# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.58180496
_cell_length_b   29.20551040
_cell_length_c   54.48780294
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   91.56781265
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   10469.9954726
_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  0.097349  0.902235  0.336233  1
  Zr  Zr2  1  0.957680  0.297713  0.372596  1
  Zr  Zr3  1  0.232525  0.516477  0.296584  1
  Zr  Zr4  1  0.676089  0.618966  0.350307  1
  Zr  Zr5  1  0.953376  0.837771  0.277069  1
  Zr  Zr6  1  0.829975  0.228160  0.310329  1
  Zr  Zr7  1  0.066399  0.737229  0.335260  1
  Zr  Zr8  1  0.922614  0.124607  0.372804  1
  Zr  Zr9  1  0.222594  0.343422  0.302151  1
  Zr  Zr10  1  0.711736  0.785525  0.350843  1
  Zr  Zr11  1  0.049966  0.992504  0.278125  1
  Zr  Zr12  1  0.864833  0.400676  0.312246  1
  Zr  Zr13  1  0.856553  0.688193  0.282357  1
  Zr  Zr14  1  0.713845  0.071623  0.316705  1
  Zr  Zr15  1  0.570332  0.465645  0.353691  1
  Zr  Zr16  1  0.354929  0.672519  0.295215  1
  Zr  Zr17  1  0.209938  0.058819  0.332357  1
  Zr  Zr18  1  0.070821  0.453458  0.368938  1
  Zr  Zr19  1  0.737081  0.538121  0.286328  1
  Zr  Zr20  1  0.589655  0.921665  0.323115  1
  Zr  Zr21  1  0.462676  0.316110  0.358813  1
  Zr  Zr22  1  0.451169  0.822577  0.290204  1
  Zr  Zr23  1  0.319441  0.208032  0.326333  1
  Zr  Zr24  1  0.177203  0.601884  0.363501  1
  Zr  Zr25  1  0.670891  0.079114  0.446786  1
  Zr  Zr26  1  0.526685  0.466349  0.485803  1
  Zr  Zr27  1  0.812967  0.684725  0.411195  1
  Zr  Zr28  1  0.248529  0.788427  0.462113  1
  Zr  Zr29  1  0.537125  1.008186  0.387296  1
  Zr  Zr30  1  0.390869  0.400582  0.424319  1
  Zr  Zr31  1  0.633005  0.904657  0.448718  1
  Zr  Zr32  1  0.493419  0.301051  0.484211  1
  Zr  Zr33  1  0.779548  0.519675  0.409781  1
  Zr  Zr34  1  0.285572  0.962658  0.460309  1
  Zr  Zr35  1  0.573256  0.181628  0.384459  1
  Zr  Zr36  1  0.423242  0.565531  0.425537  1
  Zr  Zr37  1  0.421193  0.851919  0.391713  1
  Zr  Zr38  1  0.284339  0.245953  0.427092  1
  Zr  Zr39  1  0.134087  0.632901  0.466500  1
  Zr  Zr40  1  0.919488  0.839711  0.407358  1
  Zr  Zr41  1  0.784181  0.234148  0.442964  1
  Zr  Zr42  1  0.633305  0.620609  0.482045  1
  Zr  Zr43  1  0.313340  0.701432  0.397570  1
  Zr  Zr44  1  0.175133  0.097207  0.433040  1
  Zr  Zr45  1  0.025873  0.482892  0.472203  1
  Zr  Zr46  1  0.032417  0.989612  0.400947  1
  Zr  Zr47  1  0.891335  0.383966  0.437860  1
  Zr  Zr48  1  0.744642  0.770168  0.476022  1
  Zr  Zr49  1  0.240303  0.247850  0.559657  1
  Zr  Zr50  1  0.094046  0.640246  0.596680  1
  Zr  Zr51  1  0.382642  0.860005  0.521864  1
  Zr  Zr52  1  0.818204  0.963707  0.572781  1
  Zr  Zr53  1  0.104486  0.182083  0.498173  1
  Zr  Zr54  1  0.960280  0.569318  0.537190  1
  Zr  Zr55  1  0.207929  0.082901  0.558439  1
  Zr  Zr56  1  0.057916  0.466804  0.599517  1
  Zr  Zr57  1  0.345599  0.685774  0.523667  1
  Zr  Zr58  1  0.851623  0.128757  0.574195  1
  Zr  Zr59  1  0.137752  0.347381  0.499765  1
  Zr  Zr60  1  0.998166  0.743775  0.535258  1
  Zr  Zr61  1  0.997866  0.027823  0.501932  1
  Zr  Zr62  1  0.846991  0.414284  0.541012  1
  Zr  Zr63  1  0.711683  0.808721  0.576618  1
  Zr  Zr64  1  0.497084  0.015531  0.517476  1
  Zr  Zr65  1  0.346832  0.402479  0.556885  1
  Zr  Zr66  1  0.209978  0.796513  0.592263  1
  Zr  Zr67  1  0.886529  0.878264  0.507955  1
  Zr  Zr68  1  0.739837  0.264466  0.546116  1
  Zr  Zr69  1  0.598755  0.658820  0.583029  1
  Zr  Zr70  1  0.605298  0.165540  0.511773  1
  Zr  Zr71  1  0.456038  0.551225  0.550936  1
  Zr  Zr72  1  0.317831  0.947000  0.586406  1
  Zr  Zr73  1  0.801196  0.420272  0.673647  1
  Zr  Zr74  1  0.677796  0.810661  0.706907  1
  Zr  Zr75  1  0.955082  0.029466  0.633669  1
  Zr  Zr76  1  0.398646  0.131955  0.687392  1
  Zr  Zr77  1  0.673491  0.350719  0.611380  1
  Zr  Zr78  1  0.533822  0.746197  0.647743  1
  Zr  Zr79  1  0.766338  0.247756  0.671730  1
  Zr  Zr80  1  0.581205  0.655928  0.705851  1
  Zr  Zr81  1  0.919436  0.862907  0.633133  1
  Zr  Zr82  1  0.408577  0.305010  0.681825  1
  Zr  Zr83  1  0.708558  0.523825  0.611172  1
  Zr  Zr84  1  0.564772  0.911203  0.648716  1
  Zr  Zr85  1  0.560350  0.194974  0.615038  1
  Zr  Zr86  1  0.421234  0.589613  0.651619  1
  Zr  Zr87  1  0.276242  0.975913  0.688761  1
  Zr  Zr88  1  0.060839  0.182787  0.630285  1
  Zr  Zr89  1  0.917326  0.576809  0.667271  1
  Zr  Zr90  1  0.774618  0.960239  0.701620  1
  Zr  Zr91  1  0.453968  0.046548  0.620475  1
  Zr  Zr92  1  0.311730  0.440400  0.657643  1
  Zr  Zr93  1  0.180002  0.825855  0.693772  1
  Zr  Zr94  1  0.168495  0.332322  0.625163  1
  Zr  Zr95  1  0.041516  0.726767  0.660862  1
  Zr  Zr96  1  0.894090  0.110311  0.697649  1
  Ni  Ni97  1  0.960319  0.568596  0.323210  1
  Ni  Ni98  1  0.815878  0.955145  0.361231  1
  Ni  Ni99  1  0.113331  0.175599  0.284955  1
  Ni  Ni100  1  0.754489  0.871401  0.363171  1
  Ni  Ni101  1  0.047182  0.086798  0.288229  1
  Ni  Ni102  1  0.901525  0.485576  0.323820  1
  Ni  Ni103  1  0.021796  0.651314  0.323092  1
  Ni  Ni104  1  0.876412  0.038879  0.361174  1
  Ni  Ni105  1  0.173934  0.259555  0.286791  1
  Ni  Ni106  1  0.772834  0.848573  0.317778  1
  Ni  Ni107  1  0.642554  0.244680  0.351238  1
  Ni  Ni108  1  0.906774  0.460459  0.278915  1
  Ni  Ni109  1  0.990299  0.675130  0.367980  1
  Ni  Ni110  1  0.269307  0.903171  0.288986  1
  Ni  Ni111  1  0.139103  0.279845  0.332067  1
  Ni  Ni112  1  0.083355  0.826402  0.363217  1
  Ni  Ni113  1  0.385151  0.046830  0.288341  1
  Ni  Ni114  1  0.229544  0.440075  0.324842  1
  Ni  Ni115  1  0.688936  0.696717  0.324049  1
  Ni  Ni116  1  0.551140  0.085765  0.359809  1
  Ni  Ni117  1  0.849341  0.311605  0.286703  1
  Ni  Ni118  1  0.425466  0.589826  0.274784  1
  Ni  Ni119  1  0.279316  0.974770  0.312694  1
  Ni  Ni120  1  0.135102  0.367105  0.347644  1
  Ni  Ni121  1  0.055247  0.604659  0.284137  1
  Ni  Ni122  1  0.916102  0.991733  0.322674  1
  Ni  Ni123  1  0.776653  0.385435  0.359843  1
  Ni  Ni124  1  0.156097  0.754230  0.286122  1
  Ni  Ni125  1  0.009986  0.140522  0.323772  1
  Ni  Ni126  1  0.865522  0.532974  0.362090  1
  Ni  Ni127  1  0.428128  0.756309  0.319729  1
  Ni  Ni128  1  0.286298  0.143146  0.356408  1
  Ni  Ni129  1  0.571146  0.374942  0.284208  1
  Ni  Ni130  1  0.346588  0.765938  0.366363  1
  Ni  Ni131  1  0.633552  0.983890  0.291311  1
  Ni  Ni132  1  0.498874  0.382501  0.328357  1
  Ni  Ni133  1  0.354667  0.680721  0.345797  1
  Ni  Ni134  1  0.633312  0.899308  0.273872  1
  Ni  Ni135  1  0.509913  0.286705  0.309145  1
  Ni  Ni136  1  0.418538  0.841353  0.340922  1
  Ni  Ni137  1  0.277647  0.238299  0.375875  1
  Ni  Ni138  1  0.558448  0.458418  0.303346  1
  Ni  Ni139  1  0.653010  0.706655  0.368993  1
  Ni  Ni140  1  0.921265  0.921590  0.296894  1
  Ni  Ni141  1  0.809328  0.320252  0.329781  1
  Ni  Ni142  1  0.115595  0.816314  0.317860  1
  Ni  Ni143  1  0.971640  0.205583  0.354642  1
  Ni  Ni144  1  0.246266  0.424191  0.281983  1
  Ni  Ni145  1  0.333360  0.597162  0.319249  1
  Ni  Ni146  1  0.192925  0.984380  0.358034  1
  Ni  Ni147  1  0.483253  0.206168  0.285090  1
  Ni  Ni148  1  0.438822  0.926218  0.366167  1
  Ni  Ni149  1  0.739762  0.145378  0.290222  1
  Ni  Ni150  1  0.580394  0.539159  0.327075  1
  Ni  Ni151  1  0.533475  0.741782  0.273547  1
  Ni  Ni152  1  0.377804  0.127690  0.307084  1
  Ni  Ni153  1  0.233936  0.521713  0.344977  1
  Ni  Ni154  1  0.690885  0.617271  0.303293  1
  Ni  Ni155  1  0.548955  1.003880  0.339451  1
  Ni  Ni156  1  0.405669  0.396536  0.376411  1
  Ni  Ni157  1  0.791642  0.769267  0.302123  1
  Ni  Ni158  1  0.651040  0.158591  0.336065  1
  Ni  Ni159  1  0.502099  0.548499  0.374856  1
  Ni  Ni160  1  0.528948  0.735878  0.436699  1
  Ni  Ni161  1  0.390048  0.131446  0.472365  1
  Ni  Ni162  1  0.676465  0.349619  0.398565  1
  Ni  Ni163  1  0.331462  0.047540  0.473270  1
  Ni  Ni164  1  0.618305  0.265634  0.398499  1
  Ni  Ni165  1  0.468362  0.652273  0.438169  1
  Ni  Ni166  1  0.586794  0.819786  0.435892  1
  Ni  Ni167  1  0.449839  0.214759  0.471080  1
  Ni  Ni168  1  0.736205  0.433304  0.397494  1
  Ni  Ni169  1  0.354305  0.024964  0.427587  1
  Ni  Ni170  1  0.215373  0.409779  0.467892  1
  Ni  Ni171  1  0.500534  0.627660  0.393634  1
  Ni  Ni172  1  0.564575  0.842346  0.481620  1
  Ni  Ni173  1  0.854277  0.062576  0.406339  1
  Ni  Ni174  1  0.702246  0.457318  0.442155  1
  Ni  Ni175  1  0.658186  1.001846  0.473943  1
  Ni  Ni176  1  0.945543  0.220236  0.398955  1
  Ni  Ni177  1  0.796694  0.608174  0.437342  1
  Ni  Ni178  1  0.259864  0.865830  0.435116  1
  Ni  Ni179  1  0.120950  0.258544  0.472174  1
  Ni  Ni180  1  0.406564  0.477201  0.398510  1
  Ni  Ni181  1  0.985664  0.754617  0.385800  1
  Ni  Ni182  1  0.846138  0.148133  0.420998  1
  Ni  Ni183  1  0.698958  0.536355  0.460395  1
  Ni  Ni184  1  0.626405  0.771932  0.398164  1
  Ni  Ni185  1  0.489764  0.166414  0.433094  1
  Ni  Ni186  1  0.338762  0.553033  0.472956  1
  Ni  Ni187  1  0.717446  0.920504  0.400566  1
  Ni  Ni188  1  0.578117  0.313383  0.436845  1
  Ni  Ni189  1  0.429588  0.700958  0.475727  1
  Ni  Ni190  1  0.997306  0.924939  0.432164  1
  Ni  Ni191  1  0.858020  0.319081  0.468788  1
  Ni  Ni192  1  0.143690  0.537646  0.394670  1
  Ni  Ni193  1  0.921050  0.942950  0.476812  1
  Ni  Ni194  1  0.210342  0.161023  0.401384  1
  Ni  Ni195  1  0.058797  0.547670  0.441031  1
  Ni  Ni196  1  0.926994  0.847787  0.458401  1
  Ni  Ni197  1  0.216003  0.067498  0.383481  1
  Ni  Ni198  1  0.067987  0.462771  0.420219  1
  Ni  Ni199  1  0.991920  0.019821  0.450763  1
  Ni  Ni200  1  0.849229  0.404193  0.489861  1
  Ni  Ni201  1  0.135420  0.622783  0.415468  1
  Ni  Ni202  1  0.231935  0.881515  0.478723  1
  Ni  Ni203  1  0.521121  0.101016  0.403484  1
  Ni  Ni204  1  0.364526  0.487484  0.443631  1
  Ni  Ni205  1  0.687584  0.985906  0.430394  1
  Ni  Ni206  1  0.552488  0.379160  0.466474  1
  Ni  Ni207  1  0.838582  0.597616  0.392276  1
  Ni  Ni208  1  0.904782  0.765574  0.432934  1
  Ni  Ni209  1  0.765483  0.160368  0.468292  1
  Ni  Ni210  1  0.052208  0.379062  0.394478  1
  Ni  Ni211  1  0.014061  0.101644  0.476175  1
  Ni  Ni212  1  0.300785  0.320152  0.401979  1
  Ni  Ni213  1  0.152826  0.706823  0.440856  1
  Ni  Ni214  1  0.085669  0.908257  0.384536  1
  Ni  Ni215  1  0.948680  0.302714  0.420361  1
  Ni  Ni216  1  0.799921  0.689363  0.459326  1
  Ni  Ni217  1  0.256213  0.782958  0.414403  1
  Ni  Ni218  1  0.118669  0.177584  0.449774  1
  Ni  Ni219  1  0.968764  0.563971  0.489384  1
  Ni  Ni220  1  0.361186  0.938865  0.412815  1
  Ni  Ni221  1  0.218216  0.330388  0.449311  1
  Ni  Ni222  1  0.073604  0.719595  0.487774  1
  Ni  Ni223  1  0.102224  0.912554  0.547278  1
  Ni  Ni224  1  0.954706  0.298813  0.585412  1
  Ni  Ni225  1  0.241123  0.516986  0.511611  1
  Ni  Ni226  1  0.894966  0.215128  0.586482  1
  Ni  Ni227  1  0.181332  0.433673  0.512896  1
  Ni  Ni228  1  0.044377  0.828646  0.548084  1
  Ni  Ni229  1  0.162809  0.996159  0.545807  1
  Ni  Ni230  1  0.012866  0.382798  0.585478  1
  Ni  Ni231  1  0.299709  0.600892  0.510706  1
  Ni  Ni232  1  0.928925  0.191114  0.541821  1
  Ni  Ni233  1  0.776894  0.585856  0.577638  1
  Ni  Ni234  1  0.066596  0.806086  0.502356  1
  Ni  Ni235  1  0.130638  0.020772  0.590342  1
  Ni  Ni236  1  0.415798  0.238653  0.516084  1
  Ni  Ni237  1  0.276866  0.623467  0.556389  1
  Ni  Ni238  1  0.224607  0.171231  0.585466  1
  Ni  Ni239  1  0.510221  0.389888  0.511802  1
  Ni  Ni240  1  0.371307  0.782602  0.548860  1
  Ni  Ni241  1  0.834477  0.040258  0.546634  1
  Ni  Ni242  1  0.685629  0.428196  0.585021  1
  Ni  Ni243  1  0.972985  0.646586  0.510034  1
  Ni  Ni244  1  0.557567  0.928837  0.496203  1
  Ni  Ni245  1  0.412955  0.318044  0.534665  1
  Ni  Ni246  1  0.269985  0.709567  0.571162  1
  Ni  Ni247  1  0.201583  0.947474  0.508249  1
  Ni  Ni248  1  0.053054  0.335049  0.547131  1
  Ni  Ni249  1  0.913725  0.727928  0.583410  1
  Ni  Ni250  1  0.292409  0.095399  0.511020  1
  Ni  Ni251  1  0.141407  0.482018  0.550882  1
  Ni  Ni252  1  0.004766  0.876500  0.585813  1
  Ni  Ni253  1  0.572374  0.100762  0.542945  1
  Ni  Ni254  1  0.420830  0.487409  0.582592  1
  Ni  Ni255  1  0.710121  0.705481  0.507164  1
  Ni  Ni256  1  0.487482  0.110786  0.589306  1
  Ni  Ni257  1  0.773151  0.329351  0.515188  1
  Ni  Ni258  1  0.633865  0.723493  0.551812  1
  Ni  Ni259  1  0.495751  0.025649  0.568508  1
  Ni  Ni260  1  0.781942  0.244239  0.494115  1
  Ni  Ni261  1  0.639251  0.628611  0.533214  1
  Ni  Ni262  1  0.563184  0.185661  0.563758  1
  Ni  Ni263  1  0.415168  0.580934  0.600495  1
  Ni  Ni264  1  0.704177  0.800645  0.525575  1
  Ni  Ni265  1  0.792589  0.050816  0.591700  1
  Ni  Ni266  1  0.078683  0.269272  0.517502  1
  Ni  Ni267  1  0.943587  0.662526  0.553582  1
  Ni  Ni268  1  0.266645  0.160948  0.540346  1
  Ni  Ni269  1  0.110051  0.547416  0.580492  1
  Ni  Ni270  1  0.399236  0.766917  0.505253  1
  Ni  Ni271  1  0.478346  0.941609  0.543121  1
  Ni  Ni272  1  0.330386  0.328280  0.581997  1
  Ni  Ni273  1  0.617110  0.546788  0.507801  1
  Ni  Ni274  1  0.578963  0.269370  0.589498  1
  Ni  Ni275  1  0.865688  0.488064  0.515684  1
  Ni  Ni276  1  0.726389  0.882858  0.551042  1
  Ni  Ni277  1  0.662408  0.084461  0.494592  1
  Ni  Ni278  1  0.512502  0.470848  0.534202  1
  Ni  Ni279  1  0.374959  0.865474  0.569573  1
  Ni  Ni280  1  0.831251  0.959069  0.524650  1
  Ni  Ni281  1  0.682491  0.345718  0.563615  1
  Ni  Ni282  1  0.545502  0.740175  0.599440  1
  Ni  Ni283  1  0.932213  0.112077  0.523581  1
  Ni  Ni284  1  0.785034  0.500299  0.562979  1
  Ni  Ni285  1  0.645507  0.893815  0.598176  1
  Ni  Ni286  1  0.670852  0.079835  0.660766  1
  Ni  Ni287  1  0.517840  0.472833  0.699021  1
  Ni  Ni288  1  0.815293  0.693287  0.622745  1
  Ni  Ni289  1  0.457237  0.388877  0.697185  1
  Ni  Ni290  1  0.754760  0.609553  0.622803  1
  Ni  Ni291  1  0.609375  0.997118  0.660884  1
  Ni  Ni292  1  0.729647  0.162856  0.660156  1
  Ni  Ni293  1  0.583989  0.561634  0.695747  1
  Ni  Ni294  1  0.876682  0.777031  0.620805  1
  Ni  Ni295  1  0.492069  0.368587  0.651910  1
  Ni  Ni296  1  0.361864  0.745261  0.694990  1
  Ni  Ni297  1  0.640872  0.973302  0.615996  1
  Ni  Ni298  1  0.724398  0.187973  0.705061  1
  Ni  Ni299  1  0.988617  0.403752  0.632738  1
  Ni  Ni300  1  0.858337  0.799859  0.666198  1
  Ni  Ni301  1  0.781830  0.336827  0.697274  1
  Ni  Ni302  1  0.080031  0.562667  0.624168  1
  Ni  Ni303  1  0.942236  0.951715  0.659927  1
  Ni  Ni304  1  0.401628  0.208357  0.659134  1
  Ni  Ni305  1  0.246020  0.601601  0.695635  1
  Ni  Ni306  1  0.547816  0.822030  0.620759  1
  Ni  Ni307  1  0.129072  0.099933  0.609120  1
  Ni  Ni308  1  0.980131  0.489841  0.647912  1
  Ni  Ni309  1  0.839529  0.879165  0.681853  1
  Ni  Ni310  1  0.765649  0.115458  0.621886  1
  Ni  Ni311  1  0.621185  0.507910  0.660204  1
  Ni  Ni312  1  0.475075  0.894202  0.697854  1
  Ni  Ni313  1  0.854518  0.262997  0.624133  1
  Ni  Ni314  1  0.715070  0.656699  0.661302  1
  Ni  Ni315  1  0.575924  0.043773  0.699840  1
  Ni  Ni316  1  0.132297  0.265931  0.655619  1
  Ni  Ni317  1  0.997619  0.664542  0.692665  1
  Ni  Ni318  1  0.284583  0.882494  0.617613  1
  Ni  Ni319  1  0.060025  0.273490  0.699768  1
  Ni  Ni320  1  0.344873  0.505286  0.627569  1
  Ni  Ni321  1  0.203043  0.892123  0.664247  1
  Ni  Ni322  1  0.072723  0.190014  0.680630  1
  Ni  Ni323  1  0.353524  0.410133  0.608101  1
  Ni  Ni324  1  0.212633  0.807078  0.643054  1
  Ni  Ni325  1  0.121259  0.361727  0.674832  1
  Ni  Ni326  1  0.997859  0.749124  0.710104  1
  Ni  Ni327  1  0.276504  0.967711  0.638180  1
  Ni  Ni328  1  0.384905  0.224241  0.701993  1
  Ni  Ni329  1  0.659531  0.442849  0.629334  1
  Ni  Ni330  1  0.515576  0.832118  0.666116  1
  Ni  Ni331  1  0.821844  0.328180  0.654195  1
  Ni  Ni332  1  0.709906  0.726842  0.687082  1
  Ni  Ni333  1  0.978161  0.941777  0.614983  1
  Ni  Ni334  1  0.050778  0.109273  0.656901  1
  Ni  Ni335  1  0.891409  0.503054  0.693754  1
  Ni  Ni336  1  0.192349  0.722214  0.617810  1
  Ni  Ni337  1  0.147918  0.442264  0.698886  1
  Ni  Ni338  1  0.438247  0.664052  0.625942  1
  Ni  Ni339  1  0.297812  0.051270  0.664728  1
  Ni  Ni340  1  0.225502  0.251896  0.607565  1
  Ni  Ni341  1  0.082216  0.644552  0.644525  1
  Ni  Ni342  1  0.940286  0.031161  0.680683  1
  Ni  Ni343  1  0.397235  0.126719  0.638999  1
  Ni  Ni344  1  0.253367  0.520742  0.676892  1
  Ni  Ni345  1  0.097697  0.906650  0.710429  1
  Ni  Ni346  1  0.496069  0.281327  0.636332  1
  Ni  Ni347  1  0.351855  0.673662  0.671282  1
  Ni  Ni348  1  0.205706  0.058606  0.709192  1
