# generated using pymatgen
data_ZrCu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.90964834
_cell_length_b   24.95757188
_cell_length_c   51.90261001
_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   8950.50363051
_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  0.254843  0.825517  0.308860  1
  Zr  Zr2  1  0.245855  0.441305  0.343234  1
  Zr  Zr3  1  0.253134  0.056672  0.381054  1
  Zr  Zr4  1  0.753134  0.556672  0.381054  1
  Zr  Zr5  1  0.754843  0.325517  0.308860  1
  Zr  Zr6  1  0.745855  0.941305  0.343234  1
  Zr  Zr7  1  0.747612  0.749069  0.362330  1
  Zr  Zr8  1  0.762399  0.520975  0.291954  1
  Zr  Zr9  1  0.748847  0.133018  0.325538  1
  Zr  Zr10  1  0.248847  0.633018  0.325538  1
  Zr  Zr11  1  0.247612  0.249069  0.362330  1
  Zr  Zr12  1  0.262399  0.020975  0.291954  1
  Zr  Zr13  1  0.251664  0.671893  0.418282  1
  Zr  Zr14  1  0.251153  0.287279  0.455435  1
  Zr  Zr15  1  0.251327  0.902704  0.492538  1
  Zr  Zr16  1  0.751327  0.402704  0.492538  1
  Zr  Zr17  1  0.751664  0.171893  0.418282  1
  Zr  Zr18  1  0.751153  0.787279  0.455435  1
  Zr  Zr19  1  0.751341  0.594934  0.473944  1
  Zr  Zr20  1  0.752854  0.364372  0.399846  1
  Zr  Zr21  1  0.751107  0.979680  0.436803  1
  Zr  Zr22  1  0.251107  0.479680  0.436803  1
  Zr  Zr23  1  0.251341  0.094934  0.473944  1
  Zr  Zr24  1  0.252854  0.864372  0.399846  1
  Zr  Zr25  1  0.251252  0.518066  0.529753  1
  Zr  Zr26  1  0.251238  0.133275  0.566813  1
  Zr  Zr27  1  0.253047  0.748539  0.603722  1
  Zr  Zr28  1  0.753047  0.248539  0.603722  1
  Zr  Zr29  1  0.751252  0.018066  0.529753  1
  Zr  Zr30  1  0.751238  0.633275  0.566813  1
  Zr  Zr31  1  0.751677  0.441119  0.585295  1
  Zr  Zr32  1  0.751356  0.210300  0.511111  1
  Zr  Zr33  1  0.751142  0.825733  0.548169  1
  Zr  Zr34  1  0.251142  0.325733  0.548169  1
  Zr  Zr35  1  0.251677  0.941119  0.585295  1
  Zr  Zr36  1  0.251356  0.710300  0.511111  1
  Zr  Zr37  1  0.246992  0.364299  0.641370  1
  Zr  Zr38  1  0.249274  0.979942  0.678272  1
  Zr  Zr39  1  0.273661  0.593761  0.710288  1
  Zr  Zr40  1  0.773661  0.093761  0.710288  1
  Zr  Zr41  1  0.746992  0.864299  0.641370  1
  Zr  Zr42  1  0.749274  0.479942  0.678272  1
  Zr  Zr43  1  0.756145  0.287003  0.694478  1
  Zr  Zr44  1  0.752208  0.056204  0.622854  1
  Zr  Zr45  1  0.747920  0.671564  0.660459  1
  Zr  Zr46  1  0.247920  0.171564  0.660459  1
  Zr  Zr47  1  0.256145  0.787003  0.694478  1
  Zr  Zr48  1  0.252208  0.556204  0.622854  1
  Cu  Cu49  1  0.502372  0.845052  0.353449  1
  Cu  Cu50  1  0.500358  0.612441  0.286702  1
  Cu  Cu51  1  0.500397  0.231485  0.319510  1
  Cu  Cu52  1  0.126458  0.796718  0.358272  1
  Cu  Cu53  1  0.131239  0.568663  0.284715  1
  Cu  Cu54  1  0.124992  0.182466  0.319960  1
  Cu  Cu55  1  0.376003  0.758428  0.385514  1
  Cu  Cu56  1  0.378293  0.526563  0.310123  1
  Cu  Cu57  1  0.375804  0.143769  0.347862  1
  Cu  Cu58  1  0.375174  0.546860  0.357650  1
  Cu  Cu59  1  0.417118  0.317675  0.284984  1
  Cu  Cu60  1  0.373343  0.930285  0.318842  1
  Cu  Cu61  1  0.127915  0.508712  0.385813  1
  Cu  Cu62  1  0.126993  0.277938  0.310543  1
  Cu  Cu63  1  0.127777  0.893480  0.348856  1
  Cu  Cu64  1  1.000397  0.731485  0.319510  1
  Cu  Cu65  1  0.002372  0.345052  0.353449  1
  Cu  Cu66  1  1.000358  0.112441  0.286702  1
  Cu  Cu67  1  0.624992  0.682466  0.319960  1
  Cu  Cu68  1  0.626458  0.296718  0.358272  1
  Cu  Cu69  1  0.631239  0.068663  0.284715  1
  Cu  Cu70  1  0.875804  0.643769  0.347862  1
  Cu  Cu71  1  0.876003  0.258428  0.385514  1
  Cu  Cu72  1  0.878293  0.026563  0.310123  1
  Cu  Cu73  1  0.917118  0.817675  0.284984  1
  Cu  Cu74  1  0.873343  0.430285  0.318842  1
  Cu  Cu75  1  0.875174  0.046860  0.357650  1
  Cu  Cu76  1  0.626993  0.777938  0.310543  1
  Cu  Cu77  1  0.627777  0.393480  0.348856  1
  Cu  Cu78  1  0.627915  0.008712  0.385813  1
  Cu  Cu79  1  0.995461  0.921531  0.302898  1
  Cu  Cu80  1  0.004726  0.537896  0.335010  1
  Cu  Cu81  1  1.000257  0.152768  0.372003  1
  Cu  Cu82  1  0.631565  0.874117  0.301897  1
  Cu  Cu83  1  0.627433  0.488819  0.339500  1
  Cu  Cu84  1  0.626906  0.104611  0.376543  1
  Cu  Cu85  1  0.872812  0.834946  0.329794  1
  Cu  Cu86  1  0.876932  0.450544  0.366592  1
  Cu  Cu87  1  0.843737  0.217026  0.292888  1
  Cu  Cu88  1  0.880113  0.625169  0.300806  1
  Cu  Cu89  1  0.874817  0.239133  0.338757  1
  Cu  Cu90  1  0.874707  0.854959  0.376529  1
  Cu  Cu91  1  0.630130  0.586574  0.330713  1
  Cu  Cu92  1  0.627297  0.201211  0.367271  1
  Cu  Cu93  1  0.627785  0.971189  0.293335  1
  Cu  Cu94  1  0.500257  0.652768  0.372003  1
  Cu  Cu95  1  0.495461  0.421531  0.302898  1
  Cu  Cu96  1  0.504726  0.037896  0.335010  1
  Cu  Cu97  1  0.126906  0.604611  0.376543  1
  Cu  Cu98  1  0.131565  0.374117  0.301897  1
  Cu  Cu99  1  0.127433  0.988819  0.339500  1
  Cu  Cu100  1  0.343737  0.717026  0.292888  1
  Cu  Cu101  1  0.372812  0.334946  0.329794  1
  Cu  Cu102  1  0.376932  0.950544  0.366592  1
  Cu  Cu103  1  0.374817  0.739133  0.338757  1
  Cu  Cu104  1  0.374707  0.354959  0.376529  1
  Cu  Cu105  1  0.380113  0.125169  0.300806  1
  Cu  Cu106  1  0.127297  0.701211  0.367271  1
  Cu  Cu107  1  0.127785  0.471189  0.293335  1
  Cu  Cu108  1  0.130130  0.086574  0.330713  1
  Cu  Cu109  1  0.501340  0.691088  0.464683  1
  Cu  Cu110  1  0.500074  0.460378  0.390489  1
  Cu  Cu111  1  0.501408  0.075806  0.427493  1
  Cu  Cu112  1  0.127284  0.642803  0.469319  1
  Cu  Cu113  1  0.127535  0.412284  0.395081  1
  Cu  Cu114  1  0.127134  0.027443  0.432046  1
  Cu  Cu115  1  0.375500  0.604459  0.497072  1
  Cu  Cu116  1  0.375602  0.373834  0.422783  1
  Cu  Cu117  1  0.375371  0.989169  0.459893  1
  Cu  Cu118  1  0.375553  0.393187  0.469426  1
  Cu  Cu119  1  0.374726  0.162634  0.394963  1
  Cu  Cu120  1  0.375288  0.777677  0.432304  1
  Cu  Cu121  1  0.127223  0.354847  0.497156  1
  Cu  Cu122  1  0.127434  0.124022  0.422786  1
  Cu  Cu123  1  0.126974  0.739446  0.460015  1
  Cu  Cu124  1  1.001408  0.575806  0.427493  1
  Cu  Cu125  1  1.001340  0.191088  0.464683  1
  Cu  Cu126  1  1.000074  0.960378  0.390489  1
  Cu  Cu127  1  0.627134  0.527443  0.432046  1
  Cu  Cu128  1  0.627284  0.142803  0.469319  1
  Cu  Cu129  1  0.627535  0.912284  0.395081  1
  Cu  Cu130  1  0.875371  0.489169  0.459893  1
  Cu  Cu131  1  0.875500  0.104459  0.497072  1
  Cu  Cu132  1  0.875602  0.873834  0.422783  1
  Cu  Cu133  1  0.874726  0.662634  0.394963  1
  Cu  Cu134  1  0.875288  0.277677  0.432304  1
  Cu  Cu135  1  0.875553  0.893187  0.469426  1
  Cu  Cu136  1  0.627434  0.624022  0.422786  1
  Cu  Cu137  1  0.626974  0.239446  0.460015  1
  Cu  Cu138  1  0.627223  0.854847  0.497156  1
  Cu  Cu139  1  1.000444  0.768142  0.409063  1
  Cu  Cu140  1  1.001526  0.383518  0.446123  1
  Cu  Cu141  1  1.001224  0.998846  0.483252  1
  Cu  Cu142  1  0.627061  0.719792  0.413640  1
  Cu  Cu143  1  0.627051  0.335159  0.450736  1
  Cu  Cu144  1  0.627222  0.950567  0.487921  1
  Cu  Cu145  1  0.875522  0.681418  0.441303  1
  Cu  Cu146  1  0.875355  0.296836  0.478490  1
  Cu  Cu147  1  0.875686  0.066139  0.404062  1
  Cu  Cu148  1  0.875279  0.470114  0.413632  1
  Cu  Cu149  1  0.875663  0.085402  0.450823  1
  Cu  Cu150  1  0.875472  0.700756  0.487991  1
  Cu  Cu151  1  0.627052  0.431839  0.441400  1
  Cu  Cu152  1  0.627255  0.047148  0.478605  1
  Cu  Cu153  1  0.627532  0.816434  0.404474  1
  Cu  Cu154  1  0.501224  0.498846  0.483252  1
  Cu  Cu155  1  0.500444  0.268142  0.409063  1
  Cu  Cu156  1  0.501526  0.883518  0.446123  1
  Cu  Cu157  1  0.127222  0.450567  0.487921  1
  Cu  Cu158  1  0.127061  0.219792  0.413640  1
  Cu  Cu159  1  0.127051  0.835159  0.450736  1
  Cu  Cu160  1  0.375686  0.566139  0.404062  1
  Cu  Cu161  1  0.375522  0.181418  0.441303  1
  Cu  Cu162  1  0.375355  0.796836  0.478490  1
  Cu  Cu163  1  0.375663  0.585402  0.450823  1
  Cu  Cu164  1  0.375472  0.200756  0.487991  1
  Cu  Cu165  1  0.375279  0.970114  0.413632  1
  Cu  Cu166  1  0.127255  0.547148  0.478605  1
  Cu  Cu167  1  0.127532  0.316434  0.404474  1
  Cu  Cu168  1  0.127052  0.931839  0.441400  1
  Cu  Cu169  1  0.501179  0.537211  0.576264  1
  Cu  Cu170  1  0.501269  0.306498  0.501807  1
  Cu  Cu171  1  0.501358  0.921921  0.538960  1
  Cu  Cu172  1  0.127338  0.489032  0.580943  1
  Cu  Cu173  1  0.127238  0.258144  0.506458  1
  Cu  Cu174  1  0.126868  0.873555  0.543619  1
  Cu  Cu175  1  0.374824  0.450458  0.608680  1
  Cu  Cu176  1  0.375619  0.219795  0.534207  1
  Cu  Cu177  1  0.375338  0.835324  0.571296  1
  Cu  Cu178  1  0.375615  0.239143  0.580821  1
  Cu  Cu179  1  0.375556  0.008530  0.506612  1
  Cu  Cu180  1  0.375329  0.623816  0.543776  1
  Cu  Cu181  1  0.128033  0.200639  0.608515  1
  Cu  Cu182  1  0.127178  0.970219  0.534340  1
  Cu  Cu183  1  0.127133  0.585520  0.571706  1
  Cu  Cu184  1  1.001358  0.421921  0.538960  1
  Cu  Cu185  1  1.001179  0.037211  0.576264  1
  Cu  Cu186  1  1.001269  0.806498  0.501807  1
  Cu  Cu187  1  0.626868  0.373555  0.543619  1
  Cu  Cu188  1  0.627338  0.989032  0.580943  1
  Cu  Cu189  1  0.627238  0.758144  0.506458  1
  Cu  Cu190  1  0.875338  0.335324  0.571296  1
  Cu  Cu191  1  0.874824  0.950458  0.608680  1
  Cu  Cu192  1  0.875619  0.719795  0.534207  1
  Cu  Cu193  1  0.875556  0.508530  0.506612  1
  Cu  Cu194  1  0.875329  0.123816  0.543776  1
  Cu  Cu195  1  0.875615  0.739143  0.580821  1
  Cu  Cu196  1  0.627178  0.470219  0.534340  1
  Cu  Cu197  1  0.627133  0.085520  0.571706  1
  Cu  Cu198  1  0.628033  0.700639  0.608515  1
  Cu  Cu199  1  1.001323  0.614141  0.520407  1
  Cu  Cu200  1  1.001651  0.229448  0.557520  1
  Cu  Cu201  1  1.000350  0.844905  0.594563  1
  Cu  Cu202  1  0.627186  0.565832  0.525076  1
  Cu  Cu203  1  0.627181  0.181115  0.562247  1
  Cu  Cu204  1  0.627653  0.796603  0.599119  1
  Cu  Cu205  1  0.875582  0.527619  0.552878  1
  Cu  Cu206  1  0.875544  0.142712  0.590035  1
  Cu  Cu207  1  0.875436  0.912263  0.515650  1
  Cu  Cu208  1  0.875335  0.316159  0.525129  1
  Cu  Cu209  1  0.875435  0.931600  0.562350  1
  Cu  Cu210  1  0.875432  0.546869  0.599699  1
  Cu  Cu211  1  0.627042  0.277840  0.552892  1
  Cu  Cu212  1  0.627127  0.893248  0.589986  1
  Cu  Cu213  1  0.627197  0.662427  0.515727  1
  Cu  Cu214  1  0.500350  0.344905  0.594563  1
  Cu  Cu215  1  0.501323  0.114141  0.520407  1
  Cu  Cu216  1  0.501651  0.729448  0.557520  1
  Cu  Cu217  1  0.127653  0.296603  0.599119  1
  Cu  Cu218  1  0.127186  0.065832  0.525076  1
  Cu  Cu219  1  0.127181  0.681115  0.562247  1
  Cu  Cu220  1  0.375436  0.412263  0.515650  1
  Cu  Cu221  1  0.375582  0.027619  0.552878  1
  Cu  Cu222  1  0.375544  0.642712  0.590035  1
  Cu  Cu223  1  0.375435  0.431600  0.562350  1
  Cu  Cu224  1  0.375432  0.046869  0.599699  1
  Cu  Cu225  1  0.375335  0.816159  0.525129  1
  Cu  Cu226  1  0.127127  0.393248  0.589986  1
  Cu  Cu227  1  0.127197  0.162427  0.515727  1
  Cu  Cu228  1  0.127042  0.777840  0.552892  1
  Cu  Cu229  1  0.498612  0.381570  0.683945  1
  Cu  Cu230  1  0.499849  0.152591  0.613082  1
  Cu  Cu231  1  0.503457  0.768187  0.649938  1
  Cu  Cu232  1  0.128080  0.335272  0.693012  1
  Cu  Cu233  1  0.128147  0.104201  0.617948  1
  Cu  Cu234  1  0.128023  0.719482  0.654560  1
  Cu  Cu235  1  0.421483  0.296617  0.718474  1
  Cu  Cu236  1  0.375368  0.065770  0.646320  1
  Cu  Cu237  1  0.376400  0.683442  0.684354  1
  Cu  Cu238  1  0.380242  0.086504  0.693663  1
  Cu  Cu239  1  0.375914  0.854587  0.618016  1
  Cu  Cu240  1  0.374654  0.469274  0.655764  1
  Cu  Cu241  1  0.122023  0.046783  0.718805  1
  Cu  Cu242  1  0.126437  0.816387  0.645175  1
  Cu  Cu243  1  0.123273  0.430397  0.683733  1
  Cu  Cu244  1  0.003457  0.268187  0.649938  1
  Cu  Cu245  1  0.998612  0.881570  0.683945  1
  Cu  Cu246  1  0.999849  0.652591  0.613082  1
  Cu  Cu247  1  0.628023  0.219482  0.654560  1
  Cu  Cu248  1  0.628080  0.835272  0.693012  1
  Cu  Cu249  1  0.628147  0.604201  0.617948  1
  Cu  Cu250  1  0.876400  0.183442  0.684354  1
  Cu  Cu251  1  0.921483  0.796617  0.718474  1
  Cu  Cu252  1  0.875368  0.565770  0.646320  1
  Cu  Cu253  1  0.875914  0.354587  0.618016  1
  Cu  Cu254  1  0.874654  0.969274  0.655764  1
  Cu  Cu255  1  0.880242  0.586504  0.693663  1
  Cu  Cu256  1  0.626437  0.316387  0.645175  1
  Cu  Cu257  1  0.623273  0.930397  0.683733  1
  Cu  Cu258  1  0.622023  0.546783  0.718805  1
  Cu  Cu259  1  0.999858  0.460286  0.631754  1
  Cu  Cu260  1  0.007789  0.074780  0.668230  1
  Cu  Cu261  1  0.998667  0.691725  0.700646  1
  Cu  Cu262  1  0.627396  0.411967  0.636401  1
  Cu  Cu263  1  0.629441  0.026109  0.673539  1
  Cu  Cu264  1  0.632728  0.643233  0.710392  1
  Cu  Cu265  1  0.875242  0.373964  0.664653  1
  Cu  Cu266  1  0.890540  0.987288  0.701845  1
  Cu  Cu267  1  0.874580  0.758131  0.627045  1
  Cu  Cu268  1  0.877695  0.162435  0.636961  1
  Cu  Cu269  1  0.873857  0.778266  0.673731  1
  Cu  Cu270  1  0.833161  0.391631  0.710115  1
  Cu  Cu271  1  0.627492  0.124126  0.663963  1
  Cu  Cu272  1  0.634547  0.739438  0.701753  1
  Cu  Cu273  1  0.626917  0.508404  0.627290  1
  Cu  Cu274  1  0.498667  0.191725  0.700646  1
  Cu  Cu275  1  0.499858  0.960286  0.631754  1
  Cu  Cu276  1  0.507789  0.574780  0.668230  1
  Cu  Cu277  1  0.132728  0.143233  0.710392  1
  Cu  Cu278  1  0.127396  0.911967  0.636401  1
  Cu  Cu279  1  0.129441  0.526109  0.673539  1
  Cu  Cu280  1  0.374580  0.258131  0.627045  1
  Cu  Cu281  1  0.375242  0.873964  0.664653  1
  Cu  Cu282  1  0.390540  0.487288  0.701845  1
  Cu  Cu283  1  0.373857  0.278266  0.673731  1
  Cu  Cu284  1  0.333161  0.891631  0.710115  1
  Cu  Cu285  1  0.377695  0.662435  0.636961  1
  Cu  Cu286  1  0.134547  0.239438  0.701753  1
  Cu  Cu287  1  0.126917  0.008404  0.627290  1
  Cu  Cu288  1  0.127492  0.624126  0.663963  1
