# generated using pymatgen
data_AlCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.78493627
_cell_length_b   19.03094361
_cell_length_c   47.79133470
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.70583445
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCu
_chemical_formula_sum   'Al180 Cu180'
_cell_volume   11461.6402383
_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  0.307865  0.094091  0.276538  1
  Al  Al2  1  0.671778  0.590453  0.298792  1
  Al  Al3  1  0.926183  0.803144  0.294520  1
  Al  Al4  1  0.290973  0.289766  0.341047  1
  Al  Al5  1  0.543756  0.690761  0.321575  1
  Al  Al6  1  0.034973  0.897897  0.330362  1
  Al  Al7  1  0.321766  0.081861  0.330593  1
  Al  Al8  1  0.691734  0.379346  0.303187  1
  Al  Al9  1  0.032030  0.706397  0.320487  1
  Al  Al10  1  0.084895  0.258759  0.329160  1
  Al  Al11  1  0.362635  0.643778  0.288751  1
  Al  Al12  1  0.719745  0.965422  0.297206  1
  Al  Al13  1  0.507791  0.121472  0.294754  1
  Al  Al14  1  0.038571  0.472710  0.285426  1
  Al  Al15  1  0.253157  0.730971  0.319262  1
  Al  Al16  1  0.901210  0.197290  0.358633  1
  Al  Al17  1  0.255784  0.522913  0.312671  1
  Al  Al18  1  0.442117  0.786297  0.295997  1
  Al  Al19  1  0.796788  0.290206  0.330614  1
  Al  Al20  1  0.138305  0.615635  0.287790  1
  Al  Al21  1  0.535177  0.898931  0.326194  1
  Al  Al22  1  0.901823  0.092099  0.277537  1
  Al  Al23  1  0.183052  0.381531  0.304762  1
  Al  Al24  1  0.535943  0.689914  0.379145  1
  Al  Al25  1  0.590396  0.255514  0.335586  1
  Al  Al26  1  0.868143  0.651263  0.288026  1
  Al  Al27  1  0.221471  0.964854  0.303798  1
  Al  Al28  1  0.073864  0.202540  0.277097  1
  Al  Al29  1  0.576369  0.464517  0.281323  1
  Al  Al30  1  0.756073  0.729280  0.322422  1
  Al  Al31  1  0.374447  0.197811  0.374690  1
  Al  Al32  1  0.692458  0.383434  0.359555  1
  Al  Al33  1  0.128518  0.792527  0.408495  1
  Al  Al34  1  0.368773  0.203834  0.436377  1
  Al  Al35  1  0.649498  0.600424  0.353747  1
  Al  Al36  1  0.023294  0.889187  0.385720  1
  Al  Al37  1  0.421183  0.985930  0.353879  1
  Al  Al38  1  0.782379  0.277298  0.388242  1
  Al  Al39  1  0.138533  0.598000  0.401083  1
  Al  Al40  1  0.179816  0.150368  0.412925  1
  Al  Al41  1  0.454733  0.544452  0.367317  1
  Al  Al42  1  0.808759  0.860717  0.381644  1
  Al  Al43  1  0.808312  0.076981  0.329943  1
  Al  Al44  1  0.974913  0.342790  0.359913  1
  Al  Al45  1  0.351242  0.627586  0.401192  1
  Al  Al46  1  0.914191  0.985646  0.417516  1
  Al  Al47  1  0.182453  0.378637  0.362364  1
  Al  Al48  1  0.622936  0.804051  0.410164  1
  Al  Al49  1  0.896021  0.193447  0.417804  1
  Al  Al50  1  0.141579  0.608316  0.344587  1
  Al  Al51  1  0.527240  0.891836  0.381524  1
  Al  Al52  1  0.917605  0.989391  0.360939  1
  Al  Al53  1  0.281381  0.289379  0.402826  1
  Al  Al54  1  0.633138  0.597036  0.409769  1
  Al  Al55  1  0.685749  0.152558  0.413543  1
  Al  Al56  1  0.948768  0.539628  0.365673  1
  Al  Al57  1  0.316150  0.852667  0.383740  1
  Al  Al58  1  0.116662  0.035949  0.342368  1
  Al  Al59  1  0.474221  0.339244  0.364541  1
  Al  Al60  1  0.018815  0.684920  0.378330  1
  Al  Al61  1  0.414352  0.978369  0.408754  1
  Al  Al62  1  0.816676  0.435295  0.441407  1
  Al  Al63  1  0.127138  0.583077  0.459287  1
  Al  Al64  1  0.463008  0.105676  0.464232  1
  Al  Al65  1  0.755060  0.512040  0.390631  1
  Al  Al66  1  0.109416  0.785074  0.464952  1
  Al  Al67  1  0.521108  0.889245  0.442492  1
  Al  Al68  1  0.866384  0.186143  0.477187  1
  Al  Al69  1  0.279861  0.508455  0.481187  1
  Al  Al70  1  0.262138  0.043915  0.490819  1
  Al  Al71  1  0.611942  0.468694  0.440898  1
  Al  Al72  1  0.889094  0.729741  0.463308  1
  Al  Al73  1  0.703444  0.952397  0.408768  1
  Al  Al74  1  0.093155  0.249980  0.440020  1
  Al  Al75  1  0.498969  0.553436  0.470966  1
  Al  Al76  1  0.035304  0.905625  0.498435  1
  Al  Al77  1  0.367619  0.410178  0.447680  1
  Al  Al78  1  0.704814  0.613076  0.464380  1
  Al  Al79  1  0.996635  0.110834  0.448232  1
  Al  Al80  1  0.238307  0.502102  0.425907  1
  Al  Al81  1  0.635944  0.800908  0.472562  1
  Al  Al82  1  1.006544  0.880704  0.442721  1
  Al  Al83  1  0.364482  0.191534  0.497059  1
  Al  Al84  1  0.724498  0.487366  0.491720  1
  Al  Al85  1  0.768858  0.049331  0.496806  1
  Al  Al86  1  0.026429  0.448202  0.444654  1
  Al  Al87  1  0.426806  0.760148  0.463411  1
  Al  Al88  1  0.207993  0.933708  0.417291  1
  Al  Al89  1  0.580341  0.236465  0.441070  1
  Al  Al90  1  0.894901  0.570286  0.466223  1
  Al  Al91  1  0.569409  0.992309  0.486544  1
  Al  Al92  1  0.899900  0.284859  0.520599  1
  Al  Al93  1  0.237094  0.487756  0.537298  1
  Al  Al94  1  0.598169  0.017230  0.542258  1
  Al  Al95  1  0.880216  0.410568  0.493258  1
  Al  Al96  1  0.240231  0.706401  0.487920  1
  Al  Al97  1  0.608079  0.787100  0.536746  1
  Al  Al98  1  0.968769  0.097027  0.512416  1
  Al  Al99  1  0.366406  0.395832  0.559072  1
  Al  Al100  1  0.396720  0.964227  0.567687  1
  Al  Al101  1  0.709812  0.327649  0.518755  1
  Al  Al102  1  0.024373  0.661470  0.543908  1
  Al  Al103  1  0.835855  0.848604  0.488172  1
  Al  Al104  1  0.177908  0.137786  0.521567  1
  Al  Al105  1  0.578285  0.449733  0.540325  1
  Al  Al106  1  0.190361  0.919566  0.576224  1
  Al  Al107  1  0.477576  0.314857  0.525691  1
  Al  Al108  1  0.788038  0.462640  0.543572  1
  Al  Al109  1  0.083605  0.008690  0.542486  1
  Al  Al110  1  0.324853  0.389480  0.503791  1
  Al  Al111  1  0.738329  0.711792  0.507791  1
  Al  Al112  1  0.141705  0.792259  0.520747  1
  Al  Al113  1  0.495298  0.112861  0.520026  1
  Al  Al114  1  0.849654  0.385895  0.594347  1
  Al  Al115  1  0.901269  0.945538  0.576210  1
  Al  Al116  1  0.105745  0.344499  0.514012  1
  Al  Al117  1  0.511558  0.647955  0.544958  1
  Al  Al118  1  0.342575  0.854019  0.494159  1
  Al  Al119  1  0.715619  0.168194  0.521670  1
  Al  Al120  1  0.992771  0.429240  0.544080  1
  Al  Al121  1  0.690523  0.912289  0.567462  1
  Al  Al122  1  0.981777  0.093883  0.574814  1
  Al  Al123  1  0.422260  0.519298  0.622614  1
  Al  Al124  1  0.687108  0.908544  0.624040  1
  Al  Al125  1  0.971575  0.300899  0.575210  1
  Al  Al126  1  0.323333  0.608556  0.582153  1
  Al  Al127  1  0.708692  0.704487  0.567174  1
  Al  Al128  1  0.077473  0.006098  0.603454  1
  Al  Al129  1  0.463134  0.289618  0.640391  1
  Al  Al130  1  0.488051  0.861986  0.642610  1
  Al  Al131  1  0.585899  0.213014  0.606648  1
  Al  Al132  1  0.130493  0.558691  0.620437  1
  Al  Al133  1  0.918964  0.745377  0.571435  1
  Al  Al134  1  0.288563  0.045268  0.601238  1
  Al  Al135  1  0.655945  0.358306  0.619305  1
  Al  Al136  1  0.230267  0.700124  0.610288  1
  Al  Al137  1  0.476195  0.105407  0.576483  1
  Al  Al138  1  0.912256  0.514501  0.625423  1
  Al  Al139  1  0.183530  0.912005  0.631099  1
  Al  Al140  1  0.466180  0.299934  0.583895  1
  Al  Al141  1  0.822335  0.620636  0.596736  1
  Al  Al142  1  0.235941  0.694101  0.548601  1
  Al  Al143  1  0.581419  0.008748  0.599258  1
  Al  Al144  1  0.955216  0.297511  0.631231  1
  Al  Al145  1  0.796402  0.820954  0.655035  1
  Al  Al146  1  0.253472  0.270349  0.583786  1
  Al  Al147  1  0.629800  0.555145  0.625065  1
  Al  Al148  1  0.424897  0.747567  0.572053  1
  Al  Al149  1  0.795955  0.037217  0.603334  1
  Al  Al150  1  0.149980  0.353483  0.617661  1
  Al  Al151  1  0.703503  0.700645  0.626345  1
  Al  Al152  1  0.162596  0.111637  0.688981  1
  Al  Al153  1  0.348929  0.375022  0.672307  1
  Al  Al154  1  0.702891  0.805836  0.707441  1
  Al  Al155  1  0.068771  0.208020  0.605833  1
  Al  Al156  1  0.421662  0.516404  0.680216  1
  Al  Al157  1  0.807926  0.607729  0.654364  1
  Al  Al158  1  0.069537  0.999003  0.658785  1
  Al  Al159  1  0.466408  0.282300  0.697188  1
  Al  Al160  1  0.530849  0.695395  0.707881  1
  Al  Al161  1  0.848640  0.168655  0.662556  1
  Al  Al162  1  0.028344  0.433418  0.703655  1
  Al  Al163  1  0.014317  0.642421  0.649392  1
  Al  Al164  1  0.383242  0.933080  0.681181  1
  Al  Al165  1  0.736570  0.246672  0.696952  1
  Al  Al166  1  0.296849  0.803844  0.708441  1
  Al  Al167  1  0.678530  0.094791  0.690458  1
  Al  Al168  1  0.932935  0.307482  0.686186  1
  Al  Al169  1  0.282947  0.816073  0.654385  1
  Al  Al170  1  0.572684  0.191538  0.664492  1
  Al  Al171  1  0.912980  0.518589  0.681791  1
  Al  Al172  1  0.313740  0.608169  0.643931  1
  Al  Al173  1  0.569740  1.000037  0.654616  1
  Al  Al174  1  0.060958  0.207174  0.663404  1
  Al  Al175  1  0.096923  0.776463  0.690224  1
  Al  Al176  1  0.351556  0.166964  0.665716  1
  Al  Al177  1  0.566142  0.425224  0.699552  1
  Al  Al178  1  0.519818  0.639176  0.655818  1
  Al  Al179  1  0.884969  0.932512  0.687772  1
  Al  Al180  1  0.242079  0.254156  0.696227  1
  Cu  Cu181  1  0.603162  0.042015  0.327356  1
  Cu  Cu182  1  0.975443  0.343157  0.302832  1
  Cu  Cu183  1  0.328661  0.875810  0.277480  1
  Cu  Cu184  1  0.503656  0.126218  0.353151  1
  Cu  Cu185  1  0.813601  0.498442  0.285522  1
  Cu  Cu186  1  0.146386  0.825798  0.298638  1
  Cu  Cu187  1  0.295375  0.286638  0.287111  1
  Cu  Cu188  1  0.466894  0.550117  0.313010  1
  Cu  Cu189  1  0.816850  0.874654  0.327841  1
  Cu  Cu190  1  0.208620  0.169231  0.309858  1
  Cu  Cu191  1  0.567870  0.462108  0.335771  1
  Cu  Cu192  1  0.930381  0.987663  0.307206  1
  Cu  Cu193  1  0.405498  0.211666  0.316064  1
  Cu  Cu194  1  0.763369  0.513305  0.334633  1
  Cu  Cu195  1  0.045933  0.924454  0.276890  1
  Cu  Cu196  1  0.099347  0.060913  0.287079  1
  Cu  Cu197  1  0.473942  0.347962  0.309994  1
  Cu  Cu198  1  0.853636  0.640180  0.347703  1
  Cu  Cu199  1  0.009108  0.123635  0.325777  1
  Cu  Cu200  1  0.372527  0.434236  0.287002  1
  Cu  Cu201  1  0.654301  0.822689  0.298504  1
  Cu  Cu202  1  0.568172  0.258952  0.283481  1
  Cu  Cu203  1  0.961053  0.563039  0.314665  1
  Cu  Cu204  1  0.320781  0.867878  0.329222  1
  Cu  Cu205  1  0.700617  0.169386  0.306349  1
  Cu  Cu206  1  0.077560  0.467423  0.337391  1
  Cu  Cu207  1  0.428288  0.987921  0.299439  1
  Cu  Cu208  1  0.899233  0.208857  0.302953  1
  Cu  Cu209  1  0.248618  0.516177  0.368960  1
  Cu  Cu210  1  0.535856  0.908148  0.273295  1
  Cu  Cu211  1  0.707320  0.955808  0.353847  1
  Cu  Cu212  1  0.078182  0.252617  0.385971  1
  Cu  Cu213  1  0.354862  0.637825  0.344665  1
  Cu  Cu214  1  0.598886  0.039971  0.381040  1
  Cu  Cu215  1  0.883031  0.429332  0.329126  1
  Cu  Cu216  1  0.246338  0.716291  0.375822  1
  Cu  Cu217  1  0.175251  0.164728  0.360373  1
  Cu  Cu218  1  0.557673  0.453559  0.389719  1
  Cu  Cu219  1  0.915400  0.769777  0.409521  1
  Cu  Cu220  1  0.294233  0.063602  0.383367  1
  Cu  Cu221  1  0.672072  0.359434  0.412967  1
  Cu  Cu222  1  0.923569  0.780885  0.353462  1
  Cu  Cu223  1  0.476069  0.117016  0.407486  1
  Cu  Cu224  1  0.867467  0.416255  0.389162  1
  Cu  Cu225  1  0.140072  0.805662  0.353132  1
  Cu  Cu226  1  0.213828  0.941737  0.361234  1
  Cu  Cu227  1  0.572647  0.241281  0.388186  1
  Cu  Cu228  1  0.950029  0.542204  0.417606  1
  Cu  Cu229  1  0.104898  0.022138  0.397554  1
  Cu  Cu230  1  0.365216  0.432275  0.338736  1
  Cu  Cu231  1  0.750125  0.719228  0.379095  1
  Cu  Cu232  1  0.696021  0.159165  0.358967  1
  Cu  Cu233  1  0.066323  0.459931  0.390680  1
  Cu  Cu234  1  0.415976  0.764979  0.408705  1
  Cu  Cu235  1  0.801308  0.073455  0.386412  1
  Cu  Cu236  1  0.156588  0.372221  0.415055  1
  Cu  Cu237  1  0.427608  0.774897  0.352347  1
  Cu  Cu238  1  1.000263  0.113431  0.384961  1
  Cu  Cu239  1  0.353843  0.423806  0.392572  1
  Cu  Cu240  1  0.639283  0.807518  0.352223  1
  Cu  Cu241  1  0.805443  0.852813  0.435298  1
  Cu  Cu242  1  0.189757  0.146202  0.466563  1
  Cu  Cu243  1  0.445564  0.529603  0.421284  1
  Cu  Cu244  1  0.720461  0.940531  0.461584  1
  Cu  Cu245  1  0.958779  0.331963  0.415990  1
  Cu  Cu246  1  0.347900  0.624660  0.456321  1
  Cu  Cu247  1  0.291176  0.061529  0.435737  1
  Cu  Cu248  1  0.655153  0.354917  0.468393  1
  Cu  Cu249  1  0.027754  0.667245  0.490705  1
  Cu  Cu250  1  0.386507  0.969057  0.460993  1
  Cu  Cu251  1  0.787965  0.284904  0.446755  1
  Cu  Cu252  1  0.025329  0.673256  0.433993  1
  Cu  Cu253  1  0.588014  0.032143  0.435260  1
  Cu  Cu254  1  0.974077  0.318696  0.468815  1
  Cu  Cu255  1  0.237205  0.706040  0.432306  1
  Cu  Cu256  1  0.307574  0.840452  0.439385  1
  Cu  Cu257  1  0.665609  0.136622  0.468809  1
  Cu  Cu258  1  0.080930  0.469838  0.495879  1
  Cu  Cu259  1  0.202396  0.915454  0.470346  1
  Cu  Cu260  1  0.479586  0.336832  0.418736  1
  Cu  Cu261  1  0.842768  0.637813  0.410627  1
  Cu  Cu262  1  0.791118  0.066547  0.441905  1
  Cu  Cu263  1  0.168856  0.383674  0.465385  1
  Cu  Cu264  1  0.535515  0.677756  0.491734  1
  Cu  Cu265  1  0.914248  0.986166  0.471985  1
  Cu  Cu266  1  0.255860  0.278441  0.472114  1
  Cu  Cu267  1  0.528118  0.676407  0.436684  1
  Cu  Cu268  1  0.105499  0.012195  0.453048  1
  Cu  Cu269  1  0.455283  0.308004  0.470537  1
  Cu  Cu270  1  0.727536  0.721455  0.432548  1
  Cu  Cu271  1  0.939104  0.761313  0.516169  1
  Cu  Cu272  1  0.297139  0.057483  0.545593  1
  Cu  Cu273  1  0.523784  0.428097  0.489099  1
  Cu  Cu274  1  0.813595  0.831388  0.543073  1
  Cu  Cu275  1  0.069199  0.220179  0.493245  1
  Cu  Cu276  1  0.435858  0.514261  0.519593  1
  Cu  Cu277  1  0.402317  0.982481  0.514633  1
  Cu  Cu278  1  0.761946  0.260121  0.574351  1
  Cu  Cu279  1  0.125127  0.561103  0.566243  1
  Cu  Cu280  1  0.499215  0.885739  0.531931  1
  Cu  Cu281  1  0.877177  0.176480  0.552431  1
  Cu  Cu282  1  0.149430  0.589930  0.514441  1
  Cu  Cu283  1  0.690466  0.911769  0.512994  1
  Cu  Cu284  1  0.076595  0.221528  0.548295  1
  Cu  Cu285  1  0.348853  0.619494  0.512864  1
  Cu  Cu286  1  0.414956  0.751732  0.518415  1
  Cu  Cu287  1  0.799270  0.045122  0.549680  1
  Cu  Cu288  1  0.159150  0.368332  0.563694  1
  Cu  Cu289  1  0.313538  0.836405  0.549242  1
  Cu  Cu290  1  0.576960  0.230690  0.494273  1
  Cu  Cu291  1  0.949560  0.543018  0.516585  1
  Cu  Cu292  1  0.884253  0.957404  0.523395  1
  Cu  Cu293  1  0.256813  0.273275  0.528657  1
  Cu  Cu294  1  0.645934  0.565972  0.568989  1
  Cu  Cu295  1  0.016700  0.865792  0.549719  1
  Cu  Cu296  1  0.367508  0.191895  0.552672  1
  Cu  Cu297  1  0.630636  0.579239  0.516163  1
  Cu  Cu298  1  0.218206  0.928878  0.523985  1
  Cu  Cu299  1  0.579385  0.224679  0.550985  1
  Cu  Cu300  1  0.816748  0.613031  0.538223  1
  Cu  Cu301  1  0.032067  0.656653  0.596792  1
  Cu  Cu302  1  0.390886  0.956197  0.623744  1
  Cu  Cu303  1  0.654684  0.355731  0.567372  1
  Cu  Cu304  1  0.908692  0.738770  0.626011  1
  Cu  Cu305  1  0.188737  0.132956  0.576273  1
  Cu  Cu306  1  0.538390  0.438003  0.594299  1
  Cu  Cu307  1  0.499816  0.875797  0.587424  1
  Cu  Cu308  1  0.854588  0.178707  0.605883  1
  Cu  Cu309  1  0.239497  0.465660  0.646243  1
  Cu  Cu310  1  0.604450  0.784503  0.600017  1
  Cu  Cu311  1  0.965431  0.090417  0.632755  1
  Cu  Cu312  1  0.250870  0.474129  0.592406  1
  Cu  Cu313  1  0.803406  0.824480  0.598567  1
  Cu  Cu314  1  0.177105  0.123037  0.632631  1
  Cu  Cu315  1  0.448126  0.525714  0.569923  1
  Cu  Cu316  1  0.526532  0.645317  0.599008  1
  Cu  Cu317  1  0.897393  0.942127  0.631131  1
  Cu  Cu318  1  0.249851  0.260110  0.640314  1
  Cu  Cu319  1  0.429462  0.733206  0.624605  1
  Cu  Cu320  1  0.689313  0.128157  0.575457  1
  Cu  Cu321  1  0.047041  0.444376  0.595259  1
  Cu  Cu322  1  1.005827  0.857964  0.603938  1
  Cu  Cu323  1  0.358376  0.181644  0.609156  1
  Cu  Cu324  1  0.721683  0.468603  0.655852  1
  Cu  Cu325  1  0.128645  0.780919  0.577492  1
  Cu  Cu326  1  0.464641  0.092272  0.631847  1
  Cu  Cu327  1  0.737247  0.481680  0.595816  1
  Cu  Cu328  1  0.310480  0.834332  0.601612  1
  Cu  Cu329  1  0.681144  0.117049  0.631517  1
  Cu  Cu330  1  0.932641  0.538501  0.572011  1
  Cu  Cu331  1  0.130771  0.549972  0.674984  1
  Cu  Cu332  1  0.505366  0.837022  0.697899  1
  Cu  Cu333  1  0.751078  0.257755  0.637275  1
  Cu  Cu334  1  0.036541  0.638983  0.701498  1
  Cu  Cu335  1  0.283933  0.030057  0.655756  1
  Cu  Cu336  1  0.643661  0.334896  0.670314  1
  Cu  Cu337  1  0.595605  0.774300  0.659202  1
  Cu  Cu338  1  0.950413  0.075246  0.686474  1
  Cu  Cu339  1  0.232187  0.463698  0.697976  1
  Cu  Cu340  1  0.705480  0.689078  0.682025  1
  Cu  Cu341  1  0.068858  0.989787  0.711683  1
  Cu  Cu342  1  0.356095  0.381757  0.616018  1
  Cu  Cu343  1  0.904097  0.728548  0.678629  1
  Cu  Cu344  1  0.176425  0.910013  0.685539  1
  Cu  Cu345  1  0.527153  0.430512  0.647587  1
  Cu  Cu346  1  0.629271  0.554777  0.682147  1
  Cu  Cu347  1  1.001552  0.855920  0.657622  1
  Cu  Cu348  1  0.276052  0.022124  0.707498  1
  Cu  Cu349  1  0.309338  0.611297  0.697867  1
  Cu  Cu350  1  0.787863  0.023281  0.657137  1
  Cu  Cu351  1  0.137819  0.347817  0.671969  1
  Cu  Cu352  1  0.101058  0.771717  0.631827  1
  Cu  Cu353  1  0.458327  0.072137  0.686340  1
  Cu  Cu354  1  0.791112  0.399493  0.699457  1
  Cu  Cu355  1  0.199216  0.686268  0.668914  1
  Cu  Cu356  1  0.558780  0.973481  0.708088  1
  Cu  Cu357  1  0.841344  0.384629  0.650345  1
  Cu  Cu358  1  0.396093  0.728704  0.675120  1
  Cu  Cu359  1  0.674332  0.910271  0.677772  1
  Cu  Cu360  1  0.036843  0.435827  0.649207  1
