# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   22.51920559
_cell_length_b   8.81358740
_cell_length_c   54.12187702
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   98.80169282
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   10615.3414264
_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  0.381510  0.058074  0.309277  1
  Zr  Zr2  1  0.737095  0.227790  0.381752  1
  Zr  Zr3  1  0.060485  0.136360  0.346342  1
  Zr  Zr4  1  0.066484  0.602189  0.327167  1
  Zr  Zr5  1  0.416249  0.514249  0.294002  1
  Zr  Zr6  1  0.744713  0.697593  0.363857  1
  Zr  Zr7  1  0.192517  0.356093  0.294615  1
  Zr  Zr8  1  0.547924  0.548869  0.370879  1
  Zr  Zr9  1  0.867197  0.436053  0.332853  1
  Zr  Zr10  1  0.258939  0.305731  0.341276  1
  Zr  Zr11  1  0.573226  0.204275  0.303369  1
  Zr  Zr12  1  0.935567  0.388704  0.380122  1
  Zr  Zr13  1  0.234985  0.775260  0.290091  1
  Zr  Zr14  1  0.590697  0.975222  0.362495  1
  Zr  Zr15  1  0.913372  0.866532  0.324301  1
  Zr  Zr16  1  0.214280  0.873028  0.348497  1
  Zr  Zr17  1  0.533221  0.770772  0.311275  1
  Zr  Zr18  1  0.891363  0.957421  0.384456  1
  Zr  Zr19  1  0.086978  0.034587  0.289182  1
  Zr  Zr20  1  0.440897  0.237740  0.360175  1
  Zr  Zr21  1  0.759587  0.127038  0.320798  1
  Zr  Zr22  1  0.364652  0.613121  0.351533  1
  Zr  Zr23  1  0.680104  0.500690  0.313540  1
  Zr  Zr24  1  0.043654  0.699019  0.387797  1
  Zr  Zr25  1  0.417445  0.326346  0.419583  1
  Zr  Zr26  1  0.774370  0.513465  0.492975  1
  Zr  Zr27  1  0.096540  0.419057  0.456183  1
  Zr  Zr28  1  0.099790  0.894592  0.439393  1
  Zr  Zr29  1  0.421337  0.802049  0.403053  1
  Zr  Zr30  1  0.778815  0.987155  0.475956  1
  Zr  Zr31  1  0.223967  0.640596  0.405243  1
  Zr  Zr32  1  0.581393  0.826746  0.479649  1
  Zr  Zr33  1  0.902610  0.730795  0.442048  1
  Zr  Zr34  1  0.292638  0.582324  0.452568  1
  Zr  Zr35  1  0.615373  0.487120  0.416821  1
  Zr  Zr36  1  0.971482  0.674416  0.489334  1
  Zr  Zr37  1  0.268173  0.074330  0.400033  1
  Zr  Zr38  1  0.625196  0.259074  0.473624  1
  Zr  Zr39  1  0.946311  0.163943  0.436206  1
  Zr  Zr40  1  0.249300  0.149314  0.459094  1
  Zr  Zr41  1  0.570718  0.055741  0.422496  1
  Zr  Zr42  1  0.927977  0.241565  0.495469  1
  Zr  Zr43  1  0.116506  0.335125  0.396048  1
  Zr  Zr44  1  0.472912  0.520247  0.470420  1
  Zr  Zr45  1  0.794525  0.425466  0.432272  1
  Zr  Zr46  1  0.400265  0.887306  0.462968  1
  Zr  Zr47  1  0.722866  0.790877  0.424985  1
  Zr  Zr48  1  0.079188  0.980121  0.499619  1
  Zr  Zr49  1  0.452548  0.608734  0.530492  1
  Zr  Zr50  1  0.810044  0.793769  0.603409  1
  Zr  Zr51  1  0.131675  0.701089  0.567177  1
  Zr  Zr52  1  0.134945  0.176815  0.550313  1
  Zr  Zr53  1  0.457086  0.082231  0.513458  1
  Zr  Zr54  1  0.813882  0.269770  0.586873  1
  Zr  Zr55  1  0.259940  0.921233  0.517167  1
  Zr  Zr56  1  0.616075  0.108862  0.589591  1
  Zr  Zr57  1  0.938774  0.013701  0.553934  1
  Zr  Zr58  1  0.328703  0.864713  0.564485  1
  Zr  Zr59  1  0.650035  0.769070  0.526789  1
  Zr  Zr60  1  0.007561  0.955219  0.601083  1
  Zr  Zr61  1  0.303441  0.354149  0.511012  1
  Zr  Zr62  1  0.660664  0.540233  0.583942  1
  Zr  Zr63  1  0.982129  0.446721  0.547406  1
  Zr  Zr64  1  0.284994  0.431529  0.570266  1
  Zr  Zr65  1  0.606259  0.336875  0.532802  1
  Zr  Zr66  1  0.963219  0.521944  0.606474  1
  Zr  Zr67  1  0.152220  0.615700  0.506910  1
  Zr  Zr68  1  0.508577  0.804942  0.581423  1
  Zr  Zr69  1  0.831183  0.708611  0.543478  1
  Zr  Zr70  1  0.436975  0.170520  0.574087  1
  Zr  Zr71  1  0.758521  0.075497  0.536051  1
  Zr  Zr72  1  0.114932  0.260479  0.610569  1
  Zr  Zr73  1  0.486499  0.898613  0.642520  1
  Zr  Zr74  1  0.814341  0.082058  0.712486  1
  Zr  Zr75  1  0.163465  0.995981  0.679490  1
  Zr  Zr76  1  0.171435  0.460665  0.660330  1
  Zr  Zr77  1  0.494297  0.367881  0.624687  1
  Zr  Zr78  1  0.849795  0.537982  0.697209  1
  Zr  Zr79  1  0.295602  0.205313  0.626440  1
  Zr  Zr80  1  0.658101  0.391671  0.703099  1
  Zr  Zr81  1  0.972049  0.288923  0.665076  1
  Zr  Zr82  1  0.363454  0.158871  0.673725  1
  Zr  Zr83  1  0.683340  0.047150  0.635545  1
  Zr  Zr84  1  0.038435  0.245336  0.712030  1
  Zr  Zr85  1  0.340146  0.637616  0.621672  1
  Zr  Zr86  1  0.698048  0.825188  0.695178  1
  Zr  Zr87  1  0.016886  0.723633  0.657954  1
  Zr  Zr88  1  0.318467  0.728102  0.681402  1
  Zr  Zr89  1  0.640623  0.620709  0.643942  1
  Zr  Zr90  1  0.995234  0.822260  0.716696  1
  Zr  Zr91  1  0.187479  0.896803  0.618907  1
  Zr  Zr92  1  0.550979  0.095283  0.692855  1
  Zr  Zr93  1  0.866543  0.982333  0.654970  1
  Zr  Zr94  1  0.471647  0.468888  0.685600  1
  Zr  Zr95  1  0.790488  0.358137  0.646300  1
  Zr  Zr96  1  0.143490  0.567937  0.716553  1
  Ni  Ni97  1  0.041286  0.742696  0.283136  1
  Ni  Ni98  1  0.400827  0.929287  0.355419  1
  Ni  Ni99  1  0.721428  0.817264  0.316528  1
  Ni  Ni100  1  0.317722  0.078544  0.353305  1
  Ni  Ni101  1  0.637948  0.975727  0.315293  1
  Ni  Ni102  1  0.997750  0.165374  0.391054  1
  Ni  Ni103  1  0.126970  0.583881  0.283708  1
  Ni  Ni104  1  0.484877  0.774198  0.357844  1
  Ni  Ni105  1  0.806554  0.662042  0.318378  1
  Ni  Ni106  1  0.368981  0.332525  0.329376  1
  Ni  Ni107  1  0.684376  0.228478  0.291371  1
  Ni  Ni108  1  0.041634  0.409252  0.362621  1
  Ni  Ni109  1  0.081274  0.328280  0.309203  1
  Ni  Ni110  1  0.438234  0.528019  0.384880  1
  Ni  Ni111  1  0.757441  0.418841  0.345046  1
  Ni  Ni112  1  0.261777  0.057033  0.310821  1
  Ni  Ni113  1  0.623093  0.243698  0.386417  1
  Ni  Ni114  1  0.945306  0.143045  0.350244  1
  Ni  Ni115  1  0.185313  0.597588  0.322946  1
  Ni  Ni116  1  0.535874  0.488409  0.284160  1
  Ni  Ni117  1  0.861605  0.689450  0.359614  1
  Ni  Ni118  1  0.160528  0.105821  0.324185  1
  Ni  Ni119  1  0.476462  0.989782  0.287979  1
  Ni  Ni120  1  0.836978  0.180953  0.360121  1
  Ni  Ni121  1  0.175559  0.121394  0.369661  1
  Ni  Ni122  1  0.496807  0.023172  0.332581  1
  Ni  Ni123  1  0.819755  0.914584  0.295567  1
  Ni  Ni124  1  0.307082  0.826011  0.378315  1
  Ni  Ni125  1  0.629267  0.725806  0.340425  1
  Ni  Ni126  1  0.948277  0.613450  0.304023  1
  Ni  Ni127  1  0.250003  0.586631  0.357384  1
  Ni  Ni128  1  0.567258  0.487379  0.324534  1
  Ni  Ni129  1  0.894659  0.350148  0.288636  1
  Ni  Ni130  1  0.234810  0.362342  0.388573  1
  Ni  Ni131  1  0.556986  0.263856  0.351331  1
  Ni  Ni132  1  0.876545  0.142023  0.317624  1
  Ni  Ni133  1  0.141948  0.615772  0.368395  1
  Ni  Ni134  1  0.465660  0.521761  0.336215  1
  Ni  Ni135  1  0.784559  0.399333  0.297673  1
  Ni  Ni136  1  0.341114  0.326813  0.378168  1
  Ni  Ni137  1  0.660283  0.224615  0.339418  1
  Ni  Ni138  1  0.983068  0.121557  0.305762  1
  Ni  Ni139  1  0.151764  0.372607  0.347388  1
  Ni  Ni140  1  0.475508  0.285352  0.313012  1
  Ni  Ni141  1  0.829021  0.461420  0.384117  1
  Ni  Ni142  1  0.310839  0.300108  0.291549  1
  Ni  Ni143  1  0.651004  0.470096  0.361057  1
  Ni  Ni144  1  0.973646  0.369654  0.324708  1
  Ni  Ni145  1  0.102752  0.878471  0.352890  1
  Ni  Ni146  1  0.423806  0.786060  0.318454  1
  Ni  Ni147  1  0.778502  0.965574  0.389032  1
  Ni  Ni148  1  0.354457  0.772869  0.286449  1
  Ni  Ni149  1  0.702548  0.960814  0.356712  1
  Ni  Ni150  1  0.023725  0.862295  0.322677  1
  Ni  Ni151  1  0.311040  0.818513  0.328913  1
  Ni  Ni152  1  0.626837  0.704000  0.293307  1
  Ni  Ni153  1  0.989943  0.901358  0.366134  1
  Ni  Ni154  1  0.134828  0.833818  0.309635  1
  Ni  Ni155  1  0.491515  0.031206  0.381990  1
  Ni  Ni156  1  0.812935  0.923226  0.343134  1
  Ni  Ni157  1  0.296236  0.556467  0.310791  1
  Ni  Ni158  1  0.644696  0.744980  0.386647  1
  Ni  Ni159  1  0.965400  0.639479  0.349410  1
  Ni  Ni160  1  0.080406  0.014878  0.392520  1
  Ni  Ni161  1  0.436659  0.204495  0.466688  1
  Ni  Ni162  1  0.757952  0.107194  0.428891  1
  Ni  Ni163  1  0.353436  0.356679  0.465209  1
  Ni  Ni164  1  0.675626  0.260360  0.427860  1
  Ni  Ni165  1  0.032583  0.449315  0.501664  1
  Ni  Ni166  1  0.163644  0.865925  0.393804  1
  Ni  Ni167  1  0.519709  0.052564  0.468036  1
  Ni  Ni168  1  0.841354  0.955601  0.430292  1
  Ni  Ni169  1  0.399542  0.598458  0.436991  1
  Ni  Ni170  1  0.719924  0.502511  0.399088  1
  Ni  Ni171  1  0.078288  0.691220  0.473289  1
  Ni  Ni172  1  0.117453  0.623332  0.421966  1
  Ni  Ni173  1  0.474618  0.808910  0.495966  1
  Ni  Ni174  1  0.796194  0.714213  0.458574  1
  Ni  Ni175  1  0.302070  0.338592  0.423478  1
  Ni  Ni176  1  0.658312  0.525297  0.497413  1
  Ni  Ni177  1  0.980501  0.430108  0.460171  1
  Ni  Ni178  1  0.215277  0.883856  0.435277  1
  Ni  Ni179  1  0.538550  0.793226  0.398833  1
  Ni  Ni180  1  0.894225  0.975587  0.471643  1
  Ni  Ni181  1  0.197605  0.380743  0.434051  1
  Ni  Ni182  1  0.519822  0.285888  0.397862  1
  Ni  Ni183  1  0.875188  0.472476  0.470847  1
  Ni  Ni184  1  0.210338  0.398844  0.480404  1
  Ni  Ni185  1  0.531105  0.304983  0.443782  1
  Ni  Ni186  1  0.851422  0.207106  0.405865  1
  Ni  Ni187  1  0.342456  0.104146  0.489563  1
  Ni  Ni188  1  0.664599  0.008852  0.452229  1
  Ni  Ni189  1  0.985500  0.914167  0.414891  1
  Ni  Ni190  1  0.283364  0.863211  0.469966  1
  Ni  Ni191  1  0.606201  0.768786  0.432286  1
  Ni  Ni192  1  0.926738  0.672350  0.394968  1
  Ni  Ni193  1  0.269253  0.639883  0.499942  1
  Ni  Ni194  1  0.590110  0.545811  0.463169  1
  Ni  Ni195  1  0.911374  0.448659  0.426116  1
  Ni  Ni196  1  0.177081  0.895389  0.480602  1
  Ni  Ni197  1  0.498456  0.801443  0.443873  1
  Ni  Ni198  1  0.820255  0.703555  0.405476  1
  Ni  Ni199  1  0.375277  0.607735  0.489349  1
  Ni  Ni200  1  0.697655  0.511128  0.452473  1
  Ni  Ni201  1  0.019109  0.418363  0.415254  1
  Ni  Ni202  1  0.188441  0.653800  0.459649  1
  Ni  Ni203  1  0.509656  0.560753  0.422963  1
  Ni  Ni204  1  0.867010  0.746231  0.496147  1
  Ni  Ni205  1  0.329058  0.569255  0.399121  1
  Ni  Ni206  1  0.685983  0.753843  0.472590  1
  Ni  Ni207  1  0.007190  0.659692  0.435452  1
  Ni  Ni208  1  0.137596  0.159010  0.463645  1
  Ni  Ni209  1  0.458613  0.066681  0.426810  1
  Ni  Ni210  1  0.816227  0.252836  0.500052  1
  Ni  Ni211  1  0.379528  0.061613  0.395392  1
  Ni  Ni212  1  0.737308  0.247764  0.468828  1
  Ni  Ni213  1  0.058537  0.154392  0.432091  1
  Ni  Ni214  1  0.348273  0.095457  0.440708  1
  Ni  Ni215  1  0.668503  0.998640  0.403431  1
  Ni  Ni216  1  0.027080  0.187821  0.477117  1
  Ni  Ni217  1  0.168766  0.126926  0.418191  1
  Ni  Ni218  1  0.526127  0.313806  0.492469  1
  Ni  Ni219  1  0.847335  0.218206  0.454631  1
  Ni  Ni220  1  0.319581  0.842016  0.424603  1
  Ni  Ni221  1  0.678059  0.027077  0.498185  1
  Ni  Ni222  1  0.998587  0.933407  0.461247  1
  Ni  Ni223  1  0.115731  0.297980  0.503258  1
  Ni  Ni224  1  0.473386  0.488437  0.577568  1
  Ni  Ni225  1  0.794757  0.391387  0.539765  1
  Ni  Ni226  1  0.390129  0.639838  0.576098  1
  Ni  Ni227  1  0.711733  0.543324  0.538403  1
  Ni  Ni228  1  0.067896  0.730250  0.612782  1
  Ni  Ni229  1  0.198857  0.146490  0.504847  1
  Ni  Ni230  1  0.555795  0.335554  0.578572  1
  Ni  Ni231  1  0.877968  0.239204  0.541257  1
  Ni  Ni232  1  0.435139  0.881743  0.547893  1
  Ni  Ni233  1  0.756793  0.786767  0.510447  1
  Ni  Ni234  1  0.114093  0.972441  0.584511  1
  Ni  Ni235  1  0.153175  0.904578  0.533262  1
  Ni  Ni236  1  0.511532  0.093285  0.607262  1
  Ni  Ni237  1  0.831913  0.997642  0.569537  1
  Ni  Ni238  1  0.337100  0.620179  0.534824  1
  Ni  Ni239  1  0.692818  0.802690  0.607607  1
  Ni  Ni240  1  0.016228  0.711939  0.571230  1
  Ni  Ni241  1  0.250961  0.165422  0.546335  1
  Ni  Ni242  1  0.573167  0.070639  0.509008  1
  Ni  Ni243  1  0.929225  0.257380  0.582960  1
  Ni  Ni244  1  0.232757  0.662244  0.545284  1
  Ni  Ni245  1  0.553370  0.568812  0.508257  1
  Ni  Ni246  1  0.911801  0.753819  0.581867  1
  Ni  Ni247  1  0.245662  0.681250  0.591685  1
  Ni  Ni248  1  0.566780  0.587048  0.554215  1
  Ni  Ni249  1  0.888969  0.491672  0.516909  1
  Ni  Ni250  1  0.379862  0.387989  0.600610  1
  Ni  Ni251  1  0.700311  0.290953  0.562659  1
  Ni  Ni252  1  0.021082  0.197029  0.526087  1
  Ni  Ni253  1  0.320066  0.146665  0.580404  1
  Ni  Ni254  1  0.641329  0.050083  0.543257  1
  Ni  Ni255  1  0.962113  0.955877  0.506539  1
  Ni  Ni256  1  0.304190  0.922285  0.611670  1
  Ni  Ni257  1  0.625245  0.827195  0.574141  1
  Ni  Ni258  1  0.948098  0.732764  0.536535  1
  Ni  Ni259  1  0.212286  0.177450  0.591246  1
  Ni  Ni260  1  0.533806  0.084741  0.553942  1
  Ni  Ni261  1  0.856123  0.988001  0.517132  1
  Ni  Ni262  1  0.411087  0.892367  0.600885  1
  Ni  Ni263  1  0.732992  0.794450  0.562579  1
  Ni  Ni264  1  0.054371  0.700504  0.525904  1
  Ni  Ni265  1  0.224217  0.936056  0.571134  1
  Ni  Ni266  1  0.545419  0.842030  0.533812  1
  Ni  Ni267  1  0.902504  0.026838  0.607444  1
  Ni  Ni268  1  0.364406  0.849488  0.510283  1
  Ni  Ni269  1  0.721789  0.035179  0.583500  1
  Ni  Ni270  1  0.042992  0.942143  0.546864  1
  Ni  Ni271  1  0.172766  0.441117  0.574488  1
  Ni  Ni272  1  0.494148  0.348208  0.537587  1
  Ni  Ni273  1  0.851865  0.534247  0.611107  1
  Ni  Ni274  1  0.415189  0.342870  0.506418  1
  Ni  Ni275  1  0.772793  0.529355  0.579642  1
  Ni  Ni276  1  0.093838  0.436933  0.542892  1
  Ni  Ni277  1  0.384004  0.377390  0.551820  1
  Ni  Ni278  1  0.705320  0.282005  0.513968  1
  Ni  Ni279  1  0.062690  0.468998  0.588425  1
  Ni  Ni280  1  0.204363  0.407974  0.529403  1
  Ni  Ni281  1  0.562827  0.597170  0.603018  1
  Ni  Ni282  1  0.883123  0.500423  0.565772  1
  Ni  Ni283  1  0.356251  0.122968  0.535609  1
  Ni  Ni284  1  0.711552  0.310152  0.608584  1
  Ni  Ni285  1  0.033936  0.215511  0.572392  1
  Ni  Ni286  1  0.151129  0.581053  0.614115  1
  Ni  Ni287  1  0.509830  0.778711  0.689861  1
  Ni  Ni288  1  0.830601  0.666435  0.651090  1
  Ni  Ni289  1  0.424812  0.933973  0.687945  1
  Ni  Ni290  1  0.746419  0.821652  0.648585  1
  Ni  Ni291  1  0.101719  0.017039  0.722141  1
  Ni  Ni292  1  0.233651  0.429995  0.615500  1
  Ni  Ni293  1  0.593354  0.620206  0.691138  1
  Ni  Ni294  1  0.913693  0.517218  0.653278  1
  Ni  Ni295  1  0.473556  0.177254  0.661400  1
  Ni  Ni296  1  0.793129  0.067868  0.621568  1
  Ni  Ni297  1  0.149754  0.270856  0.697554  1
  Ni  Ni298  1  0.189874  0.186879  0.644125  1
  Ni  Ni299  1  0.546795  0.367314  0.715014  1
  Ni  Ni300  1  0.862157  0.262989  0.677100  1
  Ni  Ni301  1  0.369537  0.906680  0.646744  1
  Ni  Ni302  1  0.695041  0.107744  0.722335  1
  Ni  Ni303  1  0.043756  0.000552  0.683476  1
  Ni  Ni304  1  0.286450  0.450587  0.656163  1
  Ni  Ni305  1  0.608324  0.352261  0.620012  1
  Ni  Ni306  1  0.970274  0.539712  0.695744  1
  Ni  Ni307  1  0.264742  0.956858  0.657226  1
  Ni  Ni308  1  0.586657  0.851002  0.619774  1
  Ni  Ni309  1  0.933554  0.040963  0.696035  1
  Ni  Ni310  1  0.281956  0.980726  0.702117  1
  Ni  Ni311  1  0.602032  0.870236  0.665997  1
  Ni  Ni312  1  0.924265  0.769614  0.628189  1
  Ni  Ni313  1  0.411249  0.681901  0.710697  1
  Ni  Ni314  1  0.734496  0.572789  0.673880  1
  Ni  Ni315  1  0.055856  0.474975  0.636872  1
  Ni  Ni316  1  0.354679  0.452491  0.689129  1
  Ni  Ni317  1  0.674332  0.332045  0.655126  1
  Ni  Ni318  1  0.996709  0.234858  0.617658  1
  Ni  Ni319  1  0.335697  0.242602  0.717996  1
  Ni  Ni320  1  0.663958  0.108538  0.681925  1
  Ni  Ni321  1  0.981049  0.010118  0.648433  1
  Ni  Ni322  1  0.248051  0.476665  0.700637  1
  Ni  Ni323  1  0.570983  0.371310  0.667002  1
  Ni  Ni324  1  0.890230  0.269182  0.628264  1
  Ni  Ni325  1  0.446293  0.196844  0.708745  1
  Ni  Ni326  1  0.765513  0.074149  0.670185  1
  Ni  Ni327  1  0.089317  0.980116  0.638422  1
  Ni  Ni328  1  0.256978  0.225962  0.682155  1
  Ni  Ni329  1  0.580223  0.125919  0.645357  1
  Ni  Ni330  1  0.919527  0.298108  0.715051  1
  Ni  Ni331  1  0.402401  0.134159  0.622237  1
  Ni  Ni332  1  0.755688  0.310631  0.693429  1
  Ni  Ni333  1  0.079900  0.224346  0.659320  1
  Ni  Ni334  1  0.207301  0.738663  0.684457  1
  Ni  Ni335  1  0.528845  0.635290  0.649709  1
  Ni  Ni336  1  0.875666  0.823128  0.720261  1
  Ni  Ni337  1  0.452954  0.629948  0.617372  1
  Ni  Ni338  1  0.807400  0.810159  0.687963  1
  Ni  Ni339  1  0.129007  0.718197  0.653842  1
  Ni  Ni340  1  0.418528  0.672196  0.663170  1
  Ni  Ni341  1  0.739865  0.564721  0.624473  1
  Ni  Ni342  1  0.093874  0.765248  0.696348  1
  Ni  Ni343  1  0.241635  0.694200  0.640576  1
  Ni  Ni344  1  0.604321  0.891967  0.713102  1
  Ni  Ni345  1  0.920373  0.778147  0.677727  1
  Ni  Ni346  1  0.394374  0.414461  0.646398  1
  Ni  Ni347  1  0.754941  0.606815  0.718497  1
  Ni  Ni348  1  0.070938  0.490939  0.682079  1
