# generated using pymatgen
data_AlCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   24.53876756
_cell_length_b   8.09344343
_cell_length_c   48.06825946
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   67.37958716
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCu
_chemical_formula_sum   'Al140 Cu140'
_cell_volume   8812.12487012
_cell_formula_units_Z   140
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  0.569239  0.936089  0.275256  1
  Al  Al2  1  0.096240  0.006553  0.339589  1
  Al  Al3  1  0.462718  0.564184  0.274656  1
  Al  Al4  1  0.008058  0.307407  0.318625  1
  Al  Al5  1  0.664759  0.519967  0.327733  1
  Al  Al6  1  0.182373  0.527034  0.313500  1
  Al  Al7  1  0.379769  0.401375  0.285142  1
  Al  Al8  1  0.907215  0.250012  0.314514  1
  Al  Al9  1  0.719466  0.809944  0.272619  1
  Al  Al10  1  0.285722  0.575054  0.319200  1
  Al  Al11  1  0.827849  0.874414  0.281222  1
  Al  Al12  1  0.363669  0.942299  0.349197  1
  Al  Al13  1  0.800496  0.224438  0.303592  1
  Al  Al14  1  0.276431  0.239543  0.331079  1
  Al  Al15  1  0.362278  0.740242  0.305895  1
  Al  Al16  1  0.920491  0.597772  0.299380  1
  Al  Al17  1  0.560759  0.271136  0.293077  1
  Al  Al18  1  0.171698  0.188264  0.328108  1
  Al  Al19  1  0.466996  0.897832  0.267191  1
  Al  Al20  1  0.091216  0.804409  0.295704  1
  Al  Al21  1  0.633016  0.846486  0.363821  1
  Al  Al22  1  0.179492  0.418346  0.368368  1
  Al  Al23  1  0.546932  0.152826  0.344377  1
  Al  Al24  1  0.097907  0.869070  0.393027  1
  Al  Al25  1  0.754925  0.217777  0.356409  1
  Al  Al26  1  0.267911  0.111494  0.386151  1
  Al  Al27  1  0.468374  0.004200  0.355232  1
  Al  Al28  1  0.993649  0.846571  0.382470  1
  Al  Al29  1  0.814181  0.432335  0.345475  1
  Al  Al30  1  0.370200  0.176087  0.385722  1
  Al  Al31  1  0.916099  0.478350  0.354628  1
  Al  Al32  1  0.444123  0.349940  0.380936  1
  Al  Al33  1  0.887410  0.824467  0.372818  1
  Al  Al34  1  0.363377  0.807814  0.404175  1
  Al  Al35  1  0.454481  0.448757  0.326246  1
  Al  Al36  1  1.001353  0.175239  0.374469  1
  Al  Al37  1  0.733090  0.915523  0.362478  1
  Al  Al38  1  0.258510  0.769744  0.394591  1
  Al  Al39  1  0.556003  0.510451  0.333395  1
  Al  Al40  1  0.074757  0.359846  0.358968  1
  Al  Al41  1  0.711039  0.431226  0.426575  1
  Al  Al42  1  0.269115  0.962488  0.443662  1
  Al  Al43  1  0.622272  0.732148  0.414518  1
  Al  Al44  1  0.231067  0.327494  0.460784  1
  Al  Al45  1  0.789764  0.006557  0.404560  1
  Al  Al46  1  0.311125  0.735712  0.487881  1
  Al  Al47  1  0.476191  0.558702  0.415660  1
  Al  Al48  1  0.082982  0.432185  0.449466  1
  Al  Al49  1  0.900758  0.028855  0.415468  1
  Al  Al50  1  0.415590  0.870457  0.450248  1
  Al  Al51  1  0.980555  0.391226  0.445362  1
  Al  Al52  1  0.524878  0.917503  0.449545  1
  Al  Al53  1  0.892356  0.701639  0.426854  1
  Al  Al54  1  0.408634  0.539335  0.456536  1
  Al  Al55  1  0.538859  0.072182  0.400447  1
  Al  Al56  1  0.139186  0.649466  0.438773  1
  Al  Al57  1  0.810838  0.537647  0.434689  1
  Al  Al58  1  0.336771  0.372745  0.466833  1
  Al  Al59  1  0.646961  0.128876  0.394711  1
  Al  Al60  1  0.167170  0.947668  0.427604  1
  Al  Al61  1  0.798742  0.874140  0.461349  1
  Al  Al62  1  0.325984  0.899815  0.533802  1
  Al  Al63  1  0.708628  0.322007  0.483800  1
  Al  Al64  1  0.233260  0.180142  0.513412  1
  Al  Al65  1  0.883959  0.551270  0.478835  1
  Al  Al66  1  0.405323  0.417414  0.509324  1
  Al  Al67  1  0.605337  0.278692  0.474133  1
  Al  Al68  1  0.103817  0.040926  0.510733  1
  Al  Al69  1  0.979004  0.657405  0.483531  1
  Al  Al70  1  0.510370  0.448922  0.509628  1
  Al  Al71  1  0.053581  0.824484  0.482622  1
  Al  Al72  1  0.591461  0.817670  0.541370  1
  Al  Al73  1  0.982687  0.178224  0.492119  1
  Al  Al74  1  0.510430  0.123023  0.516733  1
  Al  Al75  1  0.617357  0.618826  0.465888  1
  Al  Al76  1  0.136989  0.485734  0.495387  1
  Al  Al77  1  0.816296  0.124997  0.499428  1
  Al  Al78  1  0.421287  0.007738  0.530989  1
  Al  Al79  1  0.709050  0.728760  0.461350  1
  Al  Al80  1  0.241117  0.545958  0.499971  1
  Al  Al81  1  0.886952  0.310420  0.525166  1
  Al  Al82  1  0.394653  0.332794  0.564928  1
  Al  Al83  1  0.719234  0.168586  0.537262  1
  Al  Al84  1  0.328807  0.728323  0.585460  1
  Al  Al85  1  0.938336  0.077484  0.575898  1
  Al  Al86  1  0.494566  0.018144  0.572601  1
  Al  Al87  1  0.698578  0.849819  0.544022  1
  Al  Al88  1  0.121449  0.604266  0.575025  1
  Al  Al89  1  0.024848  0.251783  0.544821  1
  Al  Al90  1  0.599027  0.080286  0.573088  1
  Al  Al91  1  0.132136  0.304406  0.545261  1
  Al  Al92  1  0.662438  0.386987  0.608262  1
  Al  Al93  1  0.037045  0.907180  0.547770  1
  Al  Al94  1  0.567575  0.694134  0.593967  1
  Al  Al95  1  0.610049  0.497102  0.516821  1
  Al  Al96  1  0.228565  0.034587  0.567680  1
  Al  Al97  1  0.942210  0.747805  0.560592  1
  Al  Al98  1  0.472109  0.591019  0.596067  1
  Al  Al99  1  0.774548  0.431294  0.538000  1
  Al  Al100  1  0.313395  0.174106  0.566643  1
  Al  Al101  1  0.926993  0.291281  0.623109  1
  Al  Al102  1  0.470301  0.927942  0.625086  1
  Al  Al103  1  0.844387  0.620314  0.607951  1
  Al  Al104  1  0.337053  0.550299  0.636551  1
  Al  Al105  1  0.019216  0.801971  0.603048  1
  Al  Al106  1  0.544677  0.588202  0.644966  1
  Al  Al107  1  0.750920  0.524644  0.604366  1
  Al  Al108  1  0.280993  0.332378  0.641203  1
  Al  Al109  1  0.115074  0.878223  0.609186  1
  Al  Al110  1  0.639428  0.674839  0.643438  1
  Al  Al111  1  0.201800  0.176901  0.646460  1
  Al  Al112  1  0.738763  0.788836  0.640605  1
  Al  Al113  1  0.111210  0.495805  0.627511  1
  Al  Al114  1  0.644435  0.297226  0.659451  1
  Al  Al115  1  0.752083  0.909336  0.586474  1
  Al  Al116  1  0.226861  0.876126  0.616790  1
  Al  Al117  1  0.030597  0.348743  0.635282  1
  Al  Al118  1  0.541941  0.230056  0.660431  1
  Al  Al119  1  0.856992  0.931671  0.596805  1
  Al  Al120  1  0.385636  0.792205  0.629326  1
  Al  Al121  1  0.014108  0.684785  0.657593  1
  Al  Al122  1  0.500148  0.832171  0.716362  1
  Al  Al123  1  0.911613  0.195506  0.676494  1
  Al  Al124  1  0.429145  0.230483  0.663745  1
  Al  Al125  1  0.099652  0.355055  0.681360  1
  Al  Al126  1  0.609101  0.212851  0.708138  1
  Al  Al127  1  0.813303  0.126051  0.679024  1
  Al  Al128  1  0.372865  0.917468  0.709127  1
  Al  Al129  1  0.188743  0.478924  0.673177  1
  Al  Al130  1  0.705091  0.353054  0.704781  1
  Al  Al131  1  0.286032  0.787923  0.713261  1
  Al  Al132  1  0.807696  0.420506  0.708902  1
  Al  Al133  1  0.189392  0.052553  0.698253  1
  Al  Al134  1  0.727054  0.004163  0.686266  1
  Al  Al135  1  0.825442  0.492729  0.657155  1
  Al  Al136  1  0.301654  0.469498  0.688713  1
  Al  Al137  1  1.001402  0.926605  0.697649  1
  Al  Al138  1  0.607221  0.874160  0.712901  1
  Al  Al139  1  0.928219  0.537493  0.662322  1
  Al  Al140  1  0.501796  0.496641  0.698897  1
  Cu  Cu141  1  0.819875  0.543831  0.293586  1
  Cu  Cu142  1  0.280723  0.721034  0.272685  1
  Cu  Cu143  1  0.730132  0.698599  0.325073  1
  Cu  Cu144  1  0.191757  0.863791  0.306332  1
  Cu  Cu145  1  0.474057  0.120344  0.304718  1
  Cu  Cu146  1  0.910797  0.351460  0.265606  1
  Cu  Cu147  1  0.561678  0.825260  0.324893  1
  Cu  Cu148  1  0.999870  0.080440  0.282220  1
  Cu  Cu149  1  0.639652  0.962025  0.313376  1
  Cu  Cu150  1  0.101651  0.136290  0.289409  1
  Cu  Cu151  1  0.561319  0.622641  0.284396  1
  Cu  Cu152  1  0.078597  0.481441  0.307285  1
  Cu  Cu153  1  0.463523  0.787093  0.316158  1
  Cu  Cu154  1  0.988610  0.774574  0.292746  1
  Cu  Cu155  1  0.735439  0.028188  0.312334  1
  Cu  Cu156  1  0.174115  0.286260  0.279059  1
  Cu  Cu157  1  0.826107  0.756330  0.332376  1
  Cu  Cu158  1  0.265871  0.016809  0.295218  1
  Cu  Cu159  1  0.374476  0.070251  0.299850  1
  Cu  Cu160  1  0.901447  0.043038  0.274580  1
  Cu  Cu161  1  0.898869  0.139131  0.364261  1
  Cu  Cu162  1  0.379753  0.293684  0.336559  1
  Cu  Cu163  1  0.812310  0.309954  0.396656  1
  Cu  Cu164  1  0.286414  0.460414  0.368277  1
  Cu  Cu165  1  0.551234  0.708027  0.377123  1
  Cu  Cu166  1  0.994708  0.965896  0.332044  1
  Cu  Cu167  1  0.648808  0.441594  0.379205  1
  Cu  Cu168  1  0.086112  0.683806  0.347583  1
  Cu  Cu169  1  0.725482  0.578612  0.378144  1
  Cu  Cu170  1  0.189294  0.731078  0.356133  1
  Cu  Cu171  1  0.646455  0.215441  0.341760  1
  Cu  Cu172  1  0.166893  0.063469  0.377016  1
  Cu  Cu173  1  0.550660  0.381492  0.380274  1
  Cu  Cu174  1  0.985987  0.649962  0.340849  1
  Cu  Cu175  1  0.820715  0.644948  0.385720  1
  Cu  Cu176  1  0.262258  0.893391  0.344050  1
  Cu  Cu177  1  0.909593  0.354792  0.406045  1
  Cu  Cu178  1  0.356106  0.619204  0.359506  1
  Cu  Cu179  1  0.455507  0.673083  0.365247  1
  Cu  Cu180  1  0.893163  0.934862  0.323100  1
  Cu  Cu181  1  1.000157  0.741792  0.434001  1
  Cu  Cu182  1  0.462663  0.896862  0.404670  1
  Cu  Cu183  1  0.901505  0.937207  0.466675  1
  Cu  Cu184  1  0.327495  0.156272  0.431329  1
  Cu  Cu185  1  0.595862  0.426347  0.425321  1
  Cu  Cu186  1  0.084296  0.553739  0.399239  1
  Cu  Cu187  1  0.702276  0.125339  0.441355  1
  Cu  Cu188  1  0.173865  0.263641  0.418304  1
  Cu  Cu189  1  0.804215  0.192023  0.446671  1
  Cu  Cu190  1  0.240477  0.446070  0.411987  1
  Cu  Cu191  1  0.721106  0.819341  0.412986  1
  Cu  Cu192  1  0.255020  0.651156  0.446361  1
  Cu  Cu193  1  0.619222  0.013990  0.441306  1
  Cu  Cu194  1  0.073462  0.227139  0.409135  1
  Cu  Cu195  1  0.897092  0.246479  0.456889  1
  Cu  Cu196  1  0.345371  0.487930  0.413305  1
  Cu  Cu197  1  1.000125  0.056833  0.428244  1
  Cu  Cu198  1  0.429387  0.202609  0.430409  1
  Cu  Cu199  1  0.513164  0.265350  0.451556  1
  Cu  Cu200  1  0.984221  0.525504  0.394315  1
  Cu  Cu201  1  0.053363  0.355970  0.496807  1
  Cu  Cu202  1  0.514226  0.594064  0.462862  1
  Cu  Cu203  1  0.946723  0.512362  0.523879  1
  Cu  Cu204  1  0.420565  0.745517  0.499802  1
  Cu  Cu205  1  0.699697  0.003069  0.492088  1
  Cu  Cu206  1  0.167362  0.139852  0.473814  1
  Cu  Cu207  1  0.782835  0.720029  0.508245  1
  Cu  Cu208  1  0.217092  0.876991  0.521849  1
  Cu  Cu209  1  0.869715  0.807909  0.514087  1
  Cu  Cu210  1  0.332052  0.048130  0.483692  1
  Cu  Cu211  1  0.794973  0.441592  0.483433  1
  Cu  Cu212  1  0.327269  0.278759  0.518884  1
  Cu  Cu213  1  0.687699  0.634803  0.508610  1
  Cu  Cu214  1  0.168409  0.818817  0.477128  1
  Cu  Cu215  1  0.943621  0.953067  0.516697  1
  Cu  Cu216  1  0.432712  0.108240  0.480902  1
  Cu  Cu217  1  0.041439  0.601712  0.531655  1
  Cu  Cu218  1  0.518134  0.802715  0.500257  1
  Cu  Cu219  1  0.605831  0.927624  0.490050  1
  Cu  Cu220  1  0.075426  0.096729  0.458161  1
  Cu  Cu221  1  0.125398  1.000002  0.562017  1
  Cu  Cu222  1  0.612528  0.163974  0.524441  1
  Cu  Cu223  1  0.027384  0.150010  0.594560  1
  Cu  Cu224  1  0.501357  0.336244  0.559903  1
  Cu  Cu225  1  0.838670  0.653705  0.553586  1
  Cu  Cu226  1  0.211315  0.725929  0.570189  1
  Cu  Cu227  1  0.846039  0.345863  0.578766  1
  Cu  Cu228  1  0.304875  0.591458  0.540310  1
  Cu  Cu229  1  0.935858  0.433342  0.575088  1
  Cu  Cu230  1  0.414414  0.623883  0.548469  1
  Cu  Cu231  1  0.844720  0.067433  0.549088  1
  Cu  Cu232  1  0.405074  0.905037  0.579997  1
  Cu  Cu233  1  0.762627  0.222858  0.583514  1
  Cu  Cu234  1  0.223090  0.435222  0.548253  1
  Cu  Cu235  1  0.038505  0.466703  0.582764  1
  Cu  Cu236  1  0.504940  0.692855  0.548278  1
  Cu  Cu237  1  0.129133  0.193570  0.601786  1
  Cu  Cu238  1  0.593315  0.401628  0.564657  1
  Cu  Cu239  1  0.674725  0.523579  0.560692  1
  Cu  Cu240  1  0.143214  0.720527  0.528425  1
  Cu  Cu241  1  0.199514  0.601914  0.621946  1
  Cu  Cu242  1  0.659307  0.783783  0.594198  1
  Cu  Cu243  1  0.107407  0.767485  0.658995  1
  Cu  Cu244  1  0.565886  0.991500  0.620817  1
  Cu  Cu245  1  0.830915  0.220700  0.626464  1
  Cu  Cu246  1  0.289856  0.469680  0.591286  1
  Cu  Cu247  1  0.925265  0.956064  0.637149  1
  Cu  Cu248  1  0.376017  0.192758  0.612026  1
  Cu  Cu249  1  0.017403  0.029801  0.645277  1
  Cu  Cu250  1  0.466711  0.268312  0.610535  1
  Cu  Cu251  1  0.947523  0.640655  0.613903  1
  Cu  Cu252  1  0.454499  0.497536  0.646703  1
  Cu  Cu253  1  0.841912  0.841181  0.647343  1
  Cu  Cu254  1  0.297006  0.048449  0.613126  1
  Cu  Cu255  1  0.118887  0.061404  0.652030  1
  Cu  Cu256  1  0.561889  0.323276  0.611418  1
  Cu  Cu257  1  0.213416  0.768474  0.665669  1
  Cu  Cu258  1  0.657774  0.067285  0.618511  1
  Cu  Cu259  1  0.750772  0.103135  0.632979  1
  Cu  Cu260  1  0.209409  0.323979  0.596213  1
  Cu  Cu261  1  0.273192  0.173593  0.691982  1
  Cu  Cu262  1  0.734498  0.405196  0.654010  1
  Cu  Cu263  1  0.182754  0.364521  0.720831  1
  Cu  Cu264  1  0.598387  0.588337  0.692039  1
  Cu  Cu265  1  0.910718  0.842350  0.686843  1
  Cu  Cu266  1  0.361940  0.062863  0.660543  1
  Cu  Cu267  1  0.997485  0.563083  0.704759  1
  Cu  Cu268  1  0.452002  0.793348  0.671858  1
  Cu  Cu269  1  0.094224  0.645053  0.705941  1
  Cu  Cu270  1  0.538186  0.904737  0.668884  1
  Cu  Cu271  1  0.012019  0.244052  0.685352  1
  Cu  Cu272  1  0.504573  0.151142  0.706714  1
  Cu  Cu273  1  0.912342  0.450140  0.710863  1
  Cu  Cu274  1  0.382927  0.620246  0.684112  1
  Cu  Cu275  1  0.101227  0.961645  0.699424  1
  Cu  Cu276  1  0.636281  0.963652  0.665510  1
  Cu  Cu277  1  0.192572  0.687595  0.713203  1
  Cu  Cu278  1  0.710958  0.670924  0.687800  1
  Cu  Cu279  1  0.824523  0.726474  0.693731  1
  Cu  Cu280  1  0.294709  0.887390  0.662530  1
