# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   25.09006437
_cell_length_b   8.49991493
_cell_length_c   48.89526500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   87.43958062
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   10417.1609098
_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  0.993802  1.001754  0.276603  1
  Zr  Zr2  1  0.291813  0.920292  0.311395  1
  Zr  Zr3  1  0.590147  0.830938  0.348883  1
  Zr  Zr4  1  0.681893  0.476745  0.282608  1
  Zr  Zr5  1  0.974821  0.398611  0.317608  1
  Zr  Zr6  1  0.273350  0.313792  0.355337  1
  Zr  Zr7  1  0.730282  0.115110  0.371154  1
  Zr  Zr8  1  0.135285  0.295359  0.294180  1
  Zr  Zr9  1  0.431886  0.200618  0.333524  1
  Zr  Zr10  1  0.834378  0.138036  0.295755  1
  Zr  Zr11  1  0.131952  0.028418  0.333158  1
  Zr  Zr12  1  0.525708  0.234644  0.261770  1
  Zr  Zr13  1  0.821080  0.707165  0.313024  1
  Zr  Zr14  1  0.118243  0.618802  0.348405  1
  Zr  Zr15  1  0.531544  0.794741  0.277915  1
  Zr  Zr16  1  0.744556  0.521479  0.356849  1
  Zr  Zr17  1  0.149794  0.705603  0.283824  1
  Zr  Zr18  1  0.446659  0.607926  0.318541  1
  Zr  Zr19  1  0.670694  0.985665  0.300163  1
  Zr  Zr20  1  0.967486  0.898248  0.340157  1
  Zr  Zr21  1  0.377681  0.064003  0.266984  1
  Zr  Zr22  1  0.893455  0.244587  0.365758  1
  Zr  Zr23  1  0.303620  0.419145  0.289648  1
  Zr  Zr24  1  0.597544  0.332259  0.327148  1
  Zr  Zr25  1  0.885917  0.747658  0.386734  1
  Zr  Zr26  1  0.183402  0.659730  0.423235  1
  Zr  Zr27  1  0.480265  0.572006  0.461270  1
  Zr  Zr28  1  0.570598  0.224671  0.393193  1
  Zr  Zr29  1  0.866714  0.139959  0.431063  1
  Zr  Zr30  1  0.163583  0.054523  0.467320  1
  Zr  Zr31  1  0.619922  0.858583  0.482751  1
  Zr  Zr32  1  0.027086  0.033114  0.407702  1
  Zr  Zr33  1  0.322932  0.946301  0.445048  1
  Zr  Zr34  1  0.726427  0.851752  0.409279  1
  Zr  Zr35  1  0.023544  0.767364  0.446097  1
  Zr  Zr36  1  0.429835  0.937682  0.372492  1
  Zr  Zr37  1  0.712821  0.444990  0.423690  1
  Zr  Zr38  1  1.009983  0.359238  0.460507  1
  Zr  Zr39  1  0.415807  0.532161  0.386050  1
  Zr  Zr40  1  0.634131  0.265173  0.468553  1
  Zr  Zr41  1  0.039998  0.440256  0.393234  1
  Zr  Zr42  1  0.337081  0.353464  0.430850  1
  Zr  Zr43  1  0.563522  0.725973  0.414851  1
  Zr  Zr44  1  0.859737  0.640602  0.452657  1
  Zr  Zr45  1  0.266158  0.814717  0.376940  1
  Zr  Zr46  1  0.783856  0.984278  0.477399  1
  Zr  Zr47  1  0.190411  0.159690  0.401541  1
  Zr  Zr48  1  0.487047  0.071672  0.439538  1
  Zr  Zr49  1  0.776979  0.485333  0.499041  1
  Zr  Zr50  1  0.073873  0.400112  0.535315  1
  Zr  Zr51  1  0.369948  0.314570  0.573267  1
  Zr  Zr52  1  0.460239  0.967301  0.505155  1
  Zr  Zr53  1  0.757147  0.879986  0.543146  1
  Zr  Zr54  1  0.054574  0.792482  0.579579  1
  Zr  Zr55  1  0.510653  0.601565  0.593905  1
  Zr  Zr56  1  0.917014  0.772675  0.520272  1
  Zr  Zr57  1  0.214055  0.687478  0.556981  1
  Zr  Zr58  1  0.617549  0.593061  0.521342  1
  Zr  Zr59  1  0.913496  0.506982  0.558673  1
  Zr  Zr60  1  0.320650  0.680876  0.483704  1
  Zr  Zr61  1  0.603485  0.185813  0.535535  1
  Zr  Zr62  1  0.900533  0.099828  0.573133  1
  Zr  Zr63  1  0.306422  0.274363  0.497865  1
  Zr  Zr64  1  0.524774  1.007101  0.580365  1
  Zr  Zr65  1  0.930585  0.180820  0.505868  1
  Zr  Zr66  1  0.227780  0.094454  0.542753  1
  Zr  Zr67  1  0.453443  0.467587  0.526896  1
  Zr  Zr68  1  0.750162  0.380137  0.564831  1
  Zr  Zr69  1  0.156732  0.555497  0.488973  1
  Zr  Zr70  1  0.674476  0.724529  0.589428  1
  Zr  Zr71  1  0.080816  0.899549  0.513703  1
  Zr  Zr72  1  0.376902  0.813137  0.551558  1
  Zr  Zr73  1  0.667338  0.225412  0.611036  1
  Zr  Zr74  1  0.965691  0.141709  0.648732  1
  Zr  Zr75  1  0.257447  0.061988  0.683317  1
  Zr  Zr76  1  0.350401  0.709185  0.617379  1
  Zr  Zr77  1  0.648874  0.618899  0.654929  1
  Zr  Zr78  1  0.946807  0.538322  0.689763  1
  Zr  Zr79  1  0.408175  0.315294  0.703729  1
  Zr  Zr80  1  0.808658  0.511327  0.633281  1
  Zr  Zr81  1  0.105960  0.402704  0.670557  1
  Zr  Zr82  1  0.508858  0.338487  0.632882  1
  Zr  Zr83  1  0.805376  0.244161  0.672196  1
  Zr  Zr84  1  0.211009  0.424869  0.595571  1
  Zr  Zr85  1  0.494261  0.931673  0.647858  1
  Zr  Zr86  1  0.790851  0.834120  0.682573  1
  Zr  Zr87  1  0.196116  0.019132  0.609782  1
  Zr  Zr88  1  0.408747  0.743739  0.688363  1
  Zr  Zr89  1  0.822361  0.921021  0.617997  1
  Zr  Zr90  1  0.119415  0.833043  0.652947  1
  Zr  Zr91  1  0.343136  0.203872  0.639176  1
  Zr  Zr92  1  0.636892  0.119697  0.676732  1
  Zr  Zr93  1  0.047167  0.295490  0.600566  1
  Zr  Zr94  1  0.562241  0.477310  0.699117  1
  Zr  Zr95  1  0.972969  0.642091  0.626199  1
  Zr  Zr96  1  0.268451  0.559593  0.665953  1
  Ni  Ni97  1  0.690106  0.762358  0.260215  1
  Ni  Ni98  1  0.981269  0.697045  0.295060  1
  Ni  Ni99  1  0.282992  0.615055  0.332552  1
  Ni  Ni100  1  0.899541  0.878034  0.294561  1
  Ni  Ni101  1  0.200745  0.786732  0.330286  1
  Ni  Ni102  1  0.497601  0.697660  0.368514  1
  Ni  Ni103  1  0.778593  0.610064  0.266299  1
  Ni  Ni104  1  0.067344  0.534361  0.299824  1
  Ni  Ni105  1  0.365373  0.444598  0.336013  1
  Ni  Ni106  1  0.930254  0.134025  0.317097  1
  Ni  Ni107  1  0.227289  0.047928  0.352157  1
  Ni  Ni108  1  0.628433  0.228181  0.276819  1
  Ni  Ni109  1  0.634822  0.095075  0.350332  1
  Ni  Ni110  1  0.033867  0.282781  0.276419  1
  Ni  Ni111  1  0.336962  0.183149  0.312819  1
  Ni  Ni112  1  0.789691  0.799891  0.363703  1
  Ni  Ni113  1  0.196193  0.978839  0.289036  1
  Ni  Ni114  1  0.493559  0.879998  0.326796  1
  Ni  Ni115  1  0.775940  0.428141  0.305153  1
  Ni  Ni116  1  0.071778  0.347997  0.340251  1
  Ni  Ni117  1  0.478996  0.528463  0.268166  1
  Ni  Ni118  1  0.694607  0.834545  0.351730  1
  Ni  Ni119  1  0.097790  0.012640  0.278133  1
  Ni  Ni120  1  0.398039  0.921711  0.315604  1
  Ni  Ni121  1  0.771460  0.903772  0.276049  1
  Ni  Ni122  1  0.063677  0.821589  0.312022  1
  Ni  Ni123  1  0.363109  0.733664  0.349372  1
  Ni  Ni124  1  0.896419  0.573093  0.281949  1
  Ni  Ni125  1  0.202563  0.497995  0.316638  1
  Ni  Ni126  1  0.499391  0.408780  0.355691  1
  Ni  Ni127  1  0.803193  0.238161  0.342936  1
  Ni  Ni128  1  0.212806  0.419749  0.268238  1
  Ni  Ni129  1  0.507369  0.330035  0.306812  1
  Ni  Ni130  1  0.761211  0.993457  0.323643  1
  Ni  Ni131  1  0.059322  0.901774  0.362173  1
  Ni  Ni132  1  0.468371  0.062324  0.289058  1
  Ni  Ni133  1  0.704741  0.271018  0.325799  1
  Ni  Ni134  1  0.999832  0.192840  0.362712  1
  Ni  Ni135  1  0.413099  0.345414  0.287938  1
  Ni  Ni136  1  0.858822  0.963755  0.341109  1
  Ni  Ni137  1  0.271191  0.143578  0.269020  1
  Ni  Ni138  1  0.564793  0.051449  0.304665  1
  Ni  Ni139  1  0.735975  0.191758  0.280696  1
  Ni  Ni140  1  0.037359  0.115986  0.317911  1
  Ni  Ni141  1  0.335914  0.026342  0.356071  1
  Ni  Ni142  1  0.927235  0.278421  0.274831  1
  Ni  Ni143  1  0.229714  0.213867  0.311009  1
  Ni  Ni144  1  0.526697  0.118546  0.348989  1
  Ni  Ni145  1  0.653175  0.569334  0.335442  1
  Ni  Ni146  1  0.055351  0.752699  0.261972  1
  Ni  Ni147  1  0.354497  0.674673  0.296566  1
  Ni  Ni148  1  0.913310  0.651965  0.332630  1
  Ni  Ni149  1  0.211396  0.567026  0.369545  1
  Ni  Ni150  1  0.621326  0.726537  0.297690  1
  Ni  Ni151  1  0.844314  0.518136  0.360443  1
  Ni  Ni152  1  0.250786  0.691139  0.285115  1
  Ni  Ni153  1  0.546915  0.603347  0.323079  1
  Ni  Ni154  1  0.722160  0.711930  0.308171  1
  Ni  Ni155  1  0.016829  0.627226  0.344694  1
  Ni  Ni156  1  0.431022  0.795864  0.273089  1
  Ni  Ni157  1  0.870374  0.395621  0.317047  1
  Ni  Ni158  1  0.167355  0.311946  0.351481  1
  Ni  Ni159  1  0.574290  0.491110  0.279281  1
  Ni  Ni160  1  0.580369  0.528217  0.371257  1
  Ni  Ni161  1  0.876596  0.444097  0.409024  1
  Ni  Ni162  1  0.173592  0.357322  0.445311  1
  Ni  Ni163  1  0.793979  0.612737  0.405743  1
  Ni  Ni164  1  0.091071  0.526455  0.442142  1
  Ni  Ni165  1  0.387865  0.440090  0.480026  1
  Ni  Ni166  1  0.662461  0.354642  0.374640  1
  Ni  Ni167  1  0.959207  0.273816  0.411793  1
  Ni  Ni168  1  0.255789  0.187423  0.448634  1
  Ni  Ni169  1  0.821417  0.873399  0.428322  1
  Ni  Ni170  1  0.118666  0.788120  0.464341  1
  Ni  Ni171  1  0.525463  0.958735  0.390769  1
  Ni  Ni172  1  0.524844  0.838262  0.463803  1
  Ni  Ni173  1  0.932342  1.011472  0.390075  1
  Ni  Ni174  1  0.228162  0.926230  0.426118  1
  Ni  Ni175  1  0.681160  0.536129  0.475953  1
  Ni  Ni176  1  0.087285  0.711086  0.400573  1
  Ni  Ni177  1  0.384086  0.623941  0.438239  1
  Ni  Ni178  1  0.666087  0.173568  0.416458  1
  Ni  Ni179  1  0.962656  0.088834  0.453387  1
  Ni  Ni180  1  0.369042  0.262575  0.378718  1
  Ni  Ni181  1  0.585431  0.574517  0.464677  1
  Ni  Ni182  1  0.991295  0.748457  0.389929  1
  Ni  Ni183  1  0.288424  0.662540  0.426838  1
  Ni  Ni184  1  0.660830  0.647096  0.387418  1
  Ni  Ni185  1  0.957029  0.562080  0.424895  1
  Ni  Ni186  1  0.253864  0.476486  0.461715  1
  Ni  Ni187  1  0.796426  0.322337  0.392922  1
  Ni  Ni188  1  0.093249  0.238215  0.429064  1
  Ni  Ni189  1  0.389763  0.151055  0.466924  1
  Ni  Ni190  1  0.693318  0.982867  0.454850  1
  Ni  Ni191  1  0.099597  0.158916  0.379111  1
  Ni  Ni192  1  0.395878  0.071693  0.417195  1
  Ni  Ni193  1  0.653945  0.726288  0.437408  1
  Ni  Ni194  1  0.950768  0.641162  0.474724  1
  Ni  Ni195  1  0.356737  0.813540  0.399627  1
  Ni  Ni196  1  0.593762  0.018127  0.437701  1
  Ni  Ni197  1  0.890132  0.933764  0.475548  1
  Ni  Ni198  1  0.296720  0.106815  0.400042  1
  Ni  Ni199  1  0.753234  0.691963  0.454288  1
  Ni  Ni200  1  0.159295  0.867016  0.378619  1
  Ni  Ni201  1  0.456893  0.777489  0.416849  1
  Ni  Ni202  1  0.633167  0.939038  0.393428  1
  Ni  Ni203  1  0.929334  0.850551  0.431847  1
  Ni  Ni204  1  0.226610  0.766420  0.468216  1
  Ni  Ni205  1  0.824061  0.032909  0.386502  1
  Ni  Ni206  1  0.120773  0.948465  0.422401  1
  Ni  Ni207  1  0.416960  0.860690  0.460447  1
  Ni  Ni208  1  0.542021  0.317455  0.446773  1
  Ni  Ni209  1  0.947830  0.491827  0.371975  1
  Ni  Ni210  1  0.245167  0.405710  0.408887  1
  Ni  Ni211  1  0.804918  0.394649  0.445451  1
  Ni  Ni212  1  0.102089  0.308317  0.481865  1
  Ni  Ni213  1  0.508483  0.479392  0.407795  1
  Ni  Ni214  1  0.735051  0.257181  0.472047  1
  Ni  Ni215  1  0.141340  0.431902  0.396349  1
  Ni  Ni216  1  0.438023  0.345018  0.434357  1
  Ni  Ni217  1  0.612123  0.453066  0.420178  1
  Ni  Ni218  1  0.908835  0.368070  0.457763  1
  Ni  Ni219  1  0.314923  0.541416  0.382121  1
  Ni  Ni220  1  0.761570  0.136123  0.427608  1
  Ni  Ni221  1  0.058705  0.051041  0.464034  1
  Ni  Ni222  1  0.464850  0.222368  0.390143  1
  Ni  Ni223  1  0.470237  0.269662  0.483213  1
  Ni  Ni224  1  0.766987  0.182472  0.521061  1
  Ni  Ni225  1  0.064033  0.096065  0.557321  1
  Ni  Ni226  1  0.684768  0.352092  0.517748  1
  Ni  Ni227  1  0.981378  0.266379  0.554568  1
  Ni  Ni228  1  0.278189  0.185315  0.591875  1
  Ni  Ni229  1  0.552631  0.099299  0.486409  1
  Ni  Ni230  1  0.849495  0.013494  0.524237  1
  Ni  Ni231  1  0.146669  0.927353  0.560600  1
  Ni  Ni232  1  0.712322  0.613394  0.540192  1
  Ni  Ni233  1  1.008333  0.528729  0.576346  1
  Ni  Ni234  1  0.415706  0.701021  0.502641  1
  Ni  Ni235  1  0.415062  0.580412  0.575626  1
  Ni  Ni236  1  0.821933  0.751767  0.502047  1
  Ni  Ni237  1  0.119006  0.666673  0.537994  1
  Ni  Ni238  1  0.571593  0.276602  0.587670  1
  Ni  Ni239  1  0.977893  0.451201  0.512965  1
  Ni  Ni240  1  0.274405  0.365637  0.549911  1
  Ni  Ni241  1  0.556422  0.915375  0.528180  1
  Ni  Ni242  1  0.853215  0.828873  0.565803  1
  Ni  Ni243  1  0.259400  1.003537  0.490458  1
  Ni  Ni244  1  0.475743  0.316781  0.576273  1
  Ni  Ni245  1  0.881844  0.488941  0.502334  1
  Ni  Ni246  1  0.179053  0.403629  0.538817  1
  Ni  Ni247  1  0.550730  0.388279  0.499491  1
  Ni  Ni248  1  0.847312  0.301758  0.537310  1
  Ni  Ni249  1  0.144348  0.217717  0.573473  1
  Ni  Ni250  1  0.686732  0.063078  0.504669  1
  Ni  Ni251  1  0.983530  0.978065  0.541462  1
  Ni  Ni252  1  0.279539  0.892130  0.579008  1
  Ni  Ni253  1  0.583827  0.725708  0.566762  1
  Ni  Ni254  1  0.989787  0.898903  0.491643  1
  Ni  Ni255  1  0.286503  0.813280  0.529004  1
  Ni  Ni256  1  0.544679  0.467535  0.549224  1
  Ni  Ni257  1  0.840945  0.381111  0.587271  1
  Ni  Ni258  1  0.247252  0.556454  0.511516  1
  Ni  Ni259  1  0.483606  0.761857  0.549558  1
  Ni  Ni260  1  0.781307  0.672673  0.587785  1
  Ni  Ni261  1  0.187259  0.848018  0.512052  1
  Ni  Ni262  1  0.643882  0.432435  0.566314  1
  Ni  Ni263  1  0.050464  0.606251  0.490836  1
  Ni  Ni264  1  0.346685  0.521406  0.528810  1
  Ni  Ni265  1  0.523539  0.678600  0.505982  1
  Ni  Ni266  1  0.819761  0.591403  0.543981  1
  Ni  Ni267  1  0.116842  0.506757  0.579855  1
  Ni  Ni268  1  0.713998  0.773332  0.498140  1
  Ni  Ni269  1  1.011160  0.689469  0.534509  1
  Ni  Ni270  1  0.307287  0.598911  0.573339  1
  Ni  Ni271  1  0.432084  0.059849  0.558615  1
  Ni  Ni272  1  0.838489  0.231511  0.484504  1
  Ni  Ni273  1  0.135708  0.145480  0.520945  1
  Ni  Ni274  1  0.695409  0.133949  0.557499  1
  Ni  Ni275  1  0.992693  0.048423  0.594353  1
  Ni  Ni276  1  0.398487  0.221897  0.519659  1
  Ni  Ni277  1  0.625690  0.997837  0.584271  1
  Ni  Ni278  1  0.031752  0.172041  0.508609  1
  Ni  Ni279  1  0.328396  0.086249  0.546242  1
  Ni  Ni280  1  0.502512  0.194269  0.532060  1
  Ni  Ni281  1  0.799190  0.107966  0.570034  1
  Ni  Ni282  1  0.205529  0.282483  0.494346  1
  Ni  Ni283  1  0.652137  0.876934  0.539549  1
  Ni  Ni284  1  0.949183  0.791694  0.576429  1
  Ni  Ni285  1  0.355089  0.964879  0.501747  1
  Ni  Ni286  1  0.360218  1.010811  0.595082  1
  Ni  Ni287  1  0.657589  0.924220  0.633839  1
  Ni  Ni288  1  0.959574  0.843699  0.671398  1
  Ni  Ni289  1  0.575225  0.094659  0.630413  1
  Ni  Ni290  1  0.873316  1.005542  0.666567  1
  Ni  Ni291  1  0.158882  0.933855  0.699647  1
  Ni  Ni292  1  0.442999  0.841672  0.597905  1
  Ni  Ni293  1  0.739888  0.752728  0.636118  1
  Ni  Ni294  1  0.041177  0.662478  0.671756  1
  Ni  Ni295  1  0.603991  0.355984  0.653470  1
  Ni  Ni296  1  0.906761  0.257256  0.689954  1
  Ni  Ni297  1  0.306384  0.444633  0.617053  1
  Ni  Ni298  1  0.308308  0.311870  0.687077  1
  Ni  Ni299  1  0.713379  0.491353  0.614267  1
  Ni  Ni300  1  1.010195  0.406240  0.649225  1
  Ni  Ni301  1  0.460038  0.015286  0.698403  1
  Ni  Ni302  1  0.868834  0.191914  0.626113  1
  Ni  Ni303  1  0.164339  0.113033  0.661076  1
  Ni  Ni304  1  0.446939  0.659583  0.639591  1
  Ni  Ni305  1  0.744273  0.560554  0.677445  1
  Ni  Ni306  1  0.150865  0.740211  0.602461  1
  Ni  Ni307  1  0.364880  0.050020  0.687116  1
  Ni  Ni308  1  0.773270  0.227639  0.614915  1
  Ni  Ni309  1  0.070201  0.144797  0.649203  1
  Ni  Ni310  1  0.441284  0.130185  0.610777  1
  Ni  Ni311  1  0.737998  0.041484  0.649753  1
  Ni  Ni312  1  0.045309  0.967131  0.684349  1
  Ni  Ni313  1  0.577563  0.805342  0.616999  1
  Ni  Ni314  1  0.877034  0.718456  0.654389  1
  Ni  Ni315  1  0.167372  0.638367  0.689939  1
  Ni  Ni316  1  0.471138  0.476342  0.677260  1
  Ni  Ni317  1  0.881186  0.638203  0.604211  1
  Ni  Ni318  1  0.178941  0.547243  0.642684  1
  Ni  Ni319  1  0.432914  0.210162  0.659703  1
  Ni  Ni320  1  0.727688  0.120180  0.698124  1
  Ni  Ni321  1  0.137535  0.302411  0.623377  1
  Ni  Ni322  1  0.373668  0.491600  0.660964  1
  Ni  Ni323  1  0.668716  0.395930  0.697310  1
  Ni  Ni324  1  0.081531  0.576481  0.625129  1
  Ni  Ni325  1  0.527376  0.194580  0.678360  1
  Ni  Ni326  1  0.940749  0.347321  0.603650  1
  Ni  Ni327  1  0.236448  0.269904  0.641192  1
  Ni  Ni328  1  0.414080  0.420398  0.617478  1
  Ni  Ni329  1  0.710937  0.325465  0.655450  1
  Ni  Ni330  1  0.013383  0.261194  0.691483  1
  Ni  Ni331  1  0.604694  0.512942  0.610253  1
  Ni  Ni332  1  0.903208  0.424011  0.648462  1
  Ni  Ni333  1  0.203591  0.349465  0.685804  1
  Ni  Ni334  1  0.319269  0.813857  0.668553  1
  Ni  Ni335  1  0.729232  0.972240  0.596834  1
  Ni  Ni336  1  0.027153  0.888615  0.633698  1
  Ni  Ni337  1  0.586164  0.863075  0.669885  1
  Ni  Ni338  1  0.885338  0.787351  0.704419  1
  Ni  Ni339  1  0.287226  0.968052  0.630974  1
  Ni  Ni340  1  0.508610  0.744319  0.693105  1
  Ni  Ni341  1  0.923752  0.912916  0.621690  1
  Ni  Ni342  1  0.217677  0.829438  0.658432  1
  Ni  Ni343  1  0.393899  0.935536  0.643501  1
  Ni  Ni344  1  0.689879  0.848185  0.681283  1
  Ni  Ni345  1  0.096257  0.022134  0.605801  1
  Ni  Ni346  1  0.542366  0.616998  0.650723  1
  Ni  Ni347  1  0.842803  0.527283  0.688259  1
  Ni  Ni348  1  0.245663  0.705524  0.614767  1
