# generated using pymatgen
data_AlCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.01893391
_cell_length_b   19.02369215
_cell_length_c   50.20230764
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   88.36646357
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCu
_chemical_formula_sum   'Al180 Cu180'
_cell_volume   11473.816613
_cell_formula_units_Z   180
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  0.323634  0.856108  0.290020  1
  Al  Al2  1  0.694108  0.451963  0.318298  1
  Al  Al3  1  0.931447  0.292198  0.275030  1
  Al  Al4  1  0.307879  0.693274  0.295287  1
  Al  Al5  1  0.632025  0.314165  0.334030  1
  Al  Al6  1  0.961263  0.054241  0.277598  1
  Al  Al7  1  0.320049  0.998606  0.311814  1
  Al  Al8  1  0.633600  0.632269  0.345791  1
  Al  Al9  1  0.042154  0.269920  0.321419  1
  Al  Al10  1  0.075804  0.690879  0.309951  1
  Al  Al11  1  0.409349  0.334470  0.338819  1
  Al  Al12  1  0.743353  0.088563  0.283075  1
  Al  Al13  1  0.661898  0.961961  0.259710  1
  Al  Al14  1  0.840197  0.672037  0.324314  1
  Al  Al15  1  0.265009  0.237842  0.319532  1
  Al  Al16  1  0.824873  0.830693  0.335360  1
  Al  Al17  1  0.160628  0.585663  0.280122  1
  Al  Al18  1  0.516758  0.059454  0.292929  1
  Al  Al19  1  0.731297  0.702722  0.277193  1
  Al  Al20  1  0.099703  0.380823  0.288497  1
  Al  Al21  1  0.546107  0.996975  0.355125  1
  Al  Al22  1  0.892792  0.932771  0.301066  1
  Al  Al23  1  0.243690  0.581484  0.329377  1
  Al  Al24  1  0.495160  0.215886  0.311962  1
  Al  Al25  1  0.535059  0.783321  0.277316  1
  Al  Al26  1  0.883271  0.436758  0.289523  1
  Al  Al27  1  0.074131  0.031327  0.321975  1
  Al  Al28  1  0.116781  0.921714  0.289470  1
  Al  Al29  1  0.486773  0.533770  0.325648  1
  Al  Al30  1  0.689238  0.353257  0.282128  1
  Al  Al31  1  0.335043  0.778668  0.374657  1
  Al  Al32  1  0.664547  0.413382  0.402861  1
  Al  Al33  1  0.008979  0.148248  0.351403  1
  Al  Al34  1  0.303010  0.572287  0.385123  1
  Al  Al35  1  0.657193  0.175763  0.419057  1
  Al  Al36  1  0.975549  0.936227  0.352873  1
  Al  Al37  1  0.390116  0.890973  0.342527  1
  Al  Al38  1  0.717825  0.519167  0.368271  1
  Al  Al39  1  0.045397  0.123545  0.411662  1
  Al  Al40  1  0.084721  0.589236  0.390385  1
  Al  Al41  1  0.426785  0.229464  0.412574  1
  Al  Al42  1  0.762379  0.964197  0.357725  1
  Al  Al43  1  0.607914  0.866370  0.339175  1
  Al  Al44  1  0.939944  0.483715  0.375970  1
  Al  Al45  1  0.264790  0.125267  0.391229  1
  Al  Al46  1  0.831453  0.723747  0.416100  1
  Al  Al47  1  0.192837  0.365490  0.338380  1
  Al  Al48  1  0.495430  0.102691  0.391682  1
  Al  Al49  1  0.870169  0.621613  0.379111  1
  Al  Al50  1  0.149631  0.241627  0.369756  1
  Al  Al51  1  0.481031  0.882496  0.390872  1
  Al  Al52  1  0.901284  0.833092  0.385591  1
  Al  Al53  1  0.219961  0.456441  0.404774  1
  Al  Al54  1  0.592406  0.203214  0.365633  1
  Al  Al55  1  0.404459  0.658545  0.347469  1
  Al  Al56  1  0.923560  0.290007  0.368255  1
  Al  Al57  1  0.257715  0.914323  0.390807  1
  Al  Al58  1  0.116200  0.819955  0.372791  1
  Al  Al59  1  0.442387  0.437825  0.402995  1
  Al  Al60  1  0.793846  0.195849  0.345449  1
  Al  Al61  1  0.342290  0.656058  0.451233  1
  Al  Al62  1  0.711667  0.271289  0.470605  1
  Al  Al63  1  0.043600  0.941492  0.404914  1
  Al  Al64  1  0.336495  0.490646  0.447152  1
  Al  Al65  1  0.689952  0.110341  0.471182  1
  Al  Al66  1  0.986573  0.828062  0.434309  1
  Al  Al67  1  0.404177  0.776765  0.426130  1
  Al  Al68  1  0.740817  0.402691  0.451528  1
  Al  Al69  1  0.071742  0.999539  0.489147  1
  Al  Al70  1  0.131950  0.481153  0.467827  1
  Al  Al71  1  0.399607  0.122480  0.489468  1
  Al  Al72  1  0.767740  0.855441  0.433988  1
  Al  Al73  1  0.614850  0.764435  0.414704  1
  Al  Al74  1  0.121408  0.364907  0.437085  1
  Al  Al75  1  0.296417  0.012098  0.468379  1
  Al  Al76  1  0.904095  0.491816  0.466357  1
  Al  Al77  1  0.208677  0.237830  0.421524  1
  Al  Al78  1  0.555713  0.891524  0.441326  1
  Al  Al79  1  0.801866  0.519935  0.418689  1
  Al  Al80  1  0.155903  0.122411  0.457906  1
  Al  Al81  1  0.501726  0.773414  0.475243  1
  Al  Al82  1  0.919411  0.723238  0.466146  1
  Al  Al83  1  0.262191  0.359808  0.482534  1
  Al  Al84  1  0.518539  0.034015  0.453561  1
  Al  Al85  1  0.571912  0.539316  0.425291  1
  Al  Al86  1  0.890956  0.195670  0.448756  1
  Al  Al87  1  0.280943  0.799499  0.471335  1
  Al  Al88  1  0.126680  0.710234  0.450422  1
  Al  Al89  1  0.484359  0.315564  0.479487  1
  Al  Al90  1  0.816307  0.073753  0.426261  1
  Al  Al91  1  0.406454  0.451814  0.500668  1
  Al  Al92  1  0.727611  0.098808  0.530089  1
  Al  Al93  1  0.064459  0.826877  0.484104  1
  Al  Al94  1  0.301478  0.366232  0.537520  1
  Al  Al95  1  0.658094  0.983513  0.559861  1
  Al  Al96  1  0.993910  0.705356  0.518575  1
  Al  Al97  1  0.410156  0.667044  0.502599  1
  Al  Al98  1  0.722578  0.278312  0.528194  1
  Al  Al99  1  0.081605  0.911307  0.552469  1
  Al  Al100  1  0.038292  0.387774  0.541252  1
  Al  Al101  1  0.416522  0.026144  0.566176  1
  Al  Al102  1  0.785084  0.753367  0.508533  1
  Al  Al103  1  0.631253  0.652091  0.493321  1
  Al  Al104  1  0.953061  0.276414  0.513493  1
  Al  Al105  1  0.314215  0.909688  0.546052  1
  Al  Al106  1  0.884022  0.505127  0.560159  1
  Al  Al107  1  0.170955  0.261056  0.516522  1
  Al  Al108  1  0.523758  0.896652  0.534646  1
  Al  Al109  1  0.843489  0.396014  0.505511  1
  Al  Al110  1  0.184204  0.028373  0.533429  1
  Al  Al111  1  0.504795  0.655659  0.548806  1
  Al  Al112  1  0.852491  0.614802  0.493850  1
  Al  Al113  1  0.278231  0.243884  0.564929  1
  Al  Al114  1  0.604308  0.998052  0.501886  1
  Al  Al115  1  0.625527  0.415207  0.499080  1
  Al  Al116  1  0.949608  0.067850  0.527207  1
  Al  Al117  1  0.275903  0.695233  0.549373  1
  Al  Al118  1  0.133088  0.597087  0.530568  1
  Al  Al119  1  0.517312  0.217927  0.555113  1
  Al  Al120  1  0.827007  0.975321  0.501822  1
  Al  Al121  1  0.422501  0.340067  0.582200  1
  Al  Al122  1  0.733039  0.079405  0.622682  1
  Al  Al123  1  0.046840  0.769537  0.563155  1
  Al  Al124  1  0.404698  0.231126  0.643532  1
  Al  Al125  1  0.698931  0.899225  0.617344  1
  Al  Al126  1  0.019058  0.628709  0.573830  1
  Al  Al127  1  0.346668  0.554816  0.537644  1
  Al  Al128  1  0.763972  0.207748  0.589335  1
  Al  Al129  1  0.089963  0.852055  0.612120  1
  Al  Al130  1  0.160021  0.236789  0.609045  1
  Al  Al131  1  0.456563  0.920769  0.640808  1
  Al  Al132  1  0.811091  0.635746  0.587056  1
  Al  Al133  1  0.654447  0.542563  0.566397  1
  Al  Al134  1  0.981269  0.152660  0.597448  1
  Al  Al135  1  0.315894  0.825405  0.620531  1
  Al  Al136  1  0.887406  0.402871  0.640872  1
  Al  Al137  1  0.213793  0.102518  0.583955  1
  Al  Al138  1  0.595199  0.674534  0.594899  1
  Al  Al139  1  0.856894  0.328252  0.565483  1
  Al  Al140  1  0.218590  0.953878  0.591018  1
  Al  Al141  1  0.447485  0.563938  0.587691  1
  Al  Al142  1  0.936796  0.528424  0.612222  1
  Al  Al143  1  0.259382  0.129880  0.636829  1
  Al  Al144  1  0.646377  0.823513  0.573206  1
  Al  Al145  1  0.637236  0.326636  0.577400  1
  Al  Al146  1  0.901602  0.978116  0.607661  1
  Al  Al147  1  0.305516  0.589293  0.631162  1
  Al  Al148  1  0.166761  0.481528  0.616101  1
  Al  Al149  1  0.515176  0.110639  0.633917  1
  Al  Al150  1  0.877448  0.856993  0.582305  1
  Al  Al151  1  0.365970  0.357219  0.670045  1
  Al  Al152  1  0.733212  0.948510  0.701827  1
  Al  Al153  1  0.083706  0.618337  0.629809  1
  Al  Al154  1  0.316023  0.154137  0.687645  1
  Al  Al155  1  0.726382  0.802438  0.710074  1
  Al  Al156  1  0.044583  0.496148  0.661639  1
  Al  Al157  1  0.388923  0.453304  0.626266  1
  Al  Al158  1  0.741736  0.088056  0.677823  1
  Al  Al159  1  0.022900  0.741459  0.655209  1
  Al  Al160  1  0.108686  0.202085  0.699509  1
  Al  Al161  1  0.502036  0.834809  0.710657  1
  Al  Al162  1  0.816264  0.532469  0.659624  1
  Al  Al163  1  0.662922  0.436619  0.644645  1
  Al  Al164  1  0.127466  0.066708  0.674744  1
  Al  Al165  1  0.323945  0.720575  0.694024  1
  Al  Al166  1  0.905751  0.169658  0.689780  1
  Al  Al167  1  0.231643  0.953201  0.645528  1
  Al  Al168  1  0.568311  0.713152  0.686281  1
  Al  Al169  1  0.837307  0.199112  0.641003  1
  Al  Al170  1  0.174501  0.830484  0.667961  1
  Al  Al171  1  0.526202  0.556133  0.637644  1
  Al  Al172  1  0.923012  0.409662  0.693374  1
  Al  Al173  1  0.286953  0.027314  0.710295  1
  Al  Al174  1  0.546299  0.794901  0.621563  1
  Al  Al175  1  0.627944  0.218825  0.653763  1
  Al  Al176  1  0.923314  0.868177  0.686247  1
  Al  Al177  1  0.488052  0.467683  0.679403  1
  Al  Al178  1  0.144904  0.378840  0.684632  1
  Al  Al179  1  0.512088  0.975498  0.701558  1
  Al  Al180  1  0.777169  0.769558  0.661022  1
  Cu  Cu181  1  0.687161  0.978509  0.311510  1
  Cu  Cu182  1  0.937746  0.589338  0.290495  1
  Cu  Cu183  1  0.316086  0.343589  0.290203  1
  Cu  Cu184  1  0.511410  0.916852  0.297541  1
  Cu  Cu185  1  0.866612  0.524137  0.330444  1
  Cu  Cu186  1  0.160452  0.255167  0.274173  1
  Cu  Cu187  1  0.139177  0.788191  0.280706  1
  Cu  Cu188  1  0.494104  0.408676  0.302854  1
  Cu  Cu189  1  0.854973  0.061084  0.328760  1
  Cu  Cu190  1  0.233875  0.787222  0.328704  1
  Cu  Cu191  1  0.573729  0.511826  0.278922  1
  Cu  Cu192  1  0.904550  0.174063  0.302170  1
  Cu  Cu193  1  0.448109  0.772283  0.322528  1
  Cu  Cu194  1  0.717771  0.580780  0.300735  1
  Cu  Cu195  1  0.109262  0.150191  0.299667  1
  Cu  Cu196  1  0.183005  0.044532  0.274771  1
  Cu  Cu197  1  0.528722  0.653065  0.298997  1
  Cu  Cu198  1  0.835196  0.317437  0.318816  1
  Cu  Cu199  1  0.037594  0.828630  0.323471  1
  Cu  Cu200  1  0.376663  0.564021  0.283913  1
  Cu  Cu201  1  0.706696  0.220095  0.298190  1
  Cu  Cu202  1  0.655030  0.746411  0.320603  1
  Cu  Cu203  1  0.069654  0.498224  0.311529  1
  Cu  Cu204  1  0.321896  0.125655  0.294819  1
  Cu  Cu205  1  0.713484  0.849441  0.291067  1
  Cu  Cu206  1  0.140941  0.486182  0.357645  1
  Cu  Cu207  1  0.370178  0.230868  0.270329  1
  Cu  Cu208  1  0.905965  0.775762  0.291290  1
  Cu  Cu209  1  0.284821  0.462634  0.308059  1
  Cu  Cu210  1  0.647369  0.105485  0.329841  1
  Cu  Cu211  1  0.690548  0.863076  0.385934  1
  Cu  Cu212  1  0.024583  0.597161  0.342161  1
  Cu  Cu213  1  0.372417  0.217550  0.363500  1
  Cu  Cu214  1  0.546038  0.753658  0.366883  1
  Cu  Cu215  1  0.897505  0.388592  0.411453  1
  Cu  Cu216  1  0.225427  0.116638  0.340604  1
  Cu  Cu217  1  0.176439  0.686518  0.359014  1
  Cu  Cu218  1  0.522541  0.320759  0.383329  1
  Cu  Cu219  1  0.830450  0.954333  0.405618  1
  Cu  Cu220  1  0.243540  0.689373  0.406495  1
  Cu  Cu221  1  0.555874  0.429485  0.356430  1
  Cu  Cu222  1  0.917938  0.051070  0.378790  1
  Cu  Cu223  1  0.456770  0.662992  0.399830  1
  Cu  Cu224  1  0.783580  0.389198  0.361032  1
  Cu  Cu225  1  0.127993  0.030624  0.372348  1
  Cu  Cu226  1  0.184134  0.920274  0.340308  1
  Cu  Cu227  1  0.510254  0.550111  0.376362  1
  Cu  Cu228  1  0.857983  0.178151  0.394124  1
  Cu  Cu229  1  0.038655  0.717910  0.402877  1
  Cu  Cu230  1  0.347822  0.459425  0.356363  1
  Cu  Cu231  1  0.714011  0.086863  0.377697  1
  Cu  Cu232  1  0.666424  0.637416  0.398288  1
  Cu  Cu233  1  0.977234  0.400863  0.336559  1
  Cu  Cu234  1  0.334234  0.015446  0.364115  1
  Cu  Cu235  1  0.751073  0.737970  0.368078  1
  Cu  Cu236  1  0.079665  0.371646  0.384340  1
  Cu  Cu237  1  0.435158  0.109008  0.339149  1
  Cu  Cu238  1  0.973354  0.729126  0.355467  1
  Cu  Cu239  1  0.299996  0.335343  0.385954  1
  Cu  Cu240  1  0.627178  0.989581  0.407100  1
  Cu  Cu241  1  0.705182  0.752557  0.461709  1
  Cu  Cu242  1  0.023840  0.487395  0.423045  1
  Cu  Cu243  1  0.357033  0.118866  0.437123  1
  Cu  Cu244  1  0.553966  0.663616  0.445078  1
  Cu  Cu245  1  0.917187  0.330026  0.457930  1
  Cu  Cu246  1  0.201039  0.022558  0.422032  1
  Cu  Cu247  1  0.176432  0.581666  0.435675  1
  Cu  Cu248  1  0.517402  0.193272  0.457047  1
  Cu  Cu249  1  0.854709  0.856655  0.479601  1
  Cu  Cu250  1  0.268366  0.569406  0.488202  1
  Cu  Cu251  1  0.575206  0.312133  0.431912  1
  Cu  Cu252  1  0.933510  0.957305  0.451080  1
  Cu  Cu253  1  0.481345  0.559797  0.473195  1
  Cu  Cu254  1  0.773997  0.289062  0.414607  1
  Cu  Cu255  1  0.143428  0.918446  0.451015  1
  Cu  Cu256  1  0.193863  0.813999  0.421262  1
  Cu  Cu257  1  0.526639  0.430033  0.453159  1
  Cu  Cu258  1  0.909809  0.076638  0.472676  1
  Cu  Cu259  1  0.059649  0.605284  0.480035  1
  Cu  Cu260  1  0.355905  0.346742  0.435823  1
  Cu  Cu261  1  0.723539  0.975311  0.455822  1
  Cu  Cu262  1  0.683565  0.525873  0.471397  1
  Cu  Cu263  1  0.999795  0.266932  0.414939  1
  Cu  Cu264  1  0.341029  0.902313  0.439700  1
  Cu  Cu265  1  0.755422  0.628596  0.446932  1
  Cu  Cu266  1  0.089040  0.255060  0.466777  1
  Cu  Cu267  1  0.404727  0.999920  0.412177  1
  Cu  Cu268  1  0.961641  0.613107  0.434204  1
  Cu  Cu269  1  0.308235  0.232114  0.466560  1
  Cu  Cu270  1  0.649827  0.866755  0.487948  1
  Cu  Cu271  1  0.727340  0.645526  0.538955  1
  Cu  Cu272  1  0.052048  0.378457  0.490533  1
  Cu  Cu273  1  0.388221  0.005693  0.515061  1
  Cu  Cu274  1  0.557153  0.543361  0.519024  1
  Cu  Cu275  1  0.890781  0.187635  0.549026  1
  Cu  Cu276  1  0.232931  0.911182  0.499426  1
  Cu  Cu277  1  0.189972  0.467837  0.517901  1
  Cu  Cu278  1  0.519275  0.097178  0.532411  1
  Cu  Cu279  1  0.829677  0.746639  0.558283  1
  Cu  Cu280  1  0.309791  0.463517  0.576231  1
  Cu  Cu281  1  0.584358  0.198896  0.504588  1
  Cu  Cu282  1  0.939266  0.844425  0.526145  1
  Cu  Cu283  1  0.493136  0.451691  0.551416  1
  Cu  Cu284  1  0.829989  0.179135  0.499101  1
  Cu  Cu285  1  0.175547  0.805607  0.525870  1
  Cu  Cu286  1  0.199092  0.696375  0.498456  1
  Cu  Cu287  1  0.518876  0.335517  0.530707  1
  Cu  Cu288  1  0.873128  0.962581  0.552328  1
  Cu  Cu289  1  0.106474  0.496130  0.565806  1
  Cu  Cu290  1  0.383123  0.243708  0.514992  1
  Cu  Cu291  1  0.741702  0.873821  0.532258  1
  Cu  Cu292  1  0.703795  0.420257  0.546991  1
  Cu  Cu293  1  0.044596  0.155956  0.498189  1
  Cu  Cu294  1  0.379338  0.798131  0.518700  1
  Cu  Cu295  1  0.760781  0.519708  0.518183  1
  Cu  Cu296  1  0.098589  0.154664  0.546419  1
  Cu  Cu297  1  0.437374  0.903888  0.485612  1
  Cu  Cu298  1  0.986320  0.506834  0.513853  1
  Cu  Cu299  1  0.316246  0.132605  0.537687  1
  Cu  Cu300  1  0.587562  0.765702  0.525780  1
  Cu  Cu301  1  0.713129  0.548415  0.615474  1
  Cu  Cu302  1  0.049679  0.268454  0.566387  1
  Cu  Cu303  1  0.450696  0.900821  0.588585  1
  Cu  Cu304  1  0.568355  0.446805  0.597943  1
  Cu  Cu305  1  0.925802  0.071787  0.647101  1
  Cu  Cu306  1  0.243755  0.813980  0.574262  1
  Cu  Cu307  1  0.179531  0.364471  0.582308  1
  Cu  Cu308  1  0.566224  1.000411  0.605674  1
  Cu  Cu309  1  0.867059  0.651739  0.637757  1
  Cu  Cu310  1  0.294192  0.336322  0.622244  1
  Cu  Cu311  1  0.607100  0.110462  0.579717  1
  Cu  Cu312  1  0.957196  0.734867  0.606528  1
  Cu  Cu313  1  0.522483  0.341311  0.629914  1
  Cu  Cu314  1  0.823358  0.076911  0.575294  1
  Cu  Cu315  1  0.166735  0.715653  0.601173  1
  Cu  Cu316  1  0.228895  0.592957  0.582924  1
  Cu  Cu317  1  0.560186  0.226828  0.605821  1
  Cu  Cu318  1  0.897194  0.848576  0.633954  1
  Cu  Cu319  1  0.098078  0.363450  0.633838  1
  Cu  Cu320  1  0.402400  0.152574  0.592265  1
  Cu  Cu321  1  0.757117  0.757700  0.610569  1
  Cu  Cu322  1  0.733583  0.315798  0.623248  1
  Cu  Cu323  1  0.033538  0.034746  0.573114  1
  Cu  Cu324  1  0.370722  0.695783  0.597951  1
  Cu  Cu325  1  0.776495  0.430672  0.596286  1
  Cu  Cu326  1  0.097958  0.045401  0.621534  1
  Cu  Cu327  1  0.445869  0.783112  0.566406  1
  Cu  Cu328  1  0.989564  0.406573  0.592911  1
  Cu  Cu329  1  0.363615  0.026654  0.614767  1
  Cu  Cu330  1  0.664444  0.660604  0.643457  1
  Cu  Cu331  1  0.712164  0.444098  0.693661  1
  Cu  Cu332  1  0.053162  0.174219  0.646865  1
  Cu  Cu333  1  0.420430  0.803718  0.664668  1
  Cu  Cu334  1  0.587911  0.341457  0.678105  1
  Cu  Cu335  1  0.932542  0.013035  0.691556  1
  Cu  Cu336  1  0.249335  0.715365  0.646223  1
  Cu  Cu337  1  0.202930  0.261842  0.659525  1
  Cu  Cu338  1  0.622769  0.866288  0.667864  1
  Cu  Cu339  1  0.851065  0.539422  0.708023  1
  Cu  Cu340  1  0.280112  0.281410  0.706680  1
  Cu  Cu341  1  0.608239  1.000405  0.656611  1
  Cu  Cu342  1  0.977228  0.618843  0.679131  1
  Cu  Cu343  1  0.477661  0.241999  0.693082  1
  Cu  Cu344  1  0.808348  0.960552  0.654734  1
  Cu  Cu345  1  0.188516  0.616560  0.676071  1
  Cu  Cu346  1  0.265667  0.490082  0.667194  1
  Cu  Cu347  1  0.532079  0.113678  0.685961  1
  Cu  Cu348  1  0.924679  0.736978  0.700840  1
  Cu  Cu349  1  0.989369  0.289734  0.665565  1
  Cu  Cu350  1  0.384602  0.035257  0.665069  1
  Cu  Cu351  1  0.776723  0.654902  0.687791  1
  Cu  Cu352  1  0.691863  0.214898  0.700460  1
  Cu  Cu353  1  0.021094  0.946463  0.650784  1
  Cu  Cu354  1  0.404463  0.599644  0.678890  1
  Cu  Cu355  1  0.786284  0.311926  0.672991  1
  Cu  Cu356  1  0.122090  0.942040  0.695392  1
  Cu  Cu357  1  0.454999  0.686265  0.643023  1
  Cu  Cu358  1  0.947404  0.286911  0.612684  1
  Cu  Cu359  1  0.335022  0.908266  0.687777  1
  Cu  Cu360  1  0.626593  0.570354  0.682823  1
