu308  1  0.067171  0.925344  0.502197  1
  Cu  Cu309  1  0.106023  0.287856  0.479910  1
  Cu  Cu310  1  0.361775  0.229626  0.524447  1
  Cu  Cu311  1  0.695108  0.896292  0.524447  1
  Cu  Cu312  1  0.028441  0.562959  0.524447  1
  Cu  Cu313  1  0.400504  0.592011  0.502197  1
  Cu  Cu314  1  0.439356  0.954523  0.479910  1
  Cu  Cu315  1  0.772689  0.621189  0.479910  1
  Cu  Cu316  1  0.772888  0.120772  0.479850  1
  Cu  Cu317  1  0.106222  0.787438  0.479850  1
  Cu  Cu318  1  0.028570  0.062598  0.524395  1
  Cu  Cu319  1  0.400797  0.091742  0.502122  1
  Cu  Cu320  1  0.734131  0.758409  0.502122  1
  Cu  Cu321  1  0.067464  0.425075  0.502122  1
  Cu  Cu322  1  0.439555  0.454105  0.479850  1
  Cu  Cu323  1  0.361903  0.729265  0.524395  1
  Cu  Cu324  1  0.695237  0.395932  0.524395  1
  Cu  Cu325  1  0.503809  0.254053  0.505648  1
  Cu  Cu326  1  0.837142  0.920720  0.505648  1
  Cu  Cu327  1  0.875996  0.283121  0.483389  1
  Cu  Cu328  1  0.131627  0.224904  0.527915  1
  Cu  Cu329  1  0.464960  0.891571  0.527915  1
  Cu  Cu330  1  0.798294  0.558237  0.527915  1
  Cu  Cu331  1  0.170476  0.587386  0.505648  1
  Cu  Cu332  1  0.209329  0.949787  0.483389  1
  Cu  Cu333  1  0.542663  0.616454  0.483389  1
  Cu  Cu334  1  0.542359  0.116773  0.483423  1
  Cu  Cu335  1  0.875692  0.783440  0.483423  1
  Cu  Cu336  1  0.798146  0.058600  0.527966  1
  Cu  Cu337  1  0.170229  0.087669  0.505716  1
  Cu  Cu338  1  0.503563  0.754336  0.505716  1
  Cu  Cu339  1  0.836896  0.421003  0.505716  1
  Cu  Cu340  1  0.209025  0.450107  0.483423  1
  Cu  Cu341  1  0.131479  0.725267  0.527966  1
  Cu  Cu342  1  0.464812  0.391934  0.527966  1
  Cu  Cu343  1  0.428003  0.907295  0.579540  1
  Cu  Cu344  1  0.761336  0.573962  0.579540  1
  Cu  Cu345  1  0.800512  0.936355  0.557293  1
  Cu  Cu346  1  0.172374  0.965446  0.535054  1
  Cu  Cu347  1  0.505708  0.632112  0.535054  1
  Cu  Cu348  1  0.839041  0.298779  0.535054  1
  Cu  Cu349  1  0.094670  0.240629  0.579540  1
  Cu  Cu350  1  0.133845  0.603022  0.557293  1
  Cu  Cu351  1  0.467179  0.269689  0.557293  1
  Cu  Cu352  1  0.538023  0.068564  0.584124  1
  Cu  Cu353  1  0.871357  0.735231  0.584124  1
  Cu  Cu354  1  0.910107  0.097522  0.561927  1
  Cu  Cu355  1  0.282037  0.126646  0.539590  1
  Cu  Cu356  1  0.615371  0.793313  0.539590  1
  Cu  Cu357  1  0.948704  0.459979  0.539590  1
  Cu  Cu358  1  0.204690  0.401898  0.584124  1
  Cu  Cu359  1  0.243441  0.764188  0.561927  1
  Cu  Cu360  1  0.576774  0.430855  0.561927  1
  Cu  Cu361  1  0.617688  0.171377  0.569031  1
  Cu  Cu362  1  0.951021  0.838044  0.569031  1
  Cu  Cu363  1  0.989438  0.200510  0.546756  1
  Cu  Cu364  1  0.244919  0.142298  0.591153  1
  Cu  Cu365  1  0.578252  0.808965  0.591153  1
  Cu  Cu366  1  0.911586  0.475631  0.591153  1
  Cu  Cu367  1  0.284355  0.504710  0.569031  1
  Cu  Cu368  1  0.322771  0.867176  0.546756  1
  Cu  Cu369  1  0.656104  0.533843  0.546756  1
  Cu  Cu370  1  0.656641  0.033571  0.546630  1
  Cu  Cu371  1  0.989974  0.700238  0.546630  1
  Cu  Cu372  1  0.912553  0.975231  0.591282  1
  Cu  Cu373  1  0.284095  0.004434  0.568932  1
  Cu  Cu374  1  0.617428  0.671101  0.568932  1
  Cu  Cu375  1  0.950761  0.337767  0.568932  1
  Cu  Cu376  1  0.323308  0.366904  0.546630  1
  Cu  Cu377  1  0.245887  0.641897  0.591282  1
  Cu  Cu378  1  0.579220  0.308564  0.591282  1
  Cu  Cu379  1  0.387463  0.166810  0.572379  1
  Cu  Cu380  1  0.720796  0.833477  0.572379  1
  Cu  Cu381  1  0.759524  0.195853  0.550220  1
  Cu  Cu382  1  0.015040  0.137647  0.594841  1
  Cu  Cu383  1  0.348373  0.804314  0.594841  1
  Cu  Cu384  1  0.681706  0.470981  0.594841  1
  Cu  Cu385  1  0.054130  0.500143  0.572379  1
  Cu  Cu386  1  0.092857  0.862520  0.550220  1
  Cu  Cu387  1  0.426190  0.529187  0.550220  1
  Cu  Cu388  1  0.425898  0.029522  0.550224  1
  Cu  Cu389  1  0.759231  0.696189  0.550224  1
  Cu  Cu390  1  0.681813  0.971536  0.594604  1
  Cu  Cu391  1  0.053799  1.000322  0.572567  1
  Cu  Cu392  1  0.387133  0.666989  0.572567  1
  Cu  Cu393  1  0.720466  0.333655  0.572567  1
  Cu  Cu394  1  0.092565  0.362856  0.550224  1
  Cu  Cu395  1  0.015147  0.638203  0.594604  1
  Cu  Cu396  1  0.348480  0.304870  0.594604  1
  Cu  Cu397  1  0.311356  0.819718  0.646954  1
  Cu  Cu398  1  0.644689  0.486385  0.646954  1
  Cu  Cu399  1  0.683576  0.849382  0.623756  1
  Cu  Cu400  1  0.056245  0.878166  0.602042  1
  Cu  Cu401  1  0.389578  0.544832  0.602042  1
  Cu  Cu402  1  0.722911  0.211499  0.602042  1
  Cu  Cu403  1  0.978023  0.153052  0.646954  1
  Cu  Cu404  1  0.016909  0.516048  0.623756  1
  Cu  Cu405  1  0.350242  0.182715  0.623756  1
  Cu  Cu406  1  0.421261  0.981396  0.650729  1
  Cu  Cu407  1  0.754594  0.648063  0.650729  1
  Cu  Cu408  1  0.794253  0.010393  0.628700  1
  Cu  Cu409  1  0.165460  0.039193  0.606501  1
  Cu  Cu410  1  0.498793  0.705859  0.606501  1
  Cu  Cu411  1  0.832127  0.372526  0.606501  1
  Cu  Cu412  1  0.087928  0.314730  0.650729  1
  Cu  Cu413  1  0.127586  0.677059  0.628700  1
  Cu  Cu414  1  0.460919  0.343726  0.628700  1
  Cu  Cu415  1  0.501778  0.084084  0.635529  1
  Cu  Cu416  1  0.835112  0.750750  0.635529  1
  Cu  Cu417  1  0.873383  0.113163  0.613735  1
  Cu  Cu418  1  0.128406  0.055715  0.658532  1
  Cu  Cu419  1  0.461740  0.722381  0.658532  1
  Cu  Cu420  1  0.795073  0.389048  0.658532  1
  Cu  Cu421  1  0.168445  0.417417  0.635529  1
  Cu  Cu422  1  0.206716  0.779829  0.613735  1
  Cu  Cu423  1  0.540049  0.446496  0.613735  1
  Cu  Cu424  1  0.539768  0.946020  0.613418  1
  Cu  Cu425  1  0.873101  0.612687  0.613418  1
  Cu  Cu426  1  0.796971  0.887770  0.658088  1
  Cu  Cu427  1  0.168121  0.917056  0.635916  1
  Cu  Cu428  1  0.501454  0.583722  0.635916  1
  Cu  Cu429  1  0.834787  0.250389  0.635916  1
  Cu  Cu430  1  0.206435  0.279354  0.613418  1
  Cu  Cu431  1  0.130304  0.554437  0.658088  1
  Cu  Cu432  1  0.463637  0.221103  0.658088  1
  Cu  Cu433  1  0.270082  0.079845  0.639056  1
  Cu  Cu434  1  0.603415  0.746511  0.639056  1
  Cu  Cu435  1  0.643762  0.108810  0.617055  1
  Cu  Cu436  1  0.899543  0.049670  0.662107  1
  Cu  Cu437  1  0.232876  0.716337  0.662107  1
  Cu  Cu438  1  0.566209  0.383004  0.662107  1
  Cu  Cu439  1  0.936748  0.413178  0.639056  1
  Cu  Cu440  1  0.977095  0.775476  0.617055  1
  Cu  Cu441  1  0.310428  0.442143  0.617055  1
  Cu  Cu442  1  0.309451  0.942007  0.616955  1
  Cu  Cu443  1  0.642785  0.608674  0.616955  1
  Cu  Cu444  1  0.564517  0.884474  0.661944  1
  Cu  Cu445  1  0.937851  0.912913  0.639597  1
  Cu  Cu446  1  0.271184  0.579579  0.639597  1
  Cu  Cu447  1  0.604517  0.246246  0.639597  1
  Cu  Cu448  1  0.976118  0.275340  0.616955  1
  Cu  Cu449  1  0.897851  0.551140  0.661944  1
  Cu  Cu450  1  0.231184  0.217807  0.661944  1
  Cu  Cu451  1  0.195770  0.730812  0.713082  1
  Cu  Cu452  1  0.529103  0.397479  0.713082  1
  Cu  Cu453  1  0.568225  0.762597  0.690993  1
  Cu  Cu454  1  0.940835  0.789471  0.668703  1
  Cu  Cu455  1  0.274169  0.456137  0.668703  1
  Cu  Cu456  1  0.607502  0.122804  0.668703  1
  Cu  Cu457  1  0.862436  0.064145  0.713082  1
  Cu  Cu458  1  0.901558  0.429264  0.690993  1
  Cu  Cu459  1  0.234892  0.095930  0.690993  1
  Cu  Cu460  1  0.306725  0.896412  0.716752  1
  Cu  Cu461  1  0.640058  0.563078  0.716752  1
  Cu  Cu462  1  0.675328  0.923647  0.694627  1
  Cu  Cu463  1  0.049997  0.952575  0.672995  1
  Cu  Cu464  1  0.383331  0.619242  0.672995  1
  Cu  Cu465  1  0.716664  0.285909  0.672995  1
  Cu  Cu466  1  0.973391  0.229745  0.716752  1
  Cu  Cu467  1  0.008662  0.590314  0.694627  1
  Cu  Cu468  1  0.341995  0.256980  0.694627  1
  Cu  Cu469  1  0.383505  0.998680  0.702452  1
  Cu  Cu470  1  0.716839  0.665347  0.702452  1
  Cu  Cu471  1  0.757179  0.024952  0.680011  1
  Cu  Cu472  1  0.017323  0.964992  0.723029  1
  Cu  Cu473  1  0.350656  0.631659  0.723029  1
  Cu  Cu474  1  0.683989  0.298325  0.723029  1
  Cu  Cu475  1  0.050172  0.332013  0.702452  1
  Cu  Cu476  1  0.090513  0.691619  0.680011  1
  Cu  Cu477  1  0.423846  0.358285  0.680011  1
  Cu  Cu478  1  0.424482  0.860133  0.680147  1
  Cu  Cu479  1  0.757815  0.526799  0.680147  1
  Cu  Cu480  1  0.677260  0.801801  0.722577  1
  Cu  Cu481  1  0.054343  0.827589  0.702841  1
  Cu  Cu482  1  0.387677  0.494256  0.702841  1
  Cu  Cu483  1  0.721010  0.160923  0.702841  1
  Cu  Cu484  1  0.091148  0.193466  0.680147  1
  Cu  Cu485  1  0.010593  0.468468  0.722577  1
  Cu  Cu486  1  0.343927  0.135135  0.722577  1
  Cu  Cu487  1  0.158112  0.991336  0.706360  1
  Cu  Cu488  1  0.491445  0.658003  0.706360  1
  Cu  Cu489  1  0.526398  0.021676  0.683481  1
  Cu  Cu490  1  0.781081  0.961038  0.726226  1
  Cu  Cu491  1  0.114414  0.627705  0.726226  1
  Cu  Cu492  1  0.447748  0.294372  0.726226  1
  Cu  Cu493  1  0.824778  0.324670  0.706360  1
  Cu  Cu494  1  0.859731  0.688342  0.683481  1
  Cu  Cu495  1  0.193065  0.355009  0.683481  1
  Cu  Cu496  1  0.192902  0.855452  0.685000  1
  Cu  Cu497  1  0.526235  0.522118  0.685000  1
  Cu  Cu498  1  0.452854  0.795969  0.726409  1
  Cu  Cu499  1  0.819711  0.823781  0.705767  1
  Cu  Cu500  1  0.153045  0.490447  0.705767  1
  Cu  Cu501  1  0.486378  0.157114  0.705767  1
  Cu  Cu502  1  0.859569  0.188785  0.685000  1
  Cu  Cu503  1  0.786187  0.462636  0.726409  1
  Cu  Cu504  1  0.119520  0.129302  0.726409  1
