# generated using pymatgen
data_ZrCu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.85218966
_cell_length_b   21.70122777
_cell_length_c   52.46453915
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCu5
_chemical_formula_sum   'Zr48 Cu240'
_cell_volume   7801.52568907
_cell_formula_units_Z   48
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  0.505696  0.401430  0.334612  1
  Zr  Zr2  1  0.509247  0.098721  0.293498  1
  Zr  Zr3  1  0.483599  0.806341  0.260870  1
  Zr  Zr4  1  0.015221  0.249593  0.312659  1
  Zr  Zr5  1  0.990289  0.954345  0.276995  1
  Zr  Zr6  1  1.002029  0.551127  0.356400  1
  Zr  Zr7  1  0.990289  0.454345  0.276995  1
  Zr  Zr8  1  1.002029  0.051127  0.356400  1
  Zr  Zr9  1  0.015221  0.749593  0.312659  1
  Zr  Zr10  1  0.483599  0.306341  0.260870  1
  Zr  Zr11  1  0.505696  0.901430  0.334612  1
  Zr  Zr12  1  0.509247  0.598721  0.293498  1
  Zr  Zr13  1  0.504877  0.299525  0.460169  1
  Zr  Zr14  1  0.504915  1.000117  0.418628  1
  Zr  Zr15  1  0.504108  0.700407  0.376302  1
  Zr  Zr16  1  0.004799  0.149949  0.439411  1
  Zr  Zr17  1  0.005087  0.849944  0.397563  1
  Zr  Zr18  1  0.004734  0.449415  0.481082  1
  Zr  Zr19  1  0.005087  0.349944  0.397563  1
  Zr  Zr20  1  0.004734  0.949415  0.481082  1
  Zr  Zr21  1  0.004799  0.649949  0.439411  1
  Zr  Zr22  1  0.504108  0.200407  0.376302  1
  Zr  Zr23  1  0.504877  0.799525  0.460169  1
  Zr  Zr24  1  0.504915  0.500117  0.418628  1
  Zr  Zr25  1  0.504892  0.198630  0.585727  1
  Zr  Zr26  1  0.504822  0.898924  0.543773  1
  Zr  Zr27  1  0.504706  0.599339  0.502207  1
  Zr  Zr28  1  0.004936  0.048783  0.564843  1
  Zr  Zr29  1  0.004770  0.749235  0.523004  1
  Zr  Zr30  1  0.004073  0.348198  0.606536  1
  Zr  Zr31  1  0.004770  0.249235  0.523004  1
  Zr  Zr32  1  0.004073  0.848198  0.606536  1
  Zr  Zr33  1  0.004936  0.548783  0.564843  1
  Zr  Zr34  1  0.504706  0.099339  0.502207  1
  Zr  Zr35  1  0.504892  0.698630  0.585727  1
  Zr  Zr36  1  0.504822  0.398924  0.543773  1
  Zr  Zr37  1  0.514983  0.097460  0.708733  1
  Zr  Zr38  1  0.505820  0.796046  0.670826  1
  Zr  Zr39  1  0.504159  0.498937  0.626806  1
  Zr  Zr40  1  0.015580  0.948470  0.690268  1
  Zr  Zr41  1  0.005053  0.647783  0.648670  1
  Zr  Zr42  1  0.965098  0.245984  0.724934  1
  Zr  Zr43  1  0.005053  0.147783  0.648670  1
  Zr  Zr44  1  0.965098  0.745984  0.724934  1
  Zr  Zr45  1  0.015580  0.448470  0.690268  1
  Zr  Zr46  1  0.504159  0.998937  0.626806  1
  Zr  Zr47  1  0.514983  0.597460  0.708733  1
  Zr  Zr48  1  0.505820  0.296046  0.670826  1
  Cu  Cu49  1  0.766637  0.204562  0.277063  1
  Cu  Cu50  1  0.756764  0.799983  0.355710  1
  Cu  Cu51  1  0.750810  0.502023  0.314912  1
  Cu  Cu52  1  0.385324  0.219983  0.291997  1
  Cu  Cu53  1  0.329068  0.921613  0.253714  1
  Cu  Cu54  1  0.379346  0.526945  0.335019  1
  Cu  Cu55  1  0.629743  0.100144  0.345176  1
  Cu  Cu56  1  0.637707  0.800190  0.304891  1
  Cu  Cu57  1  0.610276  0.501939  0.260835  1
  Cu  Cu58  1  0.627808  0.200805  0.324153  1
  Cu  Cu59  1  0.626560  0.903955  0.282536  1
  Cu  Cu60  1  0.626507  0.501258  0.366358  1
  Cu  Cu61  1  0.381732  0.075314  0.376519  1
  Cu  Cu62  1  0.379785  0.774902  0.333494  1
  Cu  Cu63  1  0.381379  0.474133  0.293575  1
  Cu  Cu64  1  0.246064  0.353203  0.295626  1
  Cu  Cu65  1  0.243740  0.043055  0.258945  1
  Cu  Cu66  1  0.256265  0.650372  0.334792  1
  Cu  Cu67  1  0.880660  0.375250  0.313798  1
  Cu  Cu68  1  0.870526  0.076049  0.270296  1
  Cu  Cu69  1  0.883427  0.676053  0.355236  1
  Cu  Cu70  1  0.129191  0.249715  0.365764  1
  Cu  Cu71  1  0.126955  0.951373  0.325608  1
  Cu  Cu72  1  0.130024  0.649618  0.279432  1
  Cu  Cu73  1  0.126837  0.350934  0.345197  1
  Cu  Cu74  1  0.122620  0.053836  0.304144  1
  Cu  Cu75  1  0.128310  0.754222  0.261685  1
  Cu  Cu76  1  0.888143  0.326292  0.270849  1
  Cu  Cu77  1  0.879093  0.925175  0.355521  1
  Cu  Cu78  1  0.882936  0.625166  0.312714  1
  Cu  Cu79  1  0.256265  0.150372  0.334792  1
  Cu  Cu80  1  0.246064  0.853203  0.295626  1
  Cu  Cu81  1  0.243740  0.543055  0.258945  1
  Cu  Cu82  1  0.883427  0.176053  0.355236  1
  Cu  Cu83  1  0.880660  0.875250  0.313798  1
  Cu  Cu84  1  0.870526  0.576049  0.270296  1
  Cu  Cu85  1  0.130024  0.149618  0.279432  1
  Cu  Cu86  1  0.129191  0.749715  0.365764  1
  Cu  Cu87  1  0.126955  0.451373  0.325608  1
  Cu  Cu88  1  0.128310  0.254222  0.261685  1
  Cu  Cu89  1  0.126837  0.850934  0.345197  1
  Cu  Cu90  1  0.122620  0.553836  0.304144  1
  Cu  Cu91  1  0.882936  0.125166  0.312714  1
  Cu  Cu92  1  0.888143  0.826292  0.270849  1
  Cu  Cu93  1  0.879093  0.425175  0.355521  1
  Cu  Cu94  1  0.756764  0.299983  0.355710  1
  Cu  Cu95  1  0.750810  1.002023  0.314912  1
  Cu  Cu96  1  0.766637  0.704562  0.277063  1
  Cu  Cu97  1  0.329068  0.421613  0.253714  1
  Cu  Cu98  1  0.379346  0.026945  0.335019  1
  Cu  Cu99  1  0.385324  0.719983  0.291997  1
  Cu  Cu100  1  0.637707  0.300190  0.304891  1
  Cu  Cu101  1  0.610276  1.001939  0.260835  1
  Cu  Cu102  1  0.629743  0.600144  0.345176  1
  Cu  Cu103  1  0.626560  0.403955  0.282536  1
  Cu  Cu104  1  0.626507  1.001258  0.366358  1
  Cu  Cu105  1  0.627808  0.700805  0.324153  1
  Cu  Cu106  1  0.379785  0.274902  0.333494  1
  Cu  Cu107  1  0.381379  0.974133  0.293575  1
  Cu  Cu108  1  0.381732  0.575314  0.376519  1
  Cu  Cu109  1  0.754209  0.100464  0.397706  1
  Cu  Cu110  1  0.754863  0.699493  0.481188  1
  Cu  Cu111  1  0.754839  0.399701  0.439310  1
  Cu  Cu112  1  0.381274  0.125646  0.418593  1
  Cu  Cu113  1  0.382722  0.825392  0.376244  1
  Cu  Cu114  1  0.381631  0.424885  0.460359  1
  Cu  Cu115  1  0.628066  0.999086  0.470782  1
  Cu  Cu116  1  0.628086  0.699416  0.428765  1
  Cu  Cu117  1  0.627836  0.399613  0.387111  1
  Cu  Cu118  1  0.627999  0.100421  0.449889  1
  Cu  Cu119  1  0.627994  0.800340  0.407762  1
  Cu  Cu120  1  0.628111  0.399848  0.491544  1
  Cu  Cu121  1  0.381359  0.973917  0.501883  1
  Cu  Cu122  1  0.381697  0.674264  0.460147  1
  Cu  Cu123  1  0.381292  0.374294  0.418116  1
  Cu  Cu124  1  0.255125  0.249955  0.418312  1
  Cu  Cu125  1  0.254837  0.950307  0.376942  1
  Cu  Cu126  1  0.254893  0.549723  0.460333  1
  Cu  Cu127  1  0.881553  0.275149  0.439365  1
  Cu  Cu128  1  0.881011  0.975349  0.397808  1
  Cu  Cu129  1  0.881398  0.574921  0.481367  1
  Cu  Cu130  1  0.128106  0.148930  0.491675  1
  Cu  Cu131  1  0.128237  0.849097  0.449746  1
  Cu  Cu132  1  0.128189  0.549705  0.408155  1
  Cu  Cu133  1  0.128041  0.250101  0.470666  1
  Cu  Cu134  1  0.128283  0.950368  0.428847  1
  Cu  Cu135  1  0.127965  0.651079  0.387073  1
  Cu  Cu136  1  0.881395  0.224497  0.397135  1
  Cu  Cu137  1  0.881355  0.823972  0.480935  1
  Cu  Cu138  1  0.881515  0.524550  0.439204  1
  Cu  Cu139  1  0.254893  0.049723  0.460333  1
  Cu  Cu140  1  0.255125  0.749955  0.418312  1
  Cu  Cu141  1  0.254837  0.450307  0.376942  1
  Cu  Cu142  1  0.881398  0.074921  0.481367  1
  Cu  Cu143  1  0.881553  0.775149  0.439365  1
  Cu  Cu144  1  0.881011  0.475349  0.397808  1
  Cu  Cu145  1  0.128189  0.049705  0.408155  1
  Cu  Cu146  1  0.128106  0.648930  0.491675  1
  Cu  Cu147  1  0.128237  0.349097  0.449746  1
  Cu  Cu148  1  0.127965  0.151079  0.387073  1
  Cu  Cu149  1  0.128041  0.750101  0.470666  1
  Cu  Cu150  1  0.128283  0.450368  0.428847  1
  Cu  Cu151  1  0.881515  0.024550  0.439204  1
  Cu  Cu152  1  0.881395  0.724497  0.397135  1
  Cu  Cu153  1  0.881355  0.323972  0.480935  1
  Cu  Cu154  1  0.754863  0.199493  0.481188  1
  Cu  Cu155  1  0.754839  0.899701  0.439310  1
  Cu  Cu156  1  0.754209  0.600464  0.397706  1
  Cu  Cu157  1  0.382722  0.325392  0.376244  1
  Cu  Cu158  1  0.381631  0.924885  0.460359  1
  Cu  Cu159  1  0.381274  0.625646  0.418593  1
  Cu  Cu160  1  0.628086  0.199416  0.428765  1
  Cu  Cu161  1  0.627836  0.899613  0.387111  1
  Cu  Cu162  1  0.628066  0.499086  0.470782  1
  Cu  Cu163  1  0.627994  0.300340  0.407762  1
  Cu  Cu164  1  0.628111  0.899848  0.491544  1
  Cu  Cu165  1  0.627999  0.600421  0.449889  1
  Cu  Cu166  1  0.381697  0.174264  0.460147  1
  Cu  Cu167  1  0.381292  0.874294  0.418116  1
  Cu  Cu168  1  0.381359  0.473917  0.501883  1
  Cu  Cu169  1  0.755064  0.999126  0.522955  1
  Cu  Cu170  1  0.755455  0.598612  0.606508  1
  Cu  Cu171  1  0.754661  0.298753  0.564843  1
  Cu  Cu172  1  0.381345  0.024335  0.544123  1
  Cu  Cu173  1  0.381397  0.724785  0.502251  1
  Cu  Cu174  1  0.381625  0.324150  0.585923  1
  Cu  Cu175  1  0.628127  0.897867  0.596098  1
  Cu  Cu176  1  0.628330  0.598388  0.554446  1
  Cu  Cu177  1  0.628002  0.298661  0.512511  1
  Cu  Cu178  1  0.628315  0.999184  0.575129  1
  Cu  Cu179  1  0.628142  0.699629  0.533473  1
  Cu  Cu180  1  0.627202  0.298694  0.617440  1
  Cu  Cu181  1  0.383536  0.872673  0.627763  1
  Cu  Cu182  1  0.381388  0.573693  0.585552  1
  Cu  Cu183  1  0.381473  0.273542  0.543811  1
  Cu  Cu184  1  0.254784  0.149054  0.543921  1
  Cu  Cu185  1  0.254907  0.849273  0.502025  1
  Cu  Cu186  1  0.254795  0.448420  0.585642  1
  Cu  Cu187  1  0.881629  0.174375  0.565033  1
  Cu  Cu188  1  0.881626  0.874482  0.523092  1
  Cu  Cu189  1  0.881925  0.473619  0.606765  1
  Cu  Cu190  1  0.127736  0.047939  0.617033  1
  Cu  Cu191  1  0.128000  0.748241  0.575383  1
  Cu  Cu192  1  0.127991  0.448469  0.533403  1
  Cu  Cu193  1  0.128263  0.149243  0.596300  1
  Cu  Cu194  1  0.128194  0.849356  0.554347  1
  Cu  Cu195  1  0.128022  0.549724  0.512537  1
  Cu  Cu196  1  0.881657  0.123815  0.522891  1
  Cu  Cu197  1  0.880927  0.722909  0.606684  1
  Cu  Cu198  1  0.881332  0.423284  0.564625  1
  Cu  Cu199  1  0.254795  0.948420  0.585642  1
  Cu  Cu200  1  0.254784  0.649054  0.543921  1
  Cu  Cu201  1  0.254907  0.349273  0.502025  1
  Cu  Cu202  1  0.881925  0.973619  0.606765  1
  Cu  Cu203  1  0.881629  0.674375  0.565033  1
  Cu  Cu204  1  0.881626  0.374482  0.523092  1
  Cu  Cu205  1  0.127991  0.948469  0.533403  1
  Cu  Cu206  1  0.127736  0.547939  0.617033  1
  Cu  Cu207  1  0.128000  0.248241  0.575383  1
  Cu  Cu208  1  0.128022  0.049724  0.512537  1
  Cu  Cu209  1  0.128263  0.649243  0.596300  1
  Cu  Cu210  1  0.128194  0.349356  0.554347  1
  Cu  Cu211  1  0.881332  0.923284  0.564625  1
  Cu  Cu212  1  0.881657  0.623815  0.522891  1
  Cu  Cu213  1  0.880927  0.222909  0.606684  1
  Cu  Cu214  1  0.755455  0.098612  0.606508  1
  Cu  Cu215  1  0.754661  0.798753  0.564843  1
  Cu  Cu216  1  0.755064  0.499126  0.522955  1
  Cu  Cu217  1  0.381397  0.224785  0.502251  1
  Cu  Cu218  1  0.381625  0.824150  0.585923  1
  Cu  Cu219  1  0.381345  0.524335  0.544123  1
  Cu  Cu220  1  0.628330  0.098388  0.554446  1
  Cu  Cu221  1  0.628002  0.798661  0.512511  1
  Cu  Cu222  1  0.628127  0.397867  0.596098  1
  Cu  Cu223  1  0.628142  0.199629  0.533473  1
  Cu  Cu224  1  0.627202  0.798694  0.617440  1
  Cu  Cu225  1  0.628315  0.499184  0.575129  1
  Cu  Cu226  1  0.381388  0.073693  0.585552  1
  Cu  Cu227  1  0.381473  0.773542  0.543811  1
  Cu  Cu228  1  0.383536  0.372673  0.627763  1
  Cu  Cu229  1  0.755262  0.898212  0.648330  1
  Cu  Cu230  1  0.780169  0.495528  0.725673  1
  Cu  Cu231  1  0.749030  0.195079  0.688739  1
  Cu  Cu232  1  0.386389  0.924100  0.669636  1
  Cu  Cu233  1  0.379804  0.624024  0.628165  1
  Cu  Cu234  1  0.365170  0.228072  0.714004  1
  Cu  Cu235  1  0.597804  0.802651  0.724487  1
  Cu  Cu236  1  0.631190  0.496594  0.679329  1
  Cu  Cu237  1  0.625022  0.197318  0.638306  1
  Cu  Cu238  1  0.631083  0.898643  0.702090  1
  Cu  Cu239  1  0.628647  0.598228  0.658637  1
  Cu  Cu240  1  0.631696  0.195642  0.739970  1
  Cu  Cu241  1  0.237064  0.815440  0.747473  1
  Cu  Cu242  1  0.393083  0.474790  0.712502  1
  Cu  Cu243  1  0.379423  0.172950  0.670590  1
  Cu  Cu244  1  0.257516  0.047426  0.669278  1
  Cu  Cu245  1  0.255108  0.748512  0.627467  1
  Cu  Cu246  1  0.248769  0.349975  0.705956  1
  Cu  Cu247  1  0.890226  0.073427  0.690401  1
  Cu  Cu248  1  0.878191  0.773087  0.648839  1
  Cu  Cu249  1  0.901389  0.368429  0.732268  1
  Cu  Cu250  1  0.143255  0.935860  0.740802  1
  Cu  Cu251  1  0.128184  0.645548  0.701534  1
  Cu  Cu252  1  0.126627  0.347278  0.658409  1
  Cu  Cu253  1  0.134542  0.044599  0.722451  1
  Cu  Cu254  1  0.126905  0.748172  0.679151  1
  Cu  Cu255  1  0.130374  0.448798  0.637796  1
  Cu  Cu256  1  0.882365  0.022481  0.648320  1
  Cu  Cu257  1  0.864489  0.616910  0.732481  1
  Cu  Cu258  1  0.871119  0.324888  0.689502  1
  Cu  Cu259  1  0.248769  0.849975  0.705956  1
  Cu  Cu260  1  0.257516  0.547426  0.669278  1
  Cu  Cu261  1  0.255108  0.248512  0.627467  1
  Cu  Cu262  1  0.901389  0.868429  0.732268  1
  Cu  Cu263  1  0.890226  0.573427  0.690401  1
  Cu  Cu264  1  0.878191  0.273087  0.648839  1
  Cu  Cu265  1  0.126627  0.847278  0.658409  1
  Cu  Cu266  1  0.143255  0.435860  0.740802  1
  Cu  Cu267  1  0.128184  0.145548  0.701534  1
  Cu  Cu268  1  0.130374  0.948798  0.637796  1
  Cu  Cu269  1  0.134542  0.544599  0.722451  1
  Cu  Cu270  1  0.126905  0.248172  0.679151  1
  Cu  Cu271  1  0.871119  0.824888  0.689502  1
  Cu  Cu272  1  0.882365  0.522481  0.648320  1
  Cu  Cu273  1  0.864489  0.116910  0.732481  1
  Cu  Cu274  1  0.780169  0.995528  0.725673  1
  Cu  Cu275  1  0.749030  0.695079  0.688739  1
  Cu  Cu276  1  0.755262  0.398212  0.648330  1
  Cu  Cu277  1  0.379804  0.124024  0.628165  1
  Cu  Cu278  1  0.365170  0.728072  0.714004  1
  Cu  Cu279  1  0.386389  0.424100  0.669636  1
  Cu  Cu280  1  0.631190  0.996594  0.679329  1
  Cu  Cu281  1  0.625022  0.697318  0.638306  1
  Cu  Cu282  1  0.597804  0.302651  0.724487  1
  Cu  Cu283  1  0.628647  0.098228  0.658637  1
  Cu  Cu284  1  0.631696  0.695642  0.739970  1
  Cu  Cu285  1  0.631083  0.398643  0.702090  1
  Cu  Cu286  1  0.393083  0.974790  0.712502  1
  Cu  Cu287  1  0.379423  0.672950  0.670590  1
  Cu  Cu288  1  0.237064  0.315440  0.747473  1
