# generated using pymatgen
data_Zr2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.66781325
_cell_length_b   21.22914396
_cell_length_c   61.37893131
_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   11294.352815
_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  0.514459  0.993615  0.393364  1
  Zr  Zr2  1  0.514459  0.324492  0.310468  1
  Zr  Zr3  1  0.824933  0.874873  0.253686  1
  Zr  Zr4  1  0.830469  0.534055  0.335786  1
  Zr  Zr5  1  1.014459  0.741774  0.269049  1
  Zr  Zr6  1  1.014459  0.407338  0.351099  1
  Zr  Zr7  1  0.201689  0.622180  0.257699  1
  Zr  Zr8  1  0.197189  0.283307  0.336017  1
  Zr  Zr9  1  1.014459  0.952259  0.372688  1
  Zr  Zr10  1  1.014459  0.285577  0.288521  1
  Zr  Zr11  1  0.699970  0.869162  0.377949  1
  Zr  Zr12  1  0.703716  0.201170  0.295137  1
  Zr  Zr13  1  0.514459  0.865002  0.332633  1
  Zr  Zr14  1  0.514459  0.201181  0.253195  1
  Zr  Zr15  1  0.751835  0.794777  0.296673  1
  Zr  Zr16  1  0.764236  0.471339  0.382123  1
  Zr  Zr17  1  0.832548  0.657477  0.307205  1
  Zr  Zr18  1  0.828265  0.325435  0.388172  1
  Zr  Zr19  1  0.199374  0.076397  0.388109  1
  Zr  Zr20  1  0.201862  0.409174  0.304495  1
  Zr  Zr21  1  0.196370  0.657477  0.307205  1
  Zr  Zr22  1  0.200654  0.325435  0.388172  1
  Zr  Zr23  1  0.827229  0.622180  0.257699  1
  Zr  Zr24  1  0.831729  0.283307  0.336017  1
  Zr  Zr25  1  0.829545  0.076397  0.388109  1
  Zr  Zr26  1  0.827056  0.409174  0.304495  1
  Zr  Zr27  1  1.014459  0.807991  0.361119  1
  Zr  Zr28  1  1.014459  0.141357  0.275541  1
  Zr  Zr29  1  0.514459  0.671795  0.279223  1
  Zr  Zr30  1  0.514459  0.304474  0.361528  1
  Zr  Zr31  1  0.768415  0.134718  0.340532  1
  Zr  Zr32  1  0.753004  0.476679  0.257700  1
  Zr  Zr33  1  1.014459  0.992130  0.269260  1
  Zr  Zr34  1  1.014459  0.657802  0.352156  1
  Zr  Zr35  1  0.328949  0.869162  0.377949  1
  Zr  Zr36  1  0.325202  0.201170  0.295137  1
  Zr  Zr37  1  0.514459  0.072224  0.310382  1
  Zr  Zr38  1  0.514459  0.741848  0.394051  1
  Zr  Zr39  1  0.696003  0.947461  0.295558  1
  Zr  Zr40  1  0.698642  0.617746  0.378183  1
  Zr  Zr41  1  0.514459  0.959116  0.251164  1
  Zr  Zr42  1  0.514459  0.618318  0.331560  1
  Zr  Zr43  1  0.203985  0.874873  0.253686  1
  Zr  Zr44  1  0.198449  0.534055  0.335786  1
  Zr  Zr45  1  1.014459  0.200937  0.372707  1
  Zr  Zr46  1  1.014459  0.534101  0.290468  1
  Zr  Zr47  1  0.260503  0.134718  0.340532  1
  Zr  Zr48  1  0.275914  0.476679  0.257700  1
  Zr  Zr49  1  0.326668  0.988382  0.347007  1
  Zr  Zr50  1  0.326371  0.327125  0.266080  1
  Zr  Zr51  1  0.710199  0.740177  0.348586  1
  Zr  Zr52  1  0.696636  0.077304  0.264849  1
  Zr  Zr53  1  0.702250  0.988382  0.347007  1
  Zr  Zr54  1  0.702548  0.327125  0.266080  1
  Zr  Zr55  1  0.332916  0.947461  0.295558  1
  Zr  Zr56  1  0.330276  0.617746  0.378183  1
  Zr  Zr57  1  0.318719  0.740177  0.348586  1
  Zr  Zr58  1  0.332282  0.077304  0.264849  1
  Zr  Zr59  1  0.514459  0.826343  0.232719  1
  Zr  Zr60  1  0.514459  0.474431  0.319318  1
  Zr  Zr61  1  1.014459  0.966531  0.319691  1
  Zr  Zr62  1  1.014459  0.315022  0.240301  1
  Zr  Zr63  1  0.277083  0.794777  0.296673  1
  Zr  Zr64  1  0.264683  0.471339  0.382123  1
  Zr  Zr65  1  0.514459  0.339727  0.560691  1
  Zr  Zr66  1  0.514459  0.666379  0.476685  1
  Zr  Zr67  1  0.829139  0.204960  0.419246  1
  Zr  Zr68  1  0.829198  0.879271  0.502761  1
  Zr  Zr69  1  1.014459  0.079406  0.435186  1
  Zr  Zr70  1  1.014459  0.753473  0.518136  1
  Zr  Zr71  1  0.199853  0.955915  0.419291  1
  Zr  Zr72  1  0.200626  0.628919  0.502499  1
  Zr  Zr73  1  1.014459  0.299013  0.539855  1
  Zr  Zr74  1  1.014459  0.625050  0.456222  1
  Zr  Zr75  1  0.699636  0.215576  0.545133  1
  Zr  Zr76  1  0.699569  0.541245  0.461000  1
  Zr  Zr77  1  0.514459  0.212276  0.498049  1
  Zr  Zr78  1  0.514459  0.536556  0.414589  1
  Zr  Zr79  1  0.764116  0.146027  0.466483  1
  Zr  Zr80  1  0.764994  0.820078  0.549643  1
  Zr  Zr81  1  0.828316  0.999676  0.471966  1
  Zr  Zr82  1  0.829009  0.673047  0.554905  1
  Zr  Zr83  1  0.199695  0.423328  0.555233  1
  Zr  Zr84  1  0.200020  0.750075  0.471731  1
  Zr  Zr85  1  0.200602  0.999676  0.471966  1
  Zr  Zr86  1  0.199909  0.673047  0.554905  1
  Zr  Zr87  1  0.829066  0.955915  0.419291  1
  Zr  Zr88  1  0.828292  0.628919  0.502499  1
  Zr  Zr89  1  0.829224  0.423328  0.555233  1
  Zr  Zr90  1  0.828898  0.750075  0.471731  1
  Zr  Zr91  1  1.014459  0.151016  0.529625  1
  Zr  Zr92  1  1.014459  0.477788  0.445066  1
  Zr  Zr93  1  0.514459  0.978307  0.445448  1
  Zr  Zr94  1  0.514459  0.650788  0.528892  1
  Zr  Zr95  1  0.764033  0.482128  0.508068  1
  Zr  Zr96  1  0.764726  0.808958  0.424334  1
  Zr  Zr97  1  1.014459  0.329269  0.434966  1
  Zr  Zr98  1  1.014459  1.003768  0.518559  1
  Zr  Zr99  1  0.329282  0.215576  0.545133  1
  Zr  Zr100  1  0.329349  0.541245  0.461000  1
  Zr  Zr101  1  0.514459  0.415514  0.476665  1
  Zr  Zr102  1  0.514459  0.090836  0.560739  1
  Zr  Zr103  1  0.700199  0.292029  0.461019  1
  Zr  Zr104  1  0.700565  0.966997  0.544529  1
  Zr  Zr105  1  0.514459  0.288490  0.414132  1
  Zr  Zr106  1  0.514459  0.962579  0.497897  1
  Zr  Zr107  1  0.199779  0.204960  0.419246  1
  Zr  Zr108  1  0.199721  0.879271  0.502761  1
  Zr  Zr109  1  1.014459  0.548971  0.539220  1
  Zr  Zr110  1  1.014459  0.875377  0.456156  1
  Zr  Zr111  1  0.264886  0.482128  0.508068  1
  Zr  Zr112  1  0.264193  0.808958  0.424334  1
  Zr  Zr113  1  0.328624  0.335719  0.513707  1
  Zr  Zr114  1  0.327601  0.661762  0.430422  1
  Zr  Zr115  1  0.699630  0.086963  0.513782  1
  Zr  Zr116  1  0.700179  0.412419  0.429738  1
  Zr  Zr117  1  0.700294  0.335719  0.513707  1
  Zr  Zr118  1  0.701318  0.661762  0.430422  1
  Zr  Zr119  1  0.328720  0.292029  0.461019  1
  Zr  Zr120  1  0.328354  0.966997  0.544529  1
  Zr  Zr121  1  0.329288  0.086963  0.513782  1
  Zr  Zr122  1  0.328739  0.412419  0.429738  1
  Zr  Zr123  1  0.514459  0.140977  0.403018  1
  Zr  Zr124  1  0.514459  0.814721  0.487084  1
  Zr  Zr125  1  1.014459  0.313977  0.487355  1
  Zr  Zr126  1  1.014459  0.640867  0.403645  1
  Zr  Zr127  1  0.264803  0.146027  0.466483  1
  Zr  Zr128  1  0.263925  0.820078  0.549643  1
  Zr  Zr129  1  0.514459  0.675159  0.721770  1
  Zr  Zr130  1  0.514459  0.011504  0.644160  1
  Zr  Zr131  1  0.829679  0.551917  0.586033  1
  Zr  Zr132  1  0.832671  0.221862  0.671314  1
  Zr  Zr133  1  1.014459  0.426433  0.601797  1
  Zr  Zr134  1  1.014459  0.100084  0.686630  1
  Zr  Zr135  1  0.200991  0.302708  0.586688  1
  Zr  Zr136  1  0.199855  0.972694  0.669519  1
  Zr  Zr137  1  1.014459  0.639585  0.704828  1
  Zr  Zr138  1  1.014459  0.971663  0.622895  1
  Zr  Zr139  1  0.695760  0.553738  0.709884  1
  Zr  Zr140  1  0.702121  0.888876  0.627620  1
  Zr  Zr141  1  0.514459  0.555566  0.663959  1
  Zr  Zr142  1  0.514459  0.886563  0.581158  1
  Zr  Zr143  1  0.768830  0.493143  0.633386  1
  Zr  Zr144  1  0.768523  0.158833  0.718507  1
  Zr  Zr145  1  0.832099  0.345349  0.639150  1
  Zr  Zr146  1  0.829777  0.010460  0.718566  1
  Zr  Zr147  1  0.205349  0.757471  0.719165  1
  Zr  Zr148  1  0.198101  0.095661  0.639632  1
  Zr  Zr149  1  0.196819  0.345349  0.639150  1
  Zr  Zr150  1  0.199142  0.010460  0.718566  1
  Zr  Zr151  1  0.827928  0.302708  0.586688  1
  Zr  Zr152  1  0.829063  0.972694  0.669519  1
  Zr  Zr153  1  0.823569  0.757471  0.719165  1
  Zr  Zr154  1  0.830817  0.095661  0.639632  1
  Zr  Zr155  1  1.014459  0.493012  0.698908  1
  Zr  Zr156  1  1.014459  0.824096  0.612595  1
  Zr  Zr157  1  0.514459  0.323660  0.613448  1
  Zr  Zr158  1  0.514459  0.983862  0.696552  1
  Zr  Zr159  1  0.758459  0.827195  0.675623  1
  Zr  Zr160  1  0.763585  0.157001  0.592959  1
  Zr  Zr161  1  1.014459  0.676860  0.601364  1
  Zr  Zr162  1  1.014459  0.347421  0.687466  1
  Zr  Zr163  1  0.333158  0.553738  0.709884  1
  Zr  Zr164  1  0.326798  0.888876  0.627620  1
  Zr  Zr165  1  0.514459  0.764450  0.641869  1
  Zr  Zr166  1  0.514459  0.428563  0.721212  1
  Zr  Zr167  1  0.701198  0.639531  0.627038  1
  Zr  Zr168  1  0.701878  0.305380  0.708476  1
  Zr  Zr169  1  0.514459  0.635548  0.580915  1
  Zr  Zr170  1  0.514459  0.305160  0.664734  1
  Zr  Zr171  1  0.199239  0.551917  0.586033  1
  Zr  Zr172  1  0.196247  0.221862  0.671314  1
  Zr  Zr173  1  1.014459  0.886837  0.705458  1
  Zr  Zr174  1  1.014459  0.221989  0.623489  1
  Zr  Zr175  1  0.270460  0.827195  0.675623  1
  Zr  Zr176  1  0.265333  0.157001  0.592959  1
  Zr  Zr177  1  0.333706  0.680041  0.678077  1
  Zr  Zr178  1  0.329228  0.010535  0.597290  1
  Zr  Zr179  1  0.703421  0.428883  0.679281  1
  Zr  Zr180  1  0.699647  0.760554  0.596300  1
  Zr  Zr181  1  0.695213  0.680041  0.678077  1
  Zr  Zr182  1  0.699690  0.010535  0.597290  1
  Zr  Zr183  1  0.327720  0.639531  0.627038  1
  Zr  Zr184  1  0.327040  0.305380  0.708476  1
  Zr  Zr185  1  0.325497  0.428883  0.679281  1
  Zr  Zr186  1  0.329272  0.760554  0.596300  1
  Zr  Zr187  1  0.514459  0.487900  0.571223  1
  Zr  Zr188  1  0.514459  0.158220  0.656287  1
  Zr  Zr189  1  1.014459  0.660031  0.654085  1
  Zr  Zr190  1  1.014459  0.988673  0.571047  1
  Zr  Zr191  1  0.260089  0.493143  0.633386  1
  Zr  Zr192  1  0.260395  0.158833  0.718507  1
  Cu  Cu193  1  0.702803  0.748270  0.254991  1
  Cu  Cu194  1  0.680672  0.403306  0.346746  1
  Cu  Cu195  1  0.514459  0.736136  0.315321  1
  Cu  Cu196  1  0.514459  0.401663  0.389573  1
  Cu  Cu197  1  0.686295  0.205931  0.374960  1
  Cu  Cu198  1  0.669510  0.553189  0.292178  1
  Cu  Cu199  1  0.342624  0.205931  0.374960  1
  Cu  Cu200  1  0.359409  0.553189  0.292178  1
  Cu  Cu201  1  0.514459  0.565594  0.255211  1
  Cu  Cu202  1  0.514459  0.204916  0.334332  1
  Cu  Cu203  1  0.514459  0.094921  0.361751  1
  Cu  Cu204  1  0.514459  0.430317  0.279873  1
  Cu  Cu205  1  1.014459  0.525209  0.242964  1
  Cu  Cu206  1  1.014459  0.178609  0.317928  1
  Cu  Cu207  1  0.855553  0.068021  0.305106  1
  Cu  Cu208  1  0.850143  0.739538  0.390059  1
  Cu  Cu209  1  0.173366  0.068021  0.305106  1
  Cu  Cu210  1  0.178775  0.739538  0.390059  1
  Cu  Cu211  1  1.014459  0.062990  0.347859  1
  Cu  Cu212  1  1.014459  0.412841  0.266711  1
  Cu  Cu213  1  0.191665  0.868108  0.332247  1
  Cu  Cu214  1  0.193298  0.212934  0.251582  1
  Cu  Cu215  1  0.837254  0.868108  0.332247  1
  Cu  Cu216  1  0.835621  0.212934  0.251582  1
  Cu  Cu217  1  1.014459  0.867215  0.292206  1
  Cu  Cu218  1  1.014459  0.542657  0.376134  1
  Cu  Cu219  1  1.014459  0.764564  0.319916  1
  Cu  Cu220  1  1.014459  0.431446  0.404252  1
  Cu  Cu221  1  0.514459  0.844652  0.275023  1
  Cu  Cu222  1  0.514459  0.513709  0.360543  1
  Cu  Cu223  1  0.326115  0.748270  0.254991  1
  Cu  Cu224  1  0.348246  0.403306  0.346746  1
  Cu  Cu225  1  0.685159  0.076292  0.431670  1
  Cu  Cu226  1  0.685306  0.748928  0.515319  1
  Cu  Cu227  1  0.514459  0.075905  0.473456  1
  Cu  Cu228  1  0.514459  0.749465  0.556281  1
  Cu  Cu229  1  0.684837  0.552757  0.542567  1
  Cu  Cu230  1  0.686040  0.880060  0.458841  1
  Cu  Cu231  1  0.344081  0.552757  0.542567  1
  Cu  Cu232  1  0.342878  0.880060  0.458841  1
  Cu  Cu233  1  0.514459  0.879761  0.417980  1
  Cu  Cu234  1  0.514459  0.552633  0.501187  1
  Cu  Cu235  1  0.514459  0.441726  0.530230  1
  Cu  Cu236  1  0.514459  0.768460  0.446140  1
  Cu  Cu237  1  1.014459  0.849737  0.402448  1
  Cu  Cu238  1  1.014459  0.522572  0.486189  1
  Cu  Cu239  1  0.844073  0.412171  0.473357  1
  Cu  Cu240  1  0.841682  0.086766  0.557954  1
  Cu  Cu241  1  0.184846  0.412171  0.473357  1
  Cu  Cu242  1  0.187236  0.086766  0.557954  1
  Cu  Cu243  1  1.014459  0.412118  0.515041  1
  Cu  Cu244  1  1.014459  0.738544  0.431806  1
  Cu  Cu245  1  0.185456  0.215869  0.501284  1
  Cu  Cu246  1  0.186491  0.542637  0.416776  1
  Cu  Cu247  1  0.843462  0.215869  0.501284  1
  Cu  Cu248  1  0.842427  0.542637  0.416776  1
  Cu  Cu249  1  1.014459  0.216027  0.459502  1
  Cu  Cu250  1  1.014459  0.890881  0.543064  1
  Cu  Cu251  1  1.014459  0.105855  0.488457  1
  Cu  Cu252  1  1.014459  0.779269  0.571558  1
  Cu  Cu253  1  0.514459  0.186187  0.444246  1
  Cu  Cu254  1  0.514459  0.860662  0.528083  1
  Cu  Cu255  1  0.343759  0.076292  0.431670  1
  Cu  Cu256  1  0.343613  0.748928  0.515319  1
  Cu  Cu257  1  0.684614  0.421862  0.599240  1
  Cu  Cu258  1  0.680837  0.088787  0.683892  1
  Cu  Cu259  1  0.514459  0.424131  0.640093  1
  Cu  Cu260  1  0.514459  0.083587  0.721503  1
  Cu  Cu261  1  0.682785  0.885997  0.712774  1
  Cu  Cu262  1  0.683029  0.225692  0.628541  1
  Cu  Cu263  1  0.346134  0.885997  0.712774  1
  Cu  Cu264  1  0.345889  0.225692  0.628541  1
  Cu  Cu265  1  0.514459  0.226711  0.585285  1
  Cu  Cu266  1  0.514459  0.895778  0.666130  1
  Cu  Cu267  1  0.514459  0.785657  0.699375  1
  Cu  Cu268  1  0.514459  0.115304  0.615006  1
  Cu  Cu269  1  1.014459  0.196708  0.570560  1
  Cu  Cu270  1  1.014459  0.867207  0.653982  1
  Cu  Cu271  1  0.842507  0.758488  0.640381  1
  Cu  Cu272  1  0.836344  0.419323  0.721824  1
  Cu  Cu273  1  0.186412  0.758488  0.640381  1
  Cu  Cu274  1  0.192574  0.419323  0.721824  1
  Cu  Cu275  1  1.014459  0.758327  0.681262  1
  Cu  Cu276  1  1.014459  0.086432  0.598997  1
  Cu  Cu277  1  0.175804  0.559803  0.668950  1
  Cu  Cu278  1  0.184918  0.890246  0.584301  1
  Cu  Cu279  1  0.853115  0.559803  0.668950  1
  Cu  Cu280  1  0.844000  0.890246  0.584301  1
  Cu  Cu281  1  1.014459  0.564310  0.625889  1
  Cu  Cu282  1  1.014459  0.235357  0.711015  1
  Cu  Cu283  1  1.014459  0.450495  0.656773  1
  Cu  Cu284  1  1.014459  0.104835  0.735766  1
  Cu  Cu285  1  0.514459  0.533313  0.612421  1
  Cu  Cu286  1  0.514459  0.198264  0.696924  1
  Cu  Cu287  1  0.344304  0.421862  0.599240  1
  Cu  Cu288  1  0.348082  0.088787  0.683892  1
