# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.68386872
_cell_length_b   20.47250036
_cell_length_c   52.43657270
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   88.09993181
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   9317.07483348
_cell_formula_units_Z   12
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  0.241444  0.812982  0.322524  1
  Zr  Zr2  1  0.519346  0.084218  0.280917  1
  Zr  Zr3  1  0.948439  0.539390  0.364651  1
  Zr  Zr4  1  0.374914  0.400304  0.247281  1
  Zr  Zr5  1  0.787335  0.859415  0.327320  1
  Zr  Zr6  1  0.078392  0.133243  0.287055  1
  Zr  Zr7  1  0.632142  0.532835  0.287611  1
  Zr  Zr8  1  0.945299  0.815589  0.249780  1
  Zr  Zr9  1  0.342866  0.257031  0.330433  1
  Zr  Zr10  1  0.973340  0.688745  0.276330  1
  Zr  Zr11  1  0.388870  0.140493  0.360022  1
  Zr  Zr12  1  0.683697  0.415514  0.318611  1
  Zr  Zr13  1  0.206987  0.551652  0.300081  1
  Zr  Zr14  1  0.499916  0.820998  0.260863  1
  Zr  Zr15  1  0.910667  0.278310  0.341204  1
  Zr  Zr16  1  0.409701  0.665098  0.267455  1
  Zr  Zr17  1  0.820979  0.121198  0.349861  1
  Zr  Zr18  1  0.116931  0.393209  0.308310  1
  Zr  Zr19  1  0.058184  0.694108  0.357299  1
  Zr  Zr20  1  0.343163  0.969345  0.315123  1
  Zr  Zr21  1  0.633491  0.246592  0.273141  1
  Zr  Zr22  1  0.681565  0.703170  0.334066  1
  Zr  Zr23  1  0.966508  0.977937  0.293130  1
  Zr  Zr24  1  0.254642  0.249317  0.250508  1
  Zr  Zr25  1  0.361438  0.992786  0.447860  1
  Zr  Zr26  1  0.654269  0.266090  0.406120  1
  Zr  Zr27  1  0.069881  0.719625  0.489525  1
  Zr  Zr28  1  0.498031  0.586115  0.368157  1
  Zr  Zr29  1  0.909463  0.039398  0.451605  1
  Zr  Zr30  1  0.203915  0.312946  0.409981  1
  Zr  Zr31  1  0.762100  0.712444  0.415104  1
  Zr  Zr32  1  0.052756  0.986096  0.373543  1
  Zr  Zr33  1  0.469736  0.439168  0.456659  1
  Zr  Zr34  1  0.096197  0.866520  0.400913  1
  Zr  Zr35  1  0.511510  0.319988  0.484438  1
  Zr  Zr36  1  0.804753  0.593420  0.442777  1
  Zr  Zr37  1  0.327230  0.731178  0.424664  1
  Zr  Zr38  1  0.616968  1.004997  0.382836  1
  Zr  Zr39  1  0.035140  0.457936  0.466467  1
  Zr  Zr40  1  0.531693  0.847624  0.391410  1
  Zr  Zr41  1  0.945910  0.301146  0.474723  1
  Zr  Zr42  1  0.239891  0.574423  0.433119  1
  Zr  Zr43  1  0.177536  0.874429  0.481918  1
  Zr  Zr44  1  0.470695  0.147696  0.440483  1
  Zr  Zr45  1  0.765291  0.420751  0.399006  1
  Zr  Zr46  1  0.801321  0.884585  0.459123  1
  Zr  Zr47  1  0.093096  0.158115  0.417591  1
  Zr  Zr48  1  0.387132  0.430685  0.375739  1
  Zr  Zr49  1  0.483311  0.172704  0.572781  1
  Zr  Zr50  1  0.777763  0.446252  0.531157  1
  Zr  Zr51  1  0.189196  0.899534  0.614605  1
  Zr  Zr52  1  0.617345  0.766024  0.493237  1
  Zr  Zr53  1  0.032957  0.219559  0.576642  1
  Zr  Zr54  1  0.325788  0.492864  0.534902  1
  Zr  Zr55  1  0.882473  0.892230  0.539985  1
  Zr  Zr56  1  0.175717  0.165662  0.498324  1
  Zr  Zr57  1  0.591029  0.619130  0.581849  1
  Zr  Zr58  1  0.217490  0.046482  0.526103  1
  Zr  Zr59  1  0.634470  0.499554  0.609219  1
  Zr  Zr60  1  0.925126  0.773206  0.567658  1
  Zr  Zr61  1  0.447335  0.911227  0.549643  1
  Zr  Zr62  1  0.741317  0.184503  0.508039  1
  Zr  Zr63  1  0.155533  0.638025  0.591352  1
  Zr  Zr64  1  0.652087  0.027713  0.516295  1
  Zr  Zr65  1  0.070258  0.480652  0.599926  1
  Zr  Zr66  1  0.359996  0.754471  0.558098  1
  Zr  Zr67  1  0.300094  0.054965  0.607024  1
  Zr  Zr68  1  0.594131  0.327534  0.565171  1
  Zr  Zr69  1  0.885905  0.601064  0.523639  1
  Zr  Zr70  1  0.921935  0.064899  0.583756  1
  Zr  Zr71  1  0.216532  0.337954  0.542279  1
  Zr  Zr72  1  0.509690  0.611220  0.500844  1
  Zr  Zr73  1  0.608834  0.352406  0.695707  1
  Zr  Zr74  1  0.899891  0.626234  0.655442  1
  Zr  Zr75  1  0.312312  0.085346  0.735481  1
  Zr  Zr76  1  0.738787  0.946259  0.618111  1
  Zr  Zr77  1  0.167880  0.401431  0.701845  1
  Zr  Zr78  1  0.445782  0.672667  0.660238  1
  Zr  Zr79  1  0.003530  0.070136  0.664151  1
  Zr  Zr80  1  0.298356  0.345157  0.622740  1
  Zr  Zr81  1  0.713886  0.796905  0.706432  1
  Zr  Zr82  1  0.344360  0.228618  0.652329  1
  Zr  Zr83  1  0.741927  0.670060  0.732982  1
  Zr  Zr84  1  0.055084  0.952814  0.695151  1
  Zr  Zr85  1  0.570295  0.092440  0.674452  1
  Zr  Zr86  1  0.866247  0.364451  0.632901  1
  Zr  Zr87  1  0.277526  0.820551  0.715307  1
  Zr  Zr88  1  0.776559  0.207340  0.641558  1
  Zr  Zr89  1  0.187311  0.664652  0.721899  1
  Zr  Zr90  1  0.480239  0.933998  0.682681  1
  Zr  Zr91  1  0.432584  0.236332  0.732254  1
  Zr  Zr92  1  0.720718  0.507712  0.689632  1
  Zr  Zr93  1  0.005661  0.782479  0.648696  1
  Zr  Zr94  1  0.053735  0.239058  0.709621  1
  Zr  Zr95  1  0.344063  0.516305  0.667639  1
  Zr  Zr96  1  0.629043  0.791541  0.625463  1
  Ni  Ni97  1  0.368212  0.699519  0.344820  1
  Ni  Ni98  1  0.655431  0.971671  0.303317  1
  Ni  Ni99  1  0.949317  0.238629  0.259705  1
  Ni  Ni100  1  0.203892  0.680259  0.307548  1
  Ni  Ni101  1  0.485715  0.951829  0.266922  1
  Ni  Ni102  1  0.912005  0.408310  0.350126  1
  Ni  Ni103  1  0.386454  0.531788  0.256843  1
  Ni  Ni104  1  0.820150  0.991373  0.341389  1
  Ni  Ni105  1  0.111101  0.262076  0.298007  1
  Ni  Ni106  1  0.961732  0.750752  0.317828  1
  Ni  Ni107  1  0.234590  0.017939  0.272608  1
  Ni  Ni108  1  0.667484  0.478492  0.360492  1
  Ni  Ni109  1  0.637004  0.467110  0.247445  1
  Ni  Ni110  1  0.067040  0.920765  0.332504  1
  Ni  Ni111  1  0.362788  0.193771  0.286975  1
  Ni  Ni112  1  0.929086  0.498154  0.316643  1
  Ni  Ni113  1  0.219067  0.770929  0.275090  1
  Ni  Ni114  1  0.633075  0.225862  0.358348  1
  Ni  Ni115  1  0.693702  0.722332  0.250216  1
  Ni  Ni116  1  0.095341  0.174016  0.333274  1
  Ni  Ni117  1  0.390936  0.446352  0.291195  1
  Ni  Ni118  1  0.871766  0.438994  0.276185  1
  Ni  Ni119  1  0.296496  0.895102  0.360325  1
  Ni  Ni120  1  0.586827  0.168911  0.317150  1
  Ni  Ni121  1  0.148809  0.600311  0.253913  1
  Ni  Ni122  1  0.566836  0.053366  0.334449  1
  Ni  Ni123  1  0.862294  0.323838  0.292621  1
  Ni  Ni124  1  0.461168  0.619246  0.314094  1
  Ni  Ni125  1  0.749305  0.891627  0.272506  1
  Ni  Ni126  1  0.166209  0.345795  0.356193  1
  Ni  Ni127  1  0.703742  0.652957  0.290615  1
  Ni  Ni128  1  -0.001135  0.936318  0.250133  1
  Ni  Ni129  1  0.409925  0.378572  0.332415  1
  Ni  Ni130  1  0.916582  0.561181  0.276698  1
  Ni  Ni131  1  0.327517  0.019723  0.359308  1
  Ni  Ni132  1  0.620707  0.293403  0.317195  1
  Ni  Ni133  1  0.790635  0.777124  0.371898  1
  Ni  Ni134  1  0.082128  0.051172  0.330758  1
  Ni  Ni135  1  0.370073  0.323850  0.288311  1
  Ni  Ni136  1  0.949196  0.620898  0.319476  1
  Ni  Ni137  1  0.232981  0.892510  0.276872  1
  Ni  Ni138  1  0.513753  0.168941  0.242632  1
  Ni  Ni139  1  0.028512  0.825379  0.358217  1
  Ni  Ni140  1  0.318167  0.103291  0.316499  1
  Ni  Ni141  1  0.616937  0.376940  0.276222  1
  Ni  Ni142  1  0.709785  0.569570  0.331734  1
  Ni  Ni143  1  -0.001031  0.846136  0.292542  1
  Ni  Ni144  1  0.263977  0.119174  0.248479  1
  Ni  Ni145  1  0.515758  0.806338  0.346011  1
  Ni  Ni146  1  0.801657  0.079211  0.303660  1
  Ni  Ni147  1  0.095177  0.351729  0.262860  1
  Ni  Ni148  1  0.223118  0.591712  0.345341  1
  Ni  Ni149  1  0.512689  0.864965  0.303818  1
  Ni  Ni150  1  0.785938  0.135780  0.263010  1
  Ni  Ni151  1  0.472631  0.743598  0.302147  1
  Ni  Ni152  1  0.747662  1.012317  0.260323  1
  Ni  Ni153  1  0.178976  0.470819  0.344502  1
  Ni  Ni154  1  0.132051  0.474448  0.263991  1
  Ni  Ni155  1  0.554928  0.928419  0.346515  1
  Ni  Ni156  1  0.844411  0.202515  0.304248  1
  Ni  Ni157  1  0.737172  0.778437  0.289663  1
  Ni  Ni158  1  0.001225  0.058620  0.250133  1
  Ni  Ni159  1  0.442339  0.504055  0.331187  1
  Ni  Ni160  1  0.489436  0.879429  0.470512  1
  Ni  Ni161  1  0.782128  0.152935  0.428943  1
  Ni  Ni162  1  0.076028  0.426358  0.387307  1
  Ni  Ni163  1  0.326390  0.861114  0.433094  1
  Ni  Ni164  1  0.618209  0.135076  0.391695  1
  Ni  Ni165  1  0.034762  0.587876  0.474868  1
  Ni  Ni166  1  0.531875  0.717243  0.382757  1
  Ni  Ni167  1  0.945620  0.171173  0.466287  1
  Ni  Ni168  1  0.239847  0.444428  0.424611  1
  Ni  Ni169  1  0.082384  0.931869  0.442085  1
  Ni  Ni170  1  0.374477  0.205357  0.401251  1
  Ni  Ni171  1  0.790695  0.658654  0.483861  1
  Ni  Ni172  1  0.776657  0.646664  0.373846  1
  Ni  Ni173  1  0.189175  0.100358  0.457176  1
  Ni  Ni174  1  0.483247  0.373560  0.415334  1
  Ni  Ni175  1  0.050655  0.679624  0.442350  1
  Ni  Ni176  1  0.341586  0.952949  0.400603  1
  Ni  Ni177  1  0.757859  0.406277  0.483949  1
  Ni  Ni178  1  0.807232  0.899527  0.374013  1
  Ni  Ni179  1  0.223147  0.352875  0.457260  1
  Ni  Ni180  1  0.516062  0.626103  0.415545  1
  Ni  Ni181  1  0.005952  0.621785  0.402017  1
  Ni  Ni182  1  0.418060  0.074954  0.485195  1
  Ni  Ni183  1  0.711872  0.348351  0.443597  1
  Ni  Ni184  1  0.278795  0.779454  0.376633  1
  Ni  Ni185  1  0.692316  0.233090  0.460152  1
  Ni  Ni186  1  0.986444  0.506469  0.418604  1
  Ni  Ni187  1  0.580221  0.799253  0.439334  1
  Ni  Ni188  1  0.871159  0.072806  0.397685  1
  Ni  Ni189  1  0.288436  0.525992  0.481032  1
  Ni  Ni190  1  0.822543  0.833009  0.415484  1
  Ni  Ni191  1  0.114098  0.106726  0.374182  1
  Ni  Ni192  1  0.530319  0.559742  0.457040  1
  Ni  Ni193  1  0.036907  0.745971  0.400837  1
  Ni  Ni194  1  0.450471  0.199274  0.484125  1
  Ni  Ni195  1  0.744333  0.472705  0.442534  1
  Ni  Ni196  1  0.910587  0.957506  0.496685  1
  Ni  Ni197  1  0.204198  0.230994  0.455011  1
  Ni  Ni198  1  0.498000  0.504183  0.413206  1
  Ni  Ni199  1  0.068781  0.801431  0.444372  1
  Ni  Ni200  1  0.360598  0.074733  0.403069  1
  Ni  Ni201  1  0.655070  0.347477  0.361609  1
  Ni  Ni202  1  0.148909  1.005596  0.483156  1
  Ni  Ni203  1  0.442895  0.279298  0.441667  1
  Ni  Ni204  1  0.736780  0.552681  0.400217  1
  Ni  Ni205  1  0.830486  0.753496  0.457949  1
  Ni  Ni206  1  0.121630  0.026917  0.416287  1
  Ni  Ni207  1  0.414463  0.298269  0.373979  1
  Ni  Ni208  1  0.636156  0.987315  0.470781  1
  Ni  Ni209  1  0.929313  0.260888  0.429153  1
  Ni  Ni210  1  0.224122  0.534060  0.387566  1
  Ni  Ni211  1  0.342717  0.771637  0.470215  1
  Ni  Ni212  1  0.634723  0.044967  0.428578  1
  Ni  Ni213  1  0.928996  0.318275  0.387013  1
  Ni  Ni214  1  0.592098  0.924176  0.427777  1
  Ni  Ni215  1  0.884301  0.197726  0.386007  1
  Ni  Ni216  1  0.300809  0.650851  0.469543  1
  Ni  Ni217  1  0.267275  0.654717  0.388169  1
  Ni  Ni218  1  0.679302  0.108168  0.471653  1
  Ni  Ni219  1  0.973711  0.381541  0.430082  1
  Ni  Ni220  1  0.852440  0.957366  0.414226  1
  Ni  Ni221  1  0.146637  0.231133  0.372955  1
  Ni  Ni222  1  0.561318  0.683899  0.455910  1
  Ni  Ni223  1  0.611198  0.059291  0.595455  1
  Ni  Ni224  1  0.905098  0.332715  0.553819  1
  Ni  Ni225  1  0.197790  0.606221  0.512250  1
  Ni  Ni226  1  0.447379  0.041221  0.558151  1
  Ni  Ni227  1  0.741606  0.314476  0.516475  1
  Ni  Ni228  1  0.155351  0.768406  0.600006  1
  Ni  Ni229  1  0.652464  0.897773  0.507894  1
  Ni  Ni230  1  0.069018  0.350574  0.591067  1
  Ni  Ni231  1  0.360836  0.624536  0.549668  1
  Ni  Ni232  1  0.203979  0.112090  0.567428  1
  Ni  Ni233  1  0.498051  0.385292  0.525586  1
  Ni  Ni234  1  0.910569  0.838986  0.608916  1
  Ni  Ni235  1  0.896531  0.826995  0.498901  1
  Ni  Ni236  1  0.312749  0.280292  0.581511  1
  Ni  Ni237  1  0.604842  0.553781  0.540677  1
  Ni  Ni238  1  0.171164  0.859547  0.567217  1
  Ni  Ni239  1  0.464079  0.132774  0.525502  1
  Ni  Ni240  1  0.879994  0.586122  0.608749  1
  Ni  Ni241  1  0.929367  0.079373  0.498813  1
  Ni  Ni242  1  0.345640  0.532700  0.582159  1
  Ni  Ni243  1  0.636571  0.806025  0.540413  1
  Ni  Ni244  1  0.125909  0.801751  0.526852  1
  Ni  Ni245  1  0.540589  0.254517  0.609807  1
  Ni  Ni246  1  0.834786  0.528283  0.568536  1
  Ni  Ni247  1  0.398790  0.959658  0.501730  1
  Ni  Ni248  1  0.816067  0.412844  0.585077  1
  Ni  Ni249  1  0.107005  0.686396  0.543428  1
  Ni  Ni250  1  0.700782  0.979181  0.564158  1
  Ni  Ni251  1  0.994910  0.252559  0.522610  1
  Ni  Ni252  1  0.408431  0.706195  0.606129  1
  Ni  Ni253  1  0.942893  1.012944  0.540228  1
  Ni  Ni254  1  0.236755  0.286375  0.498637  1
  Ni  Ni255  1  0.650319  0.739678  0.581926  1
  Ni  Ni256  1  0.156907  0.925907  0.525722  1
  Ni  Ni257  1  0.573128  0.378923  0.608580  1
  Ni  Ni258  1  0.864683  0.652640  0.567278  1
  Ni  Ni259  1  0.032157  0.138172  0.621153  1
  Ni  Ni260  1  0.326628  0.410916  0.579693  1
  Ni  Ni261  1  0.618445  0.684218  0.538390  1
  Ni  Ni262  1  0.189227  0.981467  0.569556  1
  Ni  Ni263  1  0.483028  0.254656  0.527751  1
  Ni  Ni264  1  0.776639  0.528143  0.486077  1
  Ni  Ni265  1  0.272763  0.187381  0.608783  1
  Ni  Ni266  1  0.565596  0.458733  0.566475  1
  Ni  Ni267  1  0.856740  0.732154  0.524813  1
  Ni  Ni268  1  0.950446  0.932968  0.582546  1
  Ni  Ni269  1  0.244331  0.206352  0.541095  1
  Ni  Ni270  1  0.538317  0.480054  0.499606  1
  Ni  Ni271  1  0.758230  0.167374  0.595749  1
  Ni  Ni272  1  0.052503  0.440682  0.554184  1
  Ni  Ni273  1  0.344509  0.714013  0.512547  1
  Ni  Ni274  1  0.463104  0.951590  0.595196  1
  Ni  Ni275  1  0.757913  0.224761  0.553609  1
  Ni  Ni276  1  0.051070  0.498335  0.511982  1
  Ni  Ni277  1  0.713515  0.104109  0.552680  1
  Ni  Ni278  1  0.007924  0.377481  0.511109  1
  Ni  Ni279  1  0.419951  0.830933  0.594593  1
  Ni  Ni280  1  0.386417  0.834798  0.513219  1
  Ni  Ni281  1  0.802925  0.287924  0.596755  1
  Ni  Ni282  1  0.095128  0.561473  0.554985  1
  Ni  Ni283  1  0.975354  0.137299  0.539165  1
  Ni  Ni284  1  0.269166  0.410696  0.497567  1
  Ni  Ni285  1  0.681274  0.863864  0.580745  1
  Ni  Ni286  1  0.737909  0.247021  0.723057  1
  Ni  Ni287  1  0.031795  0.513978  0.679445  1
  Ni  Ni288  1  0.319014  0.786130  0.637942  1
  Ni  Ni289  1  0.576125  0.223573  0.684755  1
  Ni  Ni290  1  0.867076  0.494276  0.641373  1
  Ni  Ni291  1  0.300773  0.953862  0.725920  1
  Ni  Ni292  1  0.775221  0.077340  0.632636  1
  Ni  Ni293  1  0.201511  0.533820  0.715840  1
  Ni  Ni294  1  0.483334  0.805391  0.675214  1
  Ni  Ni295  1  0.324438  0.291878  0.695787  1
  Ni  Ni296  1  0.620186  0.564885  0.650258  1
  Ni  Ni297  1  0.050222  0.018540  0.735317  1
  Ni  Ni298  1  0.019743  1.007157  0.622271  1
  Ni  Ni299  1  0.452636  0.467711  0.710154  1
  Ni  Ni300  1  0.725494  0.734897  0.664934  1
  Ni  Ni301  1  0.296290  0.039298  0.691567  1
  Ni  Ni302  1  0.591885  0.311633  0.649488  1
  Ni  Ni303  1  0.993524  0.763317  0.732546  1
  Ni  Ni304  1  0.054151  0.259787  0.624414  1
  Ni  Ni305  1  0.468159  0.714721  0.707672  1
  Ni  Ni306  1  0.758140  0.987495  0.666119  1
  Ni  Ni307  1  0.244887  0.981595  0.651575  1
  Ni  Ni308  1  0.686001  0.427029  0.732629  1
  Ni  Ni309  1  0.950054  0.707213  0.693099  1
  Ni  Ni310  1  0.521017  0.139855  0.626569  1
  Ni  Ni311  1  0.937921  0.594022  0.710256  1
  Ni  Ni312  1  0.226059  0.866404  0.668668  1
  Ni  Ni313  1  0.824932  0.161811  0.690141  1
  Ni  Ni314  1  0.120390  0.432283  0.648314  1
  Ni  Ni315  1  0.538417  0.885339  0.728849  1
  Ni  Ni316  1  0.066519  0.192246  0.665567  1
  Ni  Ni317  1  0.359709  0.465926  0.623454  1
  Ni  Ni318  1  0.770644  0.924468  0.706064  1
  Ni  Ni319  1  0.277301  0.107078  0.650347  1
  Ni  Ni320  1  0.688361  0.549331  0.732629  1
  Ni  Ni321  1  0.983484  0.832693  0.692147  1
  Ni  Ni322  1  0.173473  0.316709  0.740130  1
  Ni  Ni323  1  0.454245  0.593139  0.705890  1
  Ni  Ni324  1  0.738031  0.864752  0.663286  1
  Ni  Ni325  1  0.317153  0.161799  0.694451  1
  Ni  Ni326  1  0.605098  0.434477  0.652004  1
  Ni  Ni327  1  0.896592  0.708526  0.610864  1
  Ni  Ni328  1  0.423249  0.366475  0.734283  1
  Ni  Ni329  1  0.688257  0.639514  0.690220  1
  Ni  Ni330  1  0.977441  0.916080  0.651028  1
  Ni  Ni331  1  0.070289  0.108710  0.706540  1
  Ni  Ni332  1  0.369059  0.382359  0.666263  1
  Ni  Ni333  1  0.658714  0.660271  0.624545  1
  Ni  Ni334  1  0.901288  0.349870  0.719752  1
  Ni  Ni335  1  0.174537  0.620685  0.678944  1
  Ni  Ni336  1  0.464108  0.893938  0.637422  1
  Ni  Ni337  1  0.592050  0.133920  0.719902  1
  Ni  Ni338  1  0.885570  0.406438  0.679102  1
  Ni  Ni339  1  0.171468  0.679311  0.636751  1
  Ni  Ni340  1  0.842815  0.283135  0.678514  1
  Ni  Ni341  1  0.132298  0.557231  0.636247  1
  Ni  Ni342  1  0.555175  1.011201  0.718771  1
  Ni  Ni343  1  0.508251  0.014830  0.638260  1
  Ni  Ni344  1  0.939564  0.473332  0.722439  1
  Ni  Ni345  1  0.214595  0.742051  0.680615  1
  Ni  Ni346  1  0.100399  0.316739  0.665612  1
  Ni  Ni347  1  0.390730  0.590547  0.622437  1
  Ni  Ni348  1  0.815460  0.046656  0.706577  1
