# generated using pymatgen
data_Zr2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.78811817
_cell_length_b   25.49245318
_cell_length_c   50.33702589
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Cu
_chemical_formula_sum   'Zr192 Cu96'
_cell_volume   11277.0386924
_cell_formula_units_Z   96
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
  Zr  Zr1  1  0.505586  0.839024  0.344754  1
  Zr  Zr2  1  0.512889  0.396270  0.262772  1
  Zr  Zr3  1  0.814084  0.015422  0.317993  1
  Zr  Zr4  1  0.822884  0.456270  0.399895  1
  Zr  Zr5  1  1.005775  0.948623  0.364491  1
  Zr  Zr6  1  0.013036  0.505219  0.282480  1
  Zr  Zr7  1  0.193939  0.846009  0.379836  1
  Zr  Zr8  1  0.201969  0.406248  0.297034  1
  Zr  Zr9  1  0.012108  0.787052  0.332534  1
  Zr  Zr10  1  0.007986  0.349260  0.255442  1
  Zr  Zr11  1  0.696985  0.735289  0.358901  1
  Zr  Zr12  1  0.697653  0.290864  0.275781  1
  Zr  Zr13  1  0.505794  0.117424  0.395584  1
  Zr  Zr14  1  0.516403  0.672804  0.314400  1
  Zr  Zr15  1  0.753832  0.033226  0.379991  1
  Zr  Zr16  1  0.769215  0.591465  0.294262  1
  Zr  Zr17  1  0.821116  0.057905  0.261368  1
  Zr  Zr18  1  0.824925  0.501250  0.337553  1
  Zr  Zr19  1  0.189737  0.888345  0.317485  1
  Zr  Zr20  1  0.193334  0.330569  0.400057  1
  Zr  Zr21  1  0.178835  0.055362  0.261722  1
  Zr  Zr22  1  0.196333  0.501113  0.337443  1
  Zr  Zr23  1  0.822463  0.846307  0.379998  1
  Zr  Zr24  1  0.818967  0.406338  0.297477  1
  Zr  Zr25  1  0.805770  0.892109  0.318417  1
  Zr  Zr26  1  0.821790  0.330518  0.400073  1
  Zr  Zr27  1  1.005946  0.221768  0.269119  1
  Zr  Zr28  1  0.010211  0.672553  0.357146  1
  Zr  Zr29  1  0.507735  0.893738  0.401126  1
  Zr  Zr30  1  0.510365  0.454897  0.316593  1
  Zr  Zr31  1  0.729760  0.862165  0.255779  1
  Zr  Zr32  1  0.759608  0.312060  0.336657  1
  Zr  Zr33  1  1.004928  0.118150  0.303064  1
  Zr  Zr34  1  0.010993  0.559187  0.384456  1
  Zr  Zr35  1  0.324385  0.734588  0.359529  1
  Zr  Zr36  1  0.317420  0.290198  0.275636  1
  Zr  Zr37  1  0.505690  0.228225  0.323170  1
  Zr  Zr38  1  0.510624  0.668633  0.405318  1
  Zr  Zr39  1  0.689207  0.125673  0.337880  1
  Zr  Zr40  1  0.694650  0.690648  0.260489  1
  Zr  Zr41  1  0.499376  0.060861  0.290090  1
  Zr  Zr42  1  0.509149  0.506956  0.373963  1
  Zr  Zr43  1  0.186641  0.013626  0.318253  1
  Zr  Zr44  1  0.194809  0.456450  0.399822  1
  Zr  Zr45  1  0.989143  0.951226  0.273502  1
  Zr  Zr46  1  0.008532  0.396736  0.353300  1
  Zr  Zr47  1  0.228869  0.850932  0.257683  1
  Zr  Zr48  1  0.253523  0.312211  0.336509  1
  Zr  Zr49  1  0.334896  0.777580  0.301258  1
  Zr  Zr50  1  0.320691  0.220419  0.379735  1
  Zr  Zr51  1  0.680792  0.166517  0.278145  1
  Zr  Zr52  1  0.698138  0.608492  0.358540  1
  Zr  Zr53  1  0.689745  0.781011  0.300181  1
  Zr  Zr54  1  0.691909  0.220627  0.379897  1
  Zr  Zr55  1  0.319970  0.124757  0.337772  1
  Zr  Zr56  1  0.336183  0.689374  0.260316  1
  Zr  Zr57  1  0.328440  0.165414  0.277876  1
  Zr  Zr58  1  0.325253  0.608766  0.358194  1
  Zr  Zr59  1  0.500629  0.951729  0.315841  1
  Zr  Zr60  1  0.507835  0.392747  0.399132  1
  Zr  Zr61  1  1.005500  0.174127  0.358291  1
  Zr  Zr62  1  0.018907  0.741986  0.271711  1
  Zr  Zr63  1  0.257395  0.033377  0.380028  1
  Zr  Zr64  1  0.259368  0.591279  0.294018  1
  Zr  Zr65  1  0.508402  0.718641  0.510497  1
  Zr  Zr66  1  0.507025  0.279029  0.425981  1
  Zr  Zr67  1  0.822675  0.895528  0.484704  1
  Zr  Zr68  1  0.822708  0.334978  0.566529  1
  Zr  Zr69  1  0.007986  0.828455  0.531639  1
  Zr  Zr70  1  0.008070  0.389094  0.446756  1
  Zr  Zr71  1  0.193281  0.725168  0.546902  1
  Zr  Zr72  1  0.192660  0.285654  0.462539  1
  Zr  Zr73  1  0.008407  0.666998  0.499537  1
  Zr  Zr74  1  1.006763  0.227030  0.416280  1
  Zr  Zr75  1  0.693272  0.615422  0.525662  1
  Zr  Zr76  1  0.691968  0.175447  0.442196  1
  Zr  Zr77  1  0.507814  0.995895  0.563352  1
  Zr  Zr78  1  0.508451  0.556990  0.478818  1
  Zr  Zr79  1  0.758320  0.912379  0.547854  1
  Zr  Zr80  1  0.757379  0.472990  0.462476  1
  Zr  Zr81  1  0.821776  0.940428  0.422246  1
  Zr  Zr82  1  0.822513  0.380189  0.504459  1
  Zr  Zr83  1  0.193746  0.770071  0.484434  1
  Zr  Zr84  1  0.192931  0.209677  0.567197  1
  Zr  Zr85  1  0.192330  0.940367  0.422165  1
  Zr  Zr86  1  0.192899  0.380248  0.504476  1
  Zr  Zr87  1  0.823057  0.725170  0.546918  1
  Zr  Zr88  1  0.821915  0.285571  0.462505  1
  Zr  Zr89  1  0.823196  0.770096  0.484435  1
  Zr  Zr90  1  0.822115  0.209691  0.567198  1
  Zr  Zr91  1  1.006643  0.112772  0.442188  1
  Zr  Zr92  1  0.007781  0.552914  0.525139  1
  Zr  Zr93  1  0.508083  0.772303  0.568465  1
  Zr  Zr94  1  0.507468  0.333022  0.483368  1
  Zr  Zr95  1  0.761149  0.753182  0.421266  1
  Zr  Zr96  1  0.757730  0.192136  0.504711  1
  Zr  Zr97  1  0.007586  0.998652  0.468691  1
  Zr  Zr98  1  0.007655  0.438711  0.551146  1
  Zr  Zr99  1  0.322994  0.615391  0.525705  1
  Zr  Zr100  1  0.321620  0.175515  0.442162  1
  Zr  Zr101  1  0.507253  0.108278  0.489400  1
  Zr  Zr102  1  0.507993  0.548215  0.572776  1
  Zr  Zr103  1  0.692664  0.004889  0.505408  1
  Zr  Zr104  1  0.695144  0.566199  0.421123  1
  Zr  Zr105  1  0.507489  0.946846  0.458739  1
  Zr  Zr106  1  0.507630  0.386347  0.541269  1
  Zr  Zr107  1  0.193244  0.895464  0.484726  1
  Zr  Zr108  1  0.192370  0.334986  0.566533  1
  Zr  Zr109  1  0.008822  0.837190  0.437517  1
  Zr  Zr110  1  1.007413  0.276477  0.520231  1
  Zr  Zr111  1  0.257614  0.753098  0.421370  1
  Zr  Zr112  1  0.256984  0.192120  0.504712  1
  Zr  Zr113  1  0.324167  0.660537  0.463287  1
  Zr  Zr114  1  0.322024  0.099195  0.547408  1
  Zr  Zr115  1  0.691806  0.050274  0.442857  1
  Zr  Zr116  1  0.692685  0.489804  0.525526  1
  Zr  Zr117  1  0.693949  0.660509  0.463241  1
  Zr  Zr118  1  0.692991  0.099187  0.547396  1
  Zr  Zr119  1  0.322474  0.004974  0.505407  1
  Zr  Zr120  1  0.324494  0.566438  0.421148  1
  Zr  Zr121  1  0.321549  0.050442  0.442890  1
  Zr  Zr122  1  0.323002  0.489827  0.525502  1
  Zr  Zr123  1  0.508315  0.832720  0.484532  1
  Zr  Zr124  1  0.507507  0.271730  0.567240  1
  Zr  Zr125  1  0.007528  0.051873  0.526463  1
  Zr  Zr126  1  0.009332  0.613888  0.441225  1
  Zr  Zr127  1  0.257464  0.912397  0.547849  1
  Zr  Zr128  1  0.258582  0.473101  0.462393  1
  Zr  Zr129  1  0.508238  0.594952  0.678577  1
  Zr  Zr130  1  0.507652  0.157694  0.593088  1
  Zr  Zr131  1  0.823659  0.773685  0.651787  1
  Zr  Zr132  1  0.831452  0.222771  0.730007  1
  Zr  Zr133  1  0.009272  0.707420  0.698053  1
  Zr  Zr134  1  0.007603  0.266990  0.613337  1
  Zr  Zr135  1  0.196925  0.600425  0.711603  1
  Zr  Zr136  1  0.193858  0.163372  0.629482  1
  Zr  Zr137  1  0.008737  0.546002  0.666355  1
  Zr  Zr138  1  0.007566  0.105634  0.583977  1
  Zr  Zr139  1  0.696873  0.494717  0.693748  1
  Zr  Zr140  1  0.692931  0.053485  0.610219  1
  Zr  Zr141  1  0.508973  0.874516  0.725861  1
  Zr  Zr142  1  0.507675  0.435409  0.646361  1
  Zr  Zr143  1  0.760861  0.787034  0.714344  1
  Zr  Zr144  1  0.758728  0.350857  0.628507  1
  Zr  Zr145  1  0.823018  0.818991  0.589523  1
  Zr  Zr146  1  0.824073  0.259004  0.670643  1
  Zr  Zr147  1  0.193876  0.648831  0.651754  1
  Zr  Zr148  1  0.194874  0.100490  0.732134  1
  Zr  Zr149  1  0.193097  0.818992  0.589514  1
  Zr  Zr150  1  0.190977  0.258907  0.670636  1
  Zr  Zr151  1  0.822917  0.600841  0.711588  1
  Zr  Zr152  1  0.821399  0.163397  0.629508  1
  Zr  Zr153  1  0.822341  0.648759  0.651743  1
  Zr  Zr154  1  0.820690  0.100517  0.732156  1
  Zr  Zr155  1  0.007746  0.992477  0.611283  1
  Zr  Zr156  1  1.007194  0.435095  0.691269  1
  Zr  Zr157  1  0.510140  0.646054  0.735008  1
  Zr  Zr158  1  0.507537  0.211776  0.652114  1
  Zr  Zr159  1  0.757679  0.632143  0.588607  1
  Zr  Zr160  1  0.751066  0.072549  0.673679  1
  Zr  Zr161  1  0.007929  0.878073  0.636428  1
  Zr  Zr162  1  1.006730  0.326559  0.718069  1
  Zr  Zr163  1  0.318533  0.493907  0.693404  1
  Zr  Zr164  1  0.322522  0.053504  0.610212  1
  Zr  Zr165  1  0.507829  0.987052  0.657498  1
  Zr  Zr166  1  0.507136  0.425403  0.731547  1
  Zr  Zr167  1  0.697095  0.883058  0.673373  1
  Zr  Zr168  1  0.692351  0.445262  0.588001  1
  Zr  Zr169  1  0.508070  0.825215  0.626691  1
  Zr  Zr170  1  0.507851  0.270089  0.708239  1
  Zr  Zr171  1  0.192793  0.773763  0.651724  1
  Zr  Zr172  1  0.183879  0.222849  0.729978  1
  Zr  Zr173  1  0.007980  0.715765  0.604828  1
  Zr  Zr174  1  0.007715  0.157336  0.685649  1
  Zr  Zr175  1  0.257910  0.632128  0.588619  1
  Zr  Zr176  1  0.264468  0.072597  0.673661  1
  Zr  Zr177  1  0.322336  0.538947  0.630802  1
  Zr  Zr178  1  0.323281  0.980461  0.713037  1
  Zr  Zr179  1  0.693921  0.928464  0.610678  1
  Zr  Zr180  1  0.700291  0.368308  0.690804  1
  Zr  Zr181  1  0.693676  0.539012  0.630875  1
  Zr  Zr182  1  0.693542  0.980410  0.713099  1
  Zr  Zr183  1  0.319627  0.883068  0.673300  1
  Zr  Zr184  1  0.323028  0.445224  0.587973  1
  Zr  Zr185  1  0.321750  0.928492  0.610657  1
  Zr  Zr186  1  0.314006  0.367928  0.690822  1
  Zr  Zr187  1  0.507957  0.709297  0.652185  1
  Zr  Zr188  1  0.507666  0.164036  0.739470  1
  Zr  Zr189  1  0.008382  0.932448  0.695129  1
  Zr  Zr190  1  0.007663  0.492255  0.608507  1
  Zr  Zr191  1  0.257158  0.787216  0.714208  1
  Zr  Zr192  1  0.256579  0.350856  0.628521  1
  Cu  Cu193  1  0.663329  0.940606  0.361503  1
  Cu  Cu194  1  0.664829  0.498402  0.276151  1
  Cu  Cu195  1  0.505198  0.997304  0.404517  1
  Cu  Cu196  1  0.513840  0.557760  0.318214  1
  Cu  Cu197  1  0.659843  0.964422  0.271879  1
  Cu  Cu198  1  0.672573  0.406814  0.354715  1
  Cu  Cu199  1  0.317028  0.955064  0.273319  1
  Cu  Cu200  1  0.344632  0.406603  0.354464  1
  Cu  Cu201  1  0.510057  0.789212  0.398007  1
  Cu  Cu202  1  0.506580  0.347981  0.312867  1
  Cu  Cu203  1  0.486292  0.868760  0.286802  1
  Cu  Cu204  1  0.506147  0.309930  0.367238  1
  Cu  Cu205  1  0.009003  0.755232  0.389264  1
  Cu  Cu206  1  1.006905  0.308264  0.304664  1
  Cu  Cu207  1  0.848871  0.218757  0.317453  1
  Cu  Cu208  1  0.847885  0.659751  0.401684  1
  Cu  Cu209  1  0.163560  0.218507  0.317496  1
  Cu  Cu210  1  0.172179  0.659656  0.401616  1
  Cu  Cu211  1  0.973120  0.840440  0.283385  1
  Cu  Cu212  1  1.007270  0.277357  0.362456  1
  Cu  Cu213  1  0.166194  0.127649  0.397278  1
  Cu  Cu214  1  0.172456  0.686289  0.312240  1
  Cu  Cu215  1  0.845639  0.127384  0.397346  1
  Cu  Cu216  1  0.856745  0.688869  0.311599  1
  Cu  Cu217  1  1.004392  0.069351  0.356641  1
  Cu  Cu218  1  0.014319  0.636986  0.272414  1
  Cu  Cu219  1  1.005680  0.030121  0.410299  1
  Cu  Cu220  1  0.013609  0.589867  0.325680  1
  Cu  Cu221  1  0.506195  0.034199  0.348162  1
  Cu  Cu222  1  0.515310  0.596302  0.266614  1
  Cu  Cu223  1  0.345020  0.939698  0.361351  1
  Cu  Cu224  1  0.360412  0.498154  0.275841  1
  Cu  Cu225  1  0.668941  0.818478  0.529232  1
  Cu  Cu226  1  0.668006  0.378955  0.444196  1
  Cu  Cu227  1  0.507846  0.875903  0.571878  1
  Cu  Cu228  1  0.507880  0.436744  0.486754  1
  Cu  Cu229  1  0.669842  0.846826  0.439926  1
  Cu  Cu230  1  0.667808  0.286537  0.522231  1
  Cu  Cu231  1  0.347137  0.846954  0.439972  1
  Cu  Cu232  1  0.347033  0.286517  0.522240  1
  Cu  Cu233  1  0.507822  0.668450  0.564630  1
  Cu  Cu234  1  0.507180  0.229048  0.480668  1
  Cu  Cu235  1  0.509534  0.750643  0.452053  1
  Cu  Cu236  1  0.507362  0.189320  0.535014  1
  Cu  Cu237  1  0.007880  0.634867  0.557736  1
  Cu  Cu238  1  0.007462  0.195430  0.474196  1
  Cu  Cu239  1  0.847419  0.097883  0.487233  1
  Cu  Cu240  1  0.846295  0.538725  0.569708  1
  Cu  Cu241  1  0.166855  0.097970  0.487213  1
  Cu  Cu242  1  0.169413  0.538690  0.569714  1
  Cu  Cu243  1  0.008977  0.717381  0.445682  1
  Cu  Cu244  1  1.007330  0.155553  0.529193  1
  Cu  Cu245  1  0.166930  0.006293  0.565990  1
  Cu  Cu246  1  0.169321  0.567284  0.480662  1
  Cu  Cu247  1  0.848519  0.006301  0.566003  1
  Cu  Cu248  1  0.847467  0.567288  0.480508  1
  Cu  Cu249  1  0.007968  0.948323  0.523347  1
  Cu  Cu250  1  0.007824  0.509697  0.438730  1
  Cu  Cu251  1  0.007935  0.910091  0.578789  1
  Cu  Cu252  1  0.008039  0.470293  0.493043  1
  Cu  Cu253  1  0.507733  0.914823  0.517070  1
  Cu  Cu254  1  0.508265  0.475342  0.431553  1
  Cu  Cu255  1  0.347265  0.818511  0.529244  1
  Cu  Cu256  1  0.347524  0.378987  0.444143  1
  Cu  Cu257  1  0.666818  0.694149  0.696847  1
  Cu  Cu258  1  0.667308  0.256112  0.612269  1
  Cu  Cu259  1  0.508711  0.753515  0.734969  1
  Cu  Cu260  1  0.507642  0.315307  0.653566  1
  Cu  Cu261  1  0.668297  0.725587  0.607528  1
  Cu  Cu262  1  0.664464  0.167253  0.692071  1
  Cu  Cu263  1  0.347713  0.725543  0.607496  1
  Cu  Cu264  1  0.351028  0.167246  0.692091  1
  Cu  Cu265  1  0.504045  0.541837  0.730321  1
  Cu  Cu266  1  0.507845  0.108617  0.646886  1
  Cu  Cu267  1  0.507655  0.628286  0.619608  1
  Cu  Cu268  1  0.507933  0.075269  0.708472  1
  Cu  Cu269  1  0.009366  0.513109  0.723698  1
  Cu  Cu270  1  0.007682  0.074323  0.643427  1
  Cu  Cu271  1  0.845559  0.977750  0.656291  1
  Cu  Cu272  1  0.839533  0.423601  0.733397  1
  Cu  Cu273  1  0.170206  0.977778  0.656239  1
  Cu  Cu274  1  0.174691  0.423010  0.733401  1
  Cu  Cu275  1  0.007881  0.596267  0.612583  1
  Cu  Cu276  1  0.007712  0.037860  0.698341  1
  Cu  Cu277  1  0.176825  0.881559  0.730104  1
  Cu  Cu278  1  0.171278  0.445094  0.647364  1
  Cu  Cu279  1  0.841103  0.881489  0.730209  1
  Cu  Cu280  1  0.843479  0.445248  0.647449  1
  Cu  Cu281  1  0.008656  0.827898  0.690974  1
  Cu  Cu282  1  0.007577  0.388631  0.605121  1
  Cu  Cu283  1  0.009228  0.796774  0.741604  1
  Cu  Cu284  1  0.007534  0.350505  0.660162  1
  Cu  Cu285  1  0.509140  0.791970  0.684029  1
  Cu  Cu286  1  0.507615  0.354827  0.598758  1
  Cu  Cu287  1  0.350892  0.693988  0.696985  1
  Cu  Cu288  1  0.347849  0.256126  0.612271  1
