# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.71941066
_cell_length_b   24.96087693
_cell_length_c   48.35682781
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.09067794
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   10468.6532449
_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  0.120742  0.910840  0.306716  1
  Zr  Zr2  1  0.484364  0.314202  0.342764  1
  Zr  Zr3  1  0.755569  0.508910  0.272579  1
  Zr  Zr4  1  0.404076  0.757629  0.378068  1
  Zr  Zr5  1  0.672081  0.950969  0.305905  1
  Zr  Zr6  1  0.033239  0.354534  0.341208  1
  Zr  Zr7  1  0.528373  0.664729  0.296253  1
  Zr  Zr8  1  0.913030  0.072838  0.338391  1
  Zr  Zr9  1  0.279751  0.475569  0.373673  1
  Zr  Zr10  1  0.867101  0.789123  0.273469  1
  Zr  Zr11  1  0.235297  0.198789  0.304989  1
  Zr  Zr12  1  0.604339  0.598529  0.346598  1
  Zr  Zr13  1  0.115019  0.694218  0.310439  1
  Zr  Zr14  1  0.481221  0.096286  0.347165  1
  Zr  Zr15  1  0.745672  0.288713  0.277315  1
  Zr  Zr16  1  0.404309  0.976544  0.373758  1
  Zr  Zr17  1  0.672885  0.167085  0.300285  1
  Zr  Zr18  1  0.036420  0.571834  0.336863  1
  Zr  Zr19  1  0.951587  0.837940  0.355053  1
  Zr  Zr20  1  0.218011  0.029355  0.282536  1
  Zr  Zr21  1  0.581247  0.436820  0.319533  1
  Zr  Zr22  1  0.573633  0.830599  0.328907  1
  Zr  Zr23  1  0.934576  0.235658  0.366128  1
  Zr  Zr24  1  0.193531  0.425401  0.290503  1
  Zr  Zr25  1  0.217297  0.122693  0.416273  1
  Zr  Zr26  1  0.583990  0.525829  0.453905  1
  Zr  Zr27  1  0.852899  0.719094  0.379973  1
  Zr  Zr28  1  0.495088  0.969206  0.489436  1
  Zr  Zr29  1  0.763197  0.161759  0.415297  1
  Zr  Zr30  1  0.132801  0.565673  0.452248  1
  Zr  Zr31  1  0.647699  0.882162  0.412515  1
  Zr  Zr32  1  0.010490  0.285363  0.449184  1
  Zr  Zr33  1  0.379828  0.688623  0.486084  1
  Zr  Zr34  1  0.972471  0.998527  0.383330  1
  Zr  Zr35  1  0.334698  0.402882  0.420366  1
  Zr  Zr36  1  0.704121  0.806445  0.456999  1
  Zr  Zr37  1  0.213840  0.903700  0.421448  1
  Zr  Zr38  1  0.576768  0.307415  0.458495  1
  Zr  Zr39  1  0.848372  0.500241  0.385061  1
  Zr  Zr40  1  0.498296  0.187599  0.484359  1
  Zr  Zr41  1  0.767790  0.380205  0.410557  1
  Zr  Zr42  1  0.138396  0.783813  0.447528  1
  Zr  Zr43  1  0.046199  0.048627  0.466077  1
  Zr  Zr44  1  0.313381  0.241081  0.391842  1
  Zr  Zr45  1  0.684817  0.644895  0.429623  1
  Zr  Zr46  1  0.666653  0.043202  0.440127  1
  Zr  Zr47  1  0.032147  0.446924  0.476873  1
  Zr  Zr48  1  0.302162  0.638848  0.402452  1
  Zr  Zr49  1  0.312396  0.333157  0.527954  1
  Zr  Zr50  1  0.681776  0.737044  0.564915  1
  Zr  Zr51  1  0.950176  0.929609  0.490856  1
  Zr  Zr52  1  0.592264  0.179740  0.600252  1
  Zr  Zr53  1  0.861182  0.372998  0.526289  1
  Zr  Zr54  1  0.227859  0.776141  0.563988  1
  Zr  Zr55  1  0.741117  0.092352  0.523267  1
  Zr  Zr56  1  0.110490  0.495906  0.559824  1
  Zr  Zr57  1  0.472888  0.900328  0.597169  1
  Zr  Zr58  1  0.065327  0.210234  0.494152  1
  Zr  Zr59  1  0.434631  0.613416  0.531001  1
  Zr  Zr60  1  0.797408  1.016548  0.567754  1
  Zr  Zr61  1  0.306777  0.115028  0.532725  1
  Zr  Zr62  1  0.677354  0.518593  0.569638  1
  Zr  Zr63  1  0.946888  0.711217  0.495863  1
  Zr  Zr64  1  0.596811  0.398591  0.595149  1
  Zr  Zr65  1  0.868377  0.591397  0.521702  1
  Zr  Zr66  1  0.231526  0.995153  0.558851  1
  Zr  Zr67  1  0.143031  0.260025  0.577759  1
  Zr  Zr68  1  0.413024  0.451889  0.503314  1
  Zr  Zr69  1  0.778508  0.855619  0.540155  1
  Zr  Zr70  1  0.760334  0.253963  0.550587  1
  Zr  Zr71  1  0.131788  0.657690  0.588368  1
  Zr  Zr72  1  0.399110  0.850234  0.514225  1
  Zr  Zr73  1  0.411936  0.544272  0.639012  1
  Zr  Zr74  1  0.772854  0.947504  0.675091  1
  Zr  Zr75  1  0.041167  0.141275  0.602160  1
  Zr  Zr76  1  0.689476  0.389952  0.707657  1
  Zr  Zr77  1  0.960814  0.584534  0.637431  1
  Zr  Zr78  1  0.323696  0.988013  0.673583  1
  Zr  Zr79  1  0.840788  0.300351  0.633627  1
  Zr  Zr80  1  0.210214  0.699808  0.675294  1
  Zr  Zr81  1  0.577721  0.110026  0.706853  1
  Zr  Zr82  1  0.165393  0.423263  0.606537  1
  Zr  Zr83  1  0.532171  0.825703  0.641869  1
  Zr  Zr84  1  0.916891  0.234227  0.684013  1
  Zr  Zr85  1  0.408650  0.327039  0.643349  1
  Zr  Zr86  1  0.771096  0.731223  0.679861  1
  Zr  Zr87  1  0.040862  0.922376  0.606440  1
  Zr  Zr88  1  0.699394  0.610225  0.702949  1
  Zr  Zr89  1  0.963269  0.802366  0.632807  1
  Zr  Zr90  1  0.329906  0.204731  0.669803  1
  Zr  Zr91  1  0.251542  0.473409  0.689726  1
  Zr  Zr92  1  0.510397  0.663083  0.614047  1
  Zr  Zr93  1  0.871044  0.068696  0.651206  1
  Zr  Zr94  1  0.863841  0.462001  0.660699  1
  Zr  Zr95  1  0.227098  0.869343  0.697993  1
  Zr  Zr96  1  0.493894  0.060808  0.625302  1
  Ni  Ni97  1  0.262550  0.833162  0.341578  1
  Ni  Ni98  1  0.623881  0.237502  0.378357  1
  Ni  Ni99  1  0.889010  0.429942  0.304278  1
  Ni  Ni100  1  0.095531  0.800940  0.306171  1
  Ni  Ni101  1  0.461779  0.203455  0.341031  1
  Ni  Ni102  1  0.708384  0.398253  0.269849  1
  Ni  Ni103  1  0.420800  0.868385  0.378785  1
  Ni  Ni104  1  0.682344  0.059125  0.305110  1
  Ni  Ni105  1  0.052487  0.463105  0.340846  1
  Ni  Ni106  1  0.844666  0.863951  0.308424  1
  Ni  Ni107  1  0.211143  0.265547  0.345444  1
  Ni  Ni108  1  0.459646  0.465806  0.275222  1
  Ni  Ni109  1  0.675129  0.808549  0.376356  1
  Ni  Ni110  1  0.937805  1.002094  0.299250  1
  Ni  Ni111  1  0.308222  0.401498  0.334610  1
  Ni  Ni112  1  0.849870  0.660225  0.333574  1
  Ni  Ni113  1  0.207768  0.064823  0.370642  1
  Ni  Ni114  1  0.484120  0.258234  0.297247  1
  Ni  Ni115  1  0.675543  1.008624  0.350486  1
  Ni  Ni116  1  0.944679  0.200144  0.277141  1
  Ni  Ni117  1  0.297089  0.604390  0.312590  1
  Ni  Ni118  1  0.786096  0.594166  0.299810  1
  Ni  Ni119  1  0.164863  0.996870  0.334329  1
  Ni  Ni120  1  0.529016  0.400434  0.372361  1
  Ni  Ni121  1  0.160464  0.915076  0.365520  1
  Ni  Ni122  1  0.423850  0.107317  0.292922  1
  Ni  Ni123  1  0.791603  0.512177  0.329306  1
  Ni  Ni124  1  0.362082  0.751587  0.317645  1
  Ni  Ni125  1  0.726359  0.156815  0.354476  1
  Ni  Ni126  1  0.984229  0.347890  0.280886  1
  Ni  Ni127  1  0.604196  0.763822  0.290337  1
  Ni  Ni128  1  0.968136  0.171603  0.325741  1
  Ni  Ni129  1  0.328992  0.573287  0.362003  1
  Ni  Ni130  1  0.826246  0.689618  0.286187  1
  Ni  Ni131  1  0.189978  0.096849  0.320461  1
  Ni  Ni132  1  0.556755  0.500469  0.359223  1
  Ni  Ni133  1  0.675767  0.910455  0.359827  1
  Ni  Ni134  1  0.942749  0.101531  0.288821  1
  Ni  Ni135  1  0.299417  0.504684  0.320430  1
  Ni  Ni136  1  0.847749  0.760472  0.324537  1
  Ni  Ni137  1  0.212560  0.163933  0.359256  1
  Ni  Ni138  1  0.477921  0.360616  0.290846  1
  Ni  Ni139  1  0.909032  0.946477  0.341062  1
  Ni  Ni140  1  0.172760  0.131029  0.269081  1
  Ni  Ni141  1  0.536456  0.545235  0.305094  1
  Ni  Ni142  1  0.612119  0.717800  0.339263  1
  Ni  Ni143  1  0.978818  0.129714  0.379186  1
  Ni  Ni144  1  0.239532  0.316868  0.303403  1
  Ni  Ni145  1  0.395755  0.918510  0.330353  1
  Ni  Ni146  1  0.757825  0.323458  0.367248  1
  Ni  Ni147  1  0.025151  0.515142  0.294418  1
  Ni  Ni148  1  0.129354  0.748404  0.353869  1
  Ni  Ni149  1  0.396485  0.936526  0.282388  1
  Ni  Ni150  1  0.755662  0.346018  0.317464  1
  Ni  Ni151  1  0.353935  0.839826  0.291928  1
  Ni  Ni152  1  0.724851  0.248249  0.328438  1
  Ni  Ni153  1  0.093843  0.652795  0.364995  1
  Ni  Ni154  1  0.038975  0.610219  0.284287  1
  Ni  Ni155  1  0.425936  1.014879  0.318295  1
  Ni  Ni156  1  0.792711  0.419900  0.355518  1
  Ni  Ni157  1  0.614713  0.862651  0.276257  1
  Ni  Ni158  1  0.982863  0.269452  0.312378  1
  Ni  Ni159  1  0.355206  0.671545  0.347600  1
  Ni  Ni160  1  0.356155  0.046170  0.453043  1
  Ni  Ni161  1  0.722591  0.449407  0.490095  1
  Ni  Ni162  1  -0.006332  0.642181  0.415813  1
  Ni  Ni163  1  0.198311  1.011812  0.416389  1
  Ni  Ni164  1  0.562552  0.415248  0.453433  1
  Ni  Ni165  1  0.832430  0.608712  0.379478  1
  Ni  Ni166  1  0.514356  0.080087  0.489916  1
  Ni  Ni167  1  0.782349  0.272424  0.415689  1
  Ni  Ni168  1  0.153085  0.676013  0.452729  1
  Ni  Ni169  1  0.945194  0.072963  0.419143  1
  Ni  Ni170  1  0.310897  0.476741  0.456803  1
  Ni  Ni171  1  0.578827  0.670482  0.384091  1
  Ni  Ni172  1  0.768357  0.018781  0.486930  1
  Ni  Ni173  1  0.035038  0.211700  0.413143  1
  Ni  Ni174  1  0.406169  0.614829  0.449136  1
  Ni  Ni175  1  0.940797  0.872149  0.445274  1
  Ni  Ni176  1  0.302910  0.275429  0.482031  1
  Ni  Ni177  1  0.573081  0.467792  0.408218  1
  Ni  Ni178  1  0.773244  0.219533  0.460879  1
  Ni  Ni179  1  0.040413  0.412289  0.387406  1
  Ni  Ni180  1  0.410978  0.815933  0.424014  1
  Ni  Ni181  1  0.901636  0.804565  0.409786  1
  Ni  Ni182  1  0.261749  0.207851  0.446293  1
  Ni  Ni183  1  0.630862  0.611603  0.483582  1
  Ni  Ni184  1  0.254600  0.126781  0.477080  1
  Ni  Ni185  1  0.522526  0.318921  0.402867  1
  Ni  Ni186  1  0.893716  0.722943  0.440248  1
  Ni  Ni187  1  0.457454  0.965107  0.429223  1
  Ni  Ni188  1  0.821976  0.368603  0.466003  1
  Ni  Ni189  1  0.093678  0.560982  0.391949  1
  Ni  Ni190  1  0.696722  0.978262  0.400447  1
  Ni  Ni191  1  0.060170  0.381884  0.437204  1
  Ni  Ni192  1  0.429177  0.785293  0.474177  1
  Ni  Ni193  1  0.922517  0.902419  0.395050  1
  Ni  Ni194  1  0.285208  0.306055  0.431881  1
  Ni  Ni195  1  0.655009  0.709872  0.469250  1
  Ni  Ni196  1  0.768061  0.121258  0.470897  1
  Ni  Ni197  1  0.037780  0.314056  0.397005  1
  Ni  Ni198  1  0.406313  0.717211  0.433424  1
  Ni  Ni199  1  0.944967  0.970361  0.435411  1
  Ni  Ni200  1  0.308670  0.373818  0.472562  1
  Ni  Ni201  1  0.582386  0.567239  0.399551  1
  Ni  Ni202  1  0.003999  0.154822  0.452949  1
  Ni  Ni203  1  0.271946  0.349368  0.378098  1
  Ni  Ni204  1  0.642376  0.751984  0.416445  1
  Ni  Ni205  1  0.709370  0.936843  0.453461  1
  Ni  Ni206  1  0.072677  0.339726  0.490375  1
  Ni  Ni207  1  0.343731  0.531538  0.415597  1
  Ni  Ni208  1  0.489537  0.131284  0.440881  1
  Ni  Ni209  1  0.857012  0.535100  0.478116  1
  Ni  Ni210  1  0.127576  0.727265  0.404012  1
  Ni  Ni211  1  0.222769  0.960343  0.465080  1
  Ni  Ni212  1  0.490148  0.153038  0.390482  1
  Ni  Ni213  1  0.860347  0.556634  0.428299  1
  Ni  Ni214  1  0.457517  0.057047  0.402802  1
  Ni  Ni215  1  0.822806  0.460538  0.439807  1
  Ni  Ni216  1  0.190234  0.864115  0.477011  1
  Ni  Ni217  1  0.162578  0.823059  0.391972  1
  Ni  Ni218  1  0.523166  0.227137  0.428910  1
  Ni  Ni219  1  0.893804  0.631025  0.466402  1
  Ni  Ni220  1  0.718672  0.076462  0.385770  1
  Ni  Ni221  1  0.086545  0.480024  0.422675  1
  Ni  Ni222  1  0.450766  0.883571  0.459772  1
  Ni  Ni223  1  0.451545  0.256641  0.564404  1
  Ni  Ni224  1  0.821368  0.661244  0.601839  1
  Ni  Ni225  1  0.089180  0.852667  0.527257  1
  Ni  Ni226  1  0.292114  0.222826  0.527490  1
  Ni  Ni227  1  0.662781  0.626351  0.564507  1
  Ni  Ni228  1  0.930910  0.818763  0.490357  1
  Ni  Ni229  1  0.612752  0.290130  0.600737  1
  Ni  Ni230  1  0.882626  0.483562  0.526761  1
  Ni  Ni231  1  0.247066  0.887059  0.563934  1
  Ni  Ni232  1  0.039004  0.284032  0.531084  1
  Ni  Ni233  1  0.410042  0.687074  0.567027  1
  Ni  Ni234  1  0.676984  0.880027  0.493313  1
  Ni  Ni235  1  0.866406  0.228404  0.596110  1
  Ni  Ni236  1  0.134295  0.422068  0.523374  1
  Ni  Ni237  1  0.499901  0.825949  0.561203  1
  Ni  Ni238  1  0.034197  0.082912  0.556257  1
  Ni  Ni239  1  0.404786  0.486514  0.592800  1
  Ni  Ni240  1  0.671836  0.679292  0.519331  1
  Ni  Ni241  1  0.872067  0.431028  0.571981  1
  Ni  Ni242  1  0.142264  0.623387  0.498175  1
  Ni  Ni243  1  0.504368  0.026662  0.535000  1
  Ni  Ni244  1  -0.005504  1.015259  0.520518  1
  Ni  Ni245  1  0.358635  0.418800  0.557525  1
  Ni  Ni246  1  0.726269  0.822365  0.594478  1
  Ni  Ni247  1  0.351501  0.337861  0.588259  1
  Ni  Ni248  1  0.623194  0.530202  0.514191  1
  Ni  Ni249  1  0.987775  0.933716  0.551051  1
  Ni  Ni250  1  0.551429  0.175873  0.539976  1
  Ni  Ni251  1  0.922649  0.579846  0.577324  1
  Ni  Ni252  1  0.190593  0.772076  0.503176  1
  Ni  Ni253  1  0.790107  0.188955  0.510968  1
  Ni  Ni254  1  0.159934  0.592747  0.548316  1
  Ni  Ni255  1  0.522696  0.996414  0.585287  1
  Ni  Ni256  1  0.015988  0.113568  0.506094  1
  Ni  Ni257  1  0.384991  0.516912  0.542990  1
  Ni  Ni258  1  0.748535  0.920517  0.579898  1
  Ni  Ni259  1  0.862811  0.331606  0.580659  1
  Ni  Ni260  1  0.136493  0.524999  0.507635  1
  Ni  Ni261  1  0.500436  0.928475  0.544981  1
  Ni  Ni262  1  0.038937  0.181654  0.546812  1
  Ni  Ni263  1  0.407333  0.584714  0.583181  1
  Ni  Ni264  1  0.677190  0.777556  0.509326  1
  Ni  Ni265  1  0.101454  0.367320  0.564598  1
  Ni  Ni266  1  0.372483  0.559074  0.489815  1
  Ni  Ni267  1  0.735800  0.961960  0.526779  1
  Ni  Ni268  1  0.802818  0.146960  0.563743  1
  Ni  Ni269  1  0.173228  0.549397  0.602108  1
  Ni  Ni270  1  0.441163  0.744068  0.527287  1
  Ni  Ni271  1  0.584820  0.342201  0.551908  1
  Ni  Ni272  1  0.954832  0.745689  0.589664  1
  Ni  Ni273  1  0.222539  0.938491  0.515232  1
  Ni  Ni274  1  0.317535  0.171599  0.576222  1
  Ni  Ni275  1  0.588174  0.363712  0.502082  1
  Ni  Ni276  1  0.955584  0.767548  0.539330  1
  Ni  Ni277  1  0.551363  0.267798  0.513808  1
  Ni  Ni278  1  0.921934  0.671648  0.551287  1
  Ni  Ni279  1  0.282749  0.075788  0.588323  1
  Ni  Ni280  1  0.255007  0.034725  0.503274  1
  Ni  Ni281  1  0.622360  0.438272  0.540386  1
  Ni  Ni282  1  0.987680  0.841797  0.577440  1
  Ni  Ni283  1  0.814302  0.287218  0.496622  1
  Ni  Ni284  1  0.183348  0.690973  0.533924  1
  Ni  Ni285  1  0.543400  0.094247  0.570471  1
  Ni  Ni286  1  0.556034  0.468892  0.675955  1
  Ni  Ni287  1  0.929886  0.876627  0.711709  1
  Ni  Ni288  1  0.182649  0.065708  0.638691  1
  Ni  Ni289  1  0.392635  0.435733  0.639367  1
  Ni  Ni290  1  0.763007  0.839212  0.675292  1
  Ni  Ni291  1  0.024346  0.030475  0.601502  1
  Ni  Ni292  1  0.736694  0.500595  0.710392  1
  Ni  Ni293  1  0.983389  0.695352  0.639215  1
  Ni  Ni294  1  0.349404  0.098008  0.674113  1
  Ni  Ni295  1  0.136928  0.497306  0.645612  1
  Ni  Ni296  1  0.507595  0.896355  0.680933  1
  Ni  Ni297  1  0.770034  0.090239  0.603737  1
  Ni  Ni298  1  0.985415  0.433037  0.705017  1
  Ni  Ni299  1  0.233908  0.633215  0.634788  1
  Ni  Ni300  1  0.600264  0.035275  0.671893  1
  Ni  Ni301  1  0.148011  0.294527  0.667632  1
  Ni  Ni302  1  0.498840  0.698602  0.703213  1
  Ni  Ni303  1  0.769210  0.890239  0.629904  1
  Ni  Ni304  1  0.961136  0.640510  0.682948  1
  Ni  Ni305  1  0.237290  0.834032  0.609655  1
  Ni  Ni306  1  0.595029  0.238725  0.646646  1
  Ni  Ni307  1  0.089996  0.227363  0.632618  1
  Ni  Ni308  1  0.462489  0.629311  0.667848  1
  Ni  Ni309  1  0.830941  0.036441  0.704050  1
  Ni  Ni310  1  0.460863  0.550951  0.699364  1
  Ni  Ni311  1  0.718575  0.741847  0.625697  1
  Ni  Ni312  1  0.082936  0.147362  0.662568  1
  Ni  Ni313  1  0.653494  0.386677  0.650914  1
  Ni  Ni314  1  0.020836  0.790822  0.687077  1
  Ni  Ni315  1  0.284498  0.983776  0.614784  1
  Ni  Ni316  1  0.888363  0.398382  0.620993  1
  Ni  Ni317  1  0.254901  0.801886  0.659800  1
  Ni  Ni318  1  0.618827  0.209382  0.694041  1
  Ni  Ni319  1  0.116136  0.325569  0.618207  1
  Ni  Ni320  1  0.476731  0.727010  0.654461  1
  Ni  Ni321  1  0.840729  0.135181  0.689886  1
  Ni  Ni322  1  0.967110  0.538203  0.689378  1
  Ni  Ni323  1  0.232462  0.734848  0.621009  1
  Ni  Ni324  1  0.597015  0.138565  0.655717  1
  Ni  Ni325  1  0.145635  0.394173  0.659786  1
  Ni  Ni326  1  0.501752  0.796866  0.691471  1
  Ni  Ni327  1  0.769413  0.988394  0.620515  1
  Ni  Ni328  1  0.205657  0.581861  0.676818  1
  Ni  Ni329  1  0.466059  0.769048  0.601051  1
  Ni  Ni330  1  0.832886  0.181294  0.640980  1
  Ni  Ni331  1  0.908604  0.353621  0.675146  1
  Ni  Ni332  1  0.269770  0.768175  0.711242  1
  Ni  Ni333  1  0.535735  0.952595  0.639274  1
  Ni  Ni334  1  0.689470  0.552751  0.662787  1
  Ni  Ni335  1  0.048612  0.961854  0.698081  1
  Ni  Ni336  1  0.316002  0.150427  0.626388  1
  Ni  Ni337  1  0.419930  0.383725  0.685797  1
  Ni  Ni338  1  0.687326  0.575286  0.612950  1
  Ni  Ni339  1  0.048801  0.980451  0.650008  1
  Ni  Ni340  1  0.652445  0.478922  0.624704  1
  Ni  Ni341  1  0.019163  0.883653  0.662104  1
  Ni  Ni342  1  0.406072  0.288715  0.695953  1
  Ni  Ni343  1  0.351302  0.246047  0.615217  1
  Ni  Ni344  1  0.720298  0.650299  0.651691  1
  Ni  Ni345  1  0.091127  0.059179  0.688312  1
  Ni  Ni346  1  0.916142  0.498349  0.607842  1
  Ni  Ni347  1  0.280151  0.901970  0.645989  1
  Ni  Ni348  1  0.658988  0.304731  0.680413  1
