# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.64177073
_cell_length_b   23.60048360
_cell_length_c   51.62614660
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   91.33564401
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   9308.21923009
_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  0.150698  0.893491  0.304702  1
  Zr  Zr2  1  0.933046  0.630317  0.345486  1
  Zr  Zr3  1  0.641909  0.133593  0.263275  1
  Zr  Zr4  1  0.540820  0.229190  0.332070  1
  Zr  Zr5  1  0.149455  0.976957  0.371258  1
  Zr  Zr6  1  0.738132  0.479924  0.289855  1
  Zr  Zr7  1  0.019830  0.151104  0.316079  1
  Zr  Zr8  1  0.636061  0.891726  0.358073  1
  Zr  Zr9  1  0.225946  0.399844  0.278185  1
  Zr  Zr10  1  0.669694  0.975531  0.315695  1
  Zr  Zr11  1  0.444852  0.714707  0.357629  1
  Zr  Zr12  1  0.191492  0.233318  0.277005  1
  Zr  Zr13  1  0.030900  0.245285  0.375094  1
  Zr  Zr14  1  0.452296  0.758967  0.292544  1
  Zr  Zr15  1  0.235040  0.498465  0.331763  1
  Zr  Zr16  1  0.648289  0.875082  0.267344  1
  Zr  Zr17  1  0.430345  0.613001  0.304122  1
  Zr  Zr18  1  0.215634  0.354223  0.342999  1
  Zr  Zr19  1  0.166217  0.038795  0.287214  1
  Zr  Zr20  1  0.944944  0.774973  0.331433  1
  Zr  Zr21  1  0.730876  0.514608  0.373110  1
  Zr  Zr22  1  0.523541  0.086612  0.342932  1
  Zr  Zr23  1  0.932460  0.598112  0.263919  1
  Zr  Zr24  1  0.721324  0.335136  0.300640  1
  Zr  Zr25  1  0.508996  0.115437  0.428680  1
  Zr  Zr26  1  0.140111  0.863392  0.468211  1
  Zr  Zr27  1  0.716939  0.372695  0.387823  1
  Zr  Zr28  1  0.714377  0.459625  0.454827  1
  Zr  Zr29  1  0.497796  0.199717  0.496475  1
  Zr  Zr30  1  0.933571  0.716526  0.412223  1
  Zr  Zr31  1  0.200931  0.375875  0.442094  1
  Zr  Zr32  1  0.978427  0.117272  0.484757  1
  Zr  Zr33  1  0.421974  0.632592  0.399326  1
  Zr  Zr34  1  0.023299  0.199156  0.442941  1
  Zr  Zr35  1  0.635082  0.941488  0.482301  1
  Zr  Zr36  1  0.229838  0.456936  0.400295  1
  Zr  Zr37  1  0.213761  0.477677  0.498283  1
  Zr  Zr38  1  0.648414  0.989543  0.415410  1
  Zr  Zr39  1  0.435499  0.732348  0.455101  1
  Zr  Zr40  1  0.012961  0.101511  0.384701  1
  Zr  Zr41  1  0.634016  0.846233  0.425396  1
  Zr  Zr42  1  0.412667  0.589923  0.468001  1
  Zr  Zr43  1  0.520788  0.258200  0.416336  1
  Zr  Zr44  1  0.134327  0.005449  0.457171  1
  Zr  Zr45  1  0.931184  0.750667  0.496928  1
  Zr  Zr46  1  0.700775  0.315868  0.469421  1
  Zr  Zr47  1  0.134892  0.832913  0.384335  1
  Zr  Zr48  1  0.919331  0.573793  0.426875  1
  Zr  Zr49  1  0.692348  0.349712  0.553419  1
  Zr  Zr50  1  0.473500  0.092701  0.596008  1
  Zr  Zr51  1  0.909034  0.609577  0.511763  1
  Zr  Zr52  1  0.897782  0.693845  0.579534  1
  Zr  Zr53  1  0.689665  0.436618  0.620425  1
  Zr  Zr54  1  0.266872  0.945838  0.539982  1
  Zr  Zr55  1  0.383177  0.610199  0.565316  1
  Zr  Zr56  1  0.176671  0.352375  0.607930  1
  Zr  Zr57  1  0.771942  0.867762  0.525923  1
  Zr  Zr58  1  0.205775  0.433465  0.566157  1
  Zr  Zr59  1  0.985246  0.176728  0.608882  1
  Zr  Zr60  1  0.428608  0.692031  0.523475  1
  Zr  Zr61  1  0.394038  0.707888  0.623605  1
  Zr  Zr62  1  0.994251  0.219393  0.540232  1
  Zr  Zr63  1  0.772811  0.963064  0.582747  1
  Zr  Zr64  1  0.193013  0.331668  0.509971  1
  Zr  Zr65  1  0.971502  0.076957  0.553112  1
  Zr  Zr66  1  0.758465  0.819662  0.592765  1
  Zr  Zr67  1  0.705937  0.493489  0.538842  1
  Zr  Zr68  1  0.487718  0.235482  0.581359  1
  Zr  Zr69  1  0.271851  0.976721  0.623641  1
  Zr  Zr70  1  0.885574  0.551154  0.591963  1
  Zr  Zr71  1  0.475830  0.058602  0.511299  1
  Zr  Zr72  1  0.272748  0.803824  0.551085  1
  Zr  Zr73  1  0.864761  0.580304  0.676237  1
  Zr  Zr74  1  0.668439  0.329300  0.718356  1
  Zr  Zr75  1  0.257642  0.832653  0.636867  1
  Zr  Zr76  1  0.256505  0.917882  0.702475  1
  Zr  Zr77  1  0.763691  0.676660  0.745125  1
  Zr  Zr78  1  0.473811  0.178915  0.662705  1
  Zr  Zr79  1  0.736389  0.832670  0.694316  1
  Zr  Zr80  1  0.214981  0.575516  0.731202  1
  Zr  Zr81  1  0.961158  0.094437  0.650527  1
  Zr  Zr82  1  0.387346  0.657381  0.692059  1
  Zr  Zr83  1  0.180546  0.409404  0.730018  1
  Zr  Zr84  1  0.770544  0.916060  0.650841  1
  Zr  Zr85  1  0.757063  0.932257  0.740880  1
  Zr  Zr86  1  0.190812  0.455096  0.665226  1
  Zr  Zr87  1  0.976148  0.196092  0.704095  1
  Zr  Zr88  1  0.375442  0.564162  0.633183  1
  Zr  Zr89  1  0.171499  0.310729  0.676455  1
  Zr  Zr90  1  0.954314  0.049815  0.715680  1
  Zr  Zr91  1  0.882329  0.723217  0.665301  1
  Zr  Zr92  1  0.685097  0.474137  0.707581  1
  Zr  Zr93  1  0.474191  0.211115  0.744278  1
  Zr  Zr94  1  0.241983  0.767140  0.719281  1
  Zr  Zr95  1  0.675774  0.294618  0.635109  1
  Zr  Zr96  1  0.462129  0.034321  0.676843  1
  Ni  Ni97  1  0.159416  0.940902  0.254082  1
  Ni  Ni98  1  0.939973  0.684670  0.295506  1
  Ni  Ni99  1  0.727040  0.425579  0.337509  1
  Ni  Ni100  1  0.422729  0.955345  0.279233  1
  Ni  Ni101  1  0.210349  0.696134  0.320478  1
  Ni  Ni102  1  1.000785  0.437314  0.362329  1
  Ni  Ni103  1  0.249659  0.164552  0.355213  1
  Ni  Ni104  1  0.650581  0.672728  0.272188  1
  Ni  Ni105  1  0.456300  0.415136  0.313584  1
  Ni  Ni106  1  0.342093  0.983978  0.324615  1
  Ni  Ni107  1  0.116071  0.721311  0.366322  1
  Ni  Ni108  1  0.844301  0.225950  0.282931  1
  Ni  Ni109  1  0.353397  0.147877  0.306953  1
  Ni  Ni110  1  0.965807  0.891168  0.349432  1
  Ni  Ni111  1  0.550454  0.395814  0.267221  1
  Ni  Ni112  1  0.989658  0.135248  0.266291  1
  Ni  Ni113  1  0.477384  0.871866  0.309141  1
  Ni  Ni114  1  0.261842  0.610788  0.350078  1
  Ni  Ni115  1  0.816162  0.992931  0.367866  1
  Ni  Ni116  1  0.404698  0.497694  0.285731  1
  Ni  Ni117  1  0.207311  0.247288  0.326966  1
  Ni  Ni118  1  0.308772  0.132486  0.262690  1
  Ni  Ni119  1  0.809462  0.870539  0.308892  1
  Ni  Ni120  1  0.590776  0.611296  0.350308  1
  Ni  Ni121  1  0.898279  0.955493  0.278891  1
  Ni  Ni122  1  0.672678  0.694965  0.319560  1
  Ni  Ni123  1  0.453150  0.435917  0.361632  1
  Ni  Ni124  1  0.794248  0.164511  0.356327  1
  Ni  Ni125  1  0.224783  0.674384  0.272700  1
  Ni  Ni126  1  0.997956  0.416688  0.313594  1
  Ni  Ni127  1  0.857623  0.067851  0.338813  1
  Ni  Ni128  1  0.262068  0.573578  0.262181  1
  Ni  Ni129  1  0.044204  0.316738  0.298455  1
  Ni  Ni130  1  0.830500  0.059773  0.292235  1
  Ni  Ni131  1  0.625200  0.795563  0.335224  1
  Ni  Ni132  1  0.408708  0.535868  0.377281  1
  Ni  Ni133  1  0.183994  0.067875  0.338415  1
  Ni  Ni134  1  0.591887  0.569011  0.262699  1
  Ni  Ni135  1  0.385538  0.315029  0.300058  1
  Ni  Ni136  1  0.495452  0.059504  0.292661  1
  Ni  Ni137  1  0.287179  0.800644  0.334862  1
  Ni  Ni138  1  0.073082  0.540108  0.376513  1
  Ni  Ni139  1  0.998224  0.981407  0.324199  1
  Ni  Ni140  1  0.763686  0.711492  0.366133  1
  Ni  Ni141  1  0.523680  0.226474  0.282454  1
  Ni  Ni142  1  0.693051  0.146853  0.308843  1
  Ni  Ni143  1  0.319598  0.896910  0.350492  1
  Ni  Ni144  1  0.900857  0.397780  0.267116  1
  Ni  Ni145  1  0.976592  0.852359  0.264940  1
  Ni  Ni146  1  0.757167  0.592411  0.304893  1
  Ni  Ni147  1  0.544884  0.335712  0.345935  1
  Ni  Ni148  1  0.705727  0.264497  0.373515  1
  Ni  Ni149  1  0.123414  0.776646  0.289292  1
  Ni  Ni150  1  0.911749  0.518449  0.329872  1
  Ni  Ni151  1  0.313196  0.851249  0.265480  1
  Ni  Ni152  1  0.099838  0.593767  0.305135  1
  Ni  Ni153  1  0.883797  0.337618  0.346547  1
  Ni  Ni154  1  0.361369  0.263297  0.372023  1
  Ni  Ni155  1  0.782460  0.776024  0.287087  1
  Ni  Ni156  1  0.566392  0.517854  0.329330  1
  Ni  Ni157  1  0.491040  0.992894  0.367674  1
  Ni  Ni158  1  0.072394  0.500381  0.284382  1
  Ni  Ni159  1  0.882730  0.247728  0.327496  1
  Ni  Ni160  1  0.522294  0.172653  0.380628  1
  Ni  Ni161  1  0.139145  0.918854  0.419446  1
  Ni  Ni162  1  0.924033  0.662116  0.461692  1
  Ni  Ni163  1  0.793711  0.182143  0.404782  1
  Ni  Ni164  1  0.409266  0.927422  0.444574  1
  Ni  Ni165  1  0.197895  0.672753  0.486090  1
  Ni  Ni166  1  0.428755  0.393958  0.479805  1
  Ni  Ni167  1  0.867128  0.909006  0.395816  1
  Ni  Ni168  1  0.649947  0.650949  0.437382  1
  Ni  Ni169  1  0.692397  0.201798  0.451450  1
  Ni  Ni170  1  0.311214  0.952607  0.491662  1
  Ni  Ni171  1  0.902312  0.462693  0.408646  1
  Ni  Ni172  1  0.529561  0.369170  0.434101  1
  Ni  Ni173  1  0.304631  0.109484  0.475324  1
  Ni  Ni174  1  0.750146  0.625452  0.391534  1
  Ni  Ni175  1  0.046937  0.354445  0.392244  1
  Ni  Ni176  1  0.841677  0.098299  0.432263  1
  Ni  Ni177  1  0.470802  0.841426  0.470207  1
  Ni  Ni178  1  0.169995  0.220327  0.492543  1
  Ni  Ni179  1  0.603377  0.735611  0.407834  1
  Ni  Ni180  1  0.384797  0.478610  0.450401  1
  Ni  Ni181  1  0.371512  0.354480  0.392411  1
  Ni  Ni182  1  0.166234  0.098674  0.432322  1
  Ni  Ni183  1  0.800156  0.844581  0.473505  1
  Ni  Ni184  1  0.242930  0.180938  0.403513  1
  Ni  Ni185  1  0.871863  0.926914  0.444440  1
  Ni  Ni186  1  0.652974  0.672201  0.485787  1
  Ni  Ni187  1  0.978465  0.395737  0.480712  1
  Ni  Ni188  1  0.416988  0.910379  0.396576  1
  Ni  Ni189  1  0.197834  0.652119  0.438016  1
  Ni  Ni190  1  0.024131  0.295554  0.464949  1
  Ni  Ni191  1  0.456962  0.810681  0.380255  1
  Ni  Ni192  1  0.241752  0.552765  0.422035  1
  Ni  Ni193  1  0.197234  0.279918  0.420487  1
  Ni  Ni194  1  0.801057  0.024110  0.461494  1
  Ni  Ni195  1  0.604942  0.775725  0.499906  1
  Ni  Ni196  1  0.357221  0.290885  0.465724  1
  Ni  Ni197  1  0.792151  0.806682  0.380891  1
  Ni  Ni198  1  0.575316  0.548585  0.423219  1
  Ni  Ni199  1  0.863250  0.283383  0.419708  1
  Ni  Ni200  1  0.474385  0.026216  0.460226  1
  Ni  Ni201  1  0.274372  0.776135  0.498122  1
  Ni  Ni202  1  0.339906  0.195773  0.450265  1
  Ni  Ni203  1  0.969365  0.943205  0.493090  1
  Ni  Ni204  1  0.548009  0.454110  0.408162  1
  Ni  Ni205  1  0.880444  0.377830  0.434639  1
  Ni  Ni206  1  0.656878  0.112579  0.475692  1
  Ni  Ni207  1  0.101864  0.634993  0.391786  1
  Ni  Ni208  1  0.341931  0.082091  0.384553  1
  Ni  Ni209  1  0.957556  0.826355  0.427610  1
  Ni  Ni210  1  0.737572  0.570213  0.470201  1
  Ni  Ni211  1  0.888797  0.497441  0.496179  1
  Ni  Ni212  1  0.317318  0.010142  0.414911  1
  Ni  Ni213  1  0.110657  0.753575  0.453258  1
  Ni  Ni214  1  0.683414  0.081088  0.386822  1
  Ni  Ni215  1  0.301823  0.826817  0.427344  1
  Ni  Ni216  1  0.081412  0.571292  0.470813  1
  Ni  Ni217  1  0.543543  0.495556  0.495296  1
  Ni  Ni218  1  0.976100  0.010157  0.413472  1
  Ni  Ni219  1  0.764478  0.752472  0.452866  1
  Ni  Ni220  1  0.844331  0.221037  0.492734  1
  Ni  Ni221  1  0.276484  0.734629  0.407308  1
  Ni  Ni222  1  0.059489  0.478633  0.450335  1
  Ni  Ni223  1  0.703353  0.404676  0.504128  1
  Ni  Ni224  1  0.482994  0.147170  0.546532  1
  Ni  Ni225  1  0.268009  0.890502  0.588871  1
  Ni  Ni226  1  0.977948  0.415379  0.528451  1
  Ni  Ni227  1  0.757081  0.158337  0.570842  1
  Ni  Ni228  1  0.541255  0.900146  0.612463  1
  Ni  Ni229  1  0.612580  0.627258  0.603521  1
  Ni  Ni230  1  0.209085  0.136547  0.522138  1
  Ni  Ni231  1  0.997932  0.881874  0.563634  1
  Ni  Ni232  1  0.877155  0.440171  0.574158  1
  Ni  Ni233  1  0.657124  0.183587  0.616715  1
  Ni  Ni234  1  0.102458  0.699761  0.532927  1
  Ni  Ni235  1  0.714099  0.607557  0.556819  1
  Ni  Ni236  1  0.504271  0.346621  0.599588  1
  Ni  Ni237  1  0.095832  0.856629  0.516537  1
  Ni  Ni238  1  0.236780  0.589005  0.515709  1
  Ni  Ni239  1  0.021919  0.330717  0.557840  1
  Ni  Ni240  1  0.803353  0.073552  0.600395  1
  Ni  Ni241  1  0.359583  0.454881  0.615996  1
  Ni  Ni242  1  0.936081  0.967834  0.537981  1
  Ni  Ni243  1  0.565089  0.711001  0.575964  1
  Ni  Ni244  1  0.562440  0.588284  0.515513  1
  Ni  Ni245  1  0.347260  0.330685  0.557905  1
  Ni  Ni246  1  0.130142  0.074720  0.600865  1
  Ni  Ni247  1  0.428282  0.413615  0.527547  1
  Ni  Ni248  1  0.209256  0.157184  0.570200  1
  Ni  Ni249  1  0.988601  0.898975  0.611641  1
  Ni  Ni250  1  0.163383  0.628383  0.604729  1
  Ni  Ni251  1  0.753986  0.137094  0.522434  1
  Ni  Ni252  1  0.535035  0.882337  0.563790  1
  Ni  Ni253  1  0.209272  0.529423  0.587768  1
  Ni  Ni254  1  0.802069  0.033559  0.508303  1
  Ni  Ni255  1  0.605963  0.785155  0.546710  1
  Ni  Ni256  1  0.382560  0.513799  0.543318  1
  Ni  Ni257  1  0.165225  0.256552  0.586177  1
  Ni  Ni258  1  0.948922  -0.001668  0.627945  1
  Ni  Ni259  1  0.543239  0.525991  0.588568  1
  Ni  Ni260  1  0.132658  0.033128  0.510115  1
  Ni  Ni261  1  0.932737  0.783057  0.547988  1
  Ni  Ni262  1  0.049465  0.518420  0.542534  1
  Ni  Ni263  1  0.831612  0.260703  0.585017  1
  Ni  Ni264  1  0.615142  0.002147  0.627414  1
  Ni  Ni265  1  0.526287  0.431536  0.573620  1
  Ni  Ni266  1  0.305308  0.174352  0.616409  1
  Ni  Ni267  1  0.750156  0.696722  0.532527  1
  Ni  Ni268  1  0.066570  0.613482  0.557989  1
  Ni  Ni269  1  0.858493  0.355189  0.600077  1
  Ni  Ni270  1  0.437680  0.866029  0.515120  1
  Ni  Ni271  1  0.517966  0.311885  0.512073  1
  Ni  Ni272  1  0.296383  0.055704  0.554975  1
  Ni  Ni273  1  0.089481  0.799243  0.593303  1
  Ni  Ni274  1  0.064612  0.727259  0.623625  1
  Ni  Ni275  1  0.669345  0.239096  0.538033  1
  Ni  Ni276  1  0.449634  0.982879  0.580544  1
  Ni  Ni277  1  0.863245  0.313780  0.512950  1
  Ni  Ni278  1  0.642582  0.056820  0.555335  1
  Ni  Ni279  1  0.431284  0.799149  0.594823  1
  Ni  Ni280  1  0.723391  0.728271  0.621346  1
  Ni  Ni281  1  0.325537  0.238018  0.537425  1
  Ni  Ni282  1  0.104859  0.982480  0.580802  1
  Ni  Ni283  1  0.035044  0.454859  0.615841  1
  Ni  Ni284  1  0.606733  0.964672  0.534688  1
  Ni  Ni285  1  0.240597  0.710676  0.575971  1
  Ni  Ni286  1  0.883581  0.636756  0.627658  1
  Ni  Ni287  1  0.679599  0.383634  0.670715  1
  Ni  Ni288  1  0.467092  0.124620  0.712655  1
  Ni  Ni289  1  0.156123  0.644824  0.652958  1
  Ni  Ni290  1  0.950289  0.394091  0.694629  1
  Ni  Ni291  1  0.756175  0.136287  0.736008  1
  Ni  Ni292  1  0.013896  0.854213  0.729570  1
  Ni  Ni293  1  0.405711  0.371932  0.645892  1
  Ni  Ni294  1  0.195977  0.113259  0.687688  1
  Ni  Ni295  1  0.052810  0.661249  0.701117  1
  Ni  Ni296  1  0.856000  0.413438  0.740983  1
  Ni  Ni297  1  0.440918  0.919155  0.658386  1
  Ni  Ni298  1  0.063708  0.825987  0.683451  1
  Ni  Ni299  1  0.563072  0.583434  0.725182  1
  Ni  Ni300  1  0.290192  0.088046  0.641889  1
  Ni  Ni301  1  0.591406  0.815890  0.640627  1
  Ni  Ni302  1  0.198545  0.562112  0.681263  1
  Ni  Ni303  1  1.001877  0.311482  0.722477  1
  Ni  Ni304  1  0.415870  0.673501  0.742011  1
  Ni  Ni305  1  0.144925  0.198416  0.658120  1
  Ni  Ni306  1  0.930022  0.936256  0.699316  1
  Ni  Ni307  1  0.916210  0.816364  0.640515  1
  Ni  Ni308  1  0.523909  0.561179  0.680627  1
  Ni  Ni309  1  0.334131  0.308817  0.723835  1
  Ni  Ni310  1  0.611834  0.645313  0.652060  1
  Ni  Ni311  1  0.408549  0.392496  0.694617  1
  Ni  Ni312  1  0.181767  0.134684  0.735489  1
  Ni  Ni313  1  0.478667  0.854788  0.730280  1
  Ni  Ni314  1  0.953423  0.373362  0.646594  1
  Ni  Ni315  1  0.734612  0.114052  0.688622  1
  Ni  Ni316  1  0.574954  0.750068  0.716874  1
  Ni  Ni317  1  0.997982  0.273401  0.630946  1
  Ni  Ni318  1  0.781022  0.012929  0.673092  1
  Ni  Ni319  1  0.546621  0.741913  0.670217  1
  Ni  Ni320  1  0.362196  0.492475  0.709688  1
  Ni  Ni321  1  0.144489  0.235522  0.746006  1
  Ni  Ni322  1  0.913055  0.750353  0.715911  1
  Ni  Ni323  1  0.333531  0.269189  0.631706  1
  Ni  Ni324  1  0.118452  0.008907  0.673259  1
  Ni  Ni325  1  0.222312  0.741846  0.669296  1
  Ni  Ni326  1  0.020426  0.494241  0.708162  1
  Ni  Ni327  1  0.814678  0.240154  0.745494  1
  Ni  Ni328  1  0.714053  0.663406  0.699586  1
  Ni  Ni329  1  0.505653  0.411426  0.741090  1
  Ni  Ni330  1  0.088072  0.912875  0.657459  1
  Ni  Ni331  1  0.408535  0.829556  0.683845  1
  Ni  Ni332  1  0.883475  0.583348  0.725912  1
  Ni  Ni333  1  0.642624  0.097414  0.642100  1
  Ni  Ni334  1  0.700452  0.544935  0.634781  1
  Ni  Ni335  1  0.494836  0.290770  0.678345  1
  Ni  Ni336  1  0.282804  0.033196  0.718766  1
  Ni  Ni337  1  0.431005  0.958693  0.742306  1
  Ni  Ni338  1  0.861488  0.473640  0.662310  1
  Ni  Ni339  1  0.649584  0.216762  0.703300  1
  Ni  Ni340  1  0.044695  0.546074  0.636255  1
  Ni  Ni341  1  0.840212  0.291355  0.678886  1
  Ni  Ni342  1  0.624761  0.032679  0.720902  1
  Ni  Ni343  1  0.096495  0.958420  0.742728  1
  Ni  Ni344  1  0.522667  0.471467  0.661640  1
  Ni  Ni345  1  0.306762  0.215428  0.703067  1
  Ni  Ni346  1  0.096226  0.676436  0.745409  1
  Ni  Ni347  1  0.816131  0.197892  0.657920  1
  Ni  Ni348  1  0.595900  0.937473  0.699356  1
