# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.63358372
_cell_length_b   12.73017518
_cell_length_c   51.40923164
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.35220492
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   10997.1657425
_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  0.502529  0.230553  0.314104  1
  Zr  Zr2  1  0.388157  0.897909  0.385524  1
  Zr  Zr3  1  0.002529  0.230553  0.314104  1
  Zr  Zr4  1  0.888157  0.897909  0.385524  1
  Zr  Zr5  1  0.834058  0.278708  0.407760  1
  Zr  Zr6  1  0.961994  0.605794  0.336842  1
  Zr  Zr7  1  0.334058  0.278708  0.407760  1
  Zr  Zr8  1  0.461994  0.605794  0.336842  1
  Zr  Zr9  1  0.811833  0.910216  0.308298  1
  Zr  Zr10  1  0.683618  0.582329  0.379841  1
  Zr  Zr11  1  0.311833  0.910216  0.308298  1
  Zr  Zr12  1  0.183618  0.582329  0.379841  1
  Zr  Zr13  1  0.541351  0.593094  0.415098  1
  Zr  Zr14  1  0.664500  0.930063  0.343614  1
  Zr  Zr15  1  0.041351  0.593094  0.415098  1
  Zr  Zr16  1  0.164500  0.930063  0.343614  1
  Zr  Zr17  1  0.684213  0.336052  0.335933  1
  Zr  Zr18  1  0.563763  0.998002  0.407859  1
  Zr  Zr19  1  0.184213  0.336052  0.335933  1
  Zr  Zr20  1  0.063763  0.998002  0.407859  1
  Zr  Zr21  1  0.658437  0.178411  0.385748  1
  Zr  Zr22  1  0.772374  0.520872  0.313943  1
  Zr  Zr23  1  0.158437  0.178411  0.385748  1
  Zr  Zr24  1  0.272374  0.520872  0.313943  1
  Zr  Zr25  1  0.909608  0.063469  0.337723  1
  Zr  Zr26  1  0.789898  0.729986  0.407828  1
  Zr  Zr27  1  0.409608  0.063469  0.337723  1
  Zr  Zr28  1  0.289898  0.729986  0.407828  1
  Zr  Zr29  1  0.435234  0.444455  0.385239  1
  Zr  Zr30  1  0.560058  0.776846  0.315641  1
  Zr  Zr31  1  0.935234  0.444455  0.385239  1
  Zr  Zr32  1  0.060058  0.776846  0.315641  1
  Zr  Zr33  1  0.267773  0.563302  0.456997  1
  Zr  Zr34  1  0.146976  0.229873  0.528232  1
  Zr  Zr35  1  0.767773  0.563302  0.456997  1
  Zr  Zr36  1  0.646976  0.229873  0.528232  1
  Zr  Zr37  1  0.592244  0.611837  0.550644  1
  Zr  Zr38  1  0.712960  0.945924  0.479160  1
  Zr  Zr39  1  0.092244  0.611837  0.550644  1
  Zr  Zr40  1  0.212960  0.945924  0.479160  1
  Zr  Zr41  1  0.559953  0.248741  0.450318  1
  Zr  Zr42  1  0.439211  0.916059  0.521756  1
  Zr  Zr43  1  0.059953  0.248741  0.450318  1
  Zr  Zr44  1  0.939211  0.916059  0.521756  1
  Zr  Zr45  1  0.299779  0.926804  0.556958  1
  Zr  Zr46  1  0.420779  0.259207  0.485567  1
  Zr  Zr47  1  0.799779  0.926804  0.556958  1
  Zr  Zr48  1  0.920779  0.259207  0.485567  1
  Zr  Zr49  1  0.442893  0.664226  0.479189  1
  Zr  Zr50  1  0.321765  0.331396  0.550644  1
  Zr  Zr51  1  0.942893  0.664226  0.479189  1
  Zr  Zr52  1  0.821765  0.331396  0.550644  1
  Zr  Zr53  1  0.417051  0.511120  0.528289  1
  Zr  Zr54  1  0.538171  0.844047  0.456888  1
  Zr  Zr55  1  0.917051  0.511120  0.528289  1
  Zr  Zr56  1  0.038171  0.844047  0.456888  1
  Zr  Zr57  1  0.669001  0.396085  0.479415  1
  Zr  Zr58  1  0.548128  0.062747  0.550784  1
  Zr  Zr59  1  0.169001  0.396085  0.479415  1
  Zr  Zr60  1  0.048128  0.062747  0.550784  1
  Zr  Zr61  1  0.191214  0.779217  0.528046  1
  Zr  Zr62  1  0.312092  0.112484  0.456378  1
  Zr  Zr63  1  0.691214  0.779217  0.528046  1
  Zr  Zr64  1  0.812092  0.112484  0.456378  1
  Zr  Zr65  1  0.024879  0.897627  0.599511  1
  Zr  Zr66  1  0.899651  0.570031  0.670299  1
  Zr  Zr67  1  0.524879  0.897627  0.599511  1
  Zr  Zr68  1  0.399651  0.570031  0.670299  1
  Zr  Zr69  1  0.357446  0.940379  0.693297  1
  Zr  Zr70  1  0.472581  0.275939  0.621813  1
  Zr  Zr71  1  0.857446  0.940379  0.693297  1
  Zr  Zr72  1  0.972581  0.275939  0.621813  1
  Zr  Zr73  1  0.317444  0.582008  0.592962  1
  Zr  Zr74  1  0.194926  0.245366  0.663986  1
  Zr  Zr75  1  0.817444  0.582008  0.592962  1
  Zr  Zr76  1  0.694926  0.245366  0.663986  1
  Zr  Zr77  1  0.046044  0.264186  0.699174  1
  Zr  Zr78  1  0.176206  0.595176  0.629467  1
  Zr  Zr79  1  0.546044  0.264186  0.699174  1
  Zr  Zr80  1  0.676206  0.595176  0.629467  1
  Zr  Zr81  1  0.201268  0.997567  0.621616  1
  Zr  Zr82  1  0.085143  0.655335  0.691915  1
  Zr  Zr83  1  0.701268  0.997567  0.621616  1
  Zr  Zr84  1  0.585143  0.655335  0.691915  1
  Zr  Zr85  1  0.174698  0.839568  0.670618  1
  Zr  Zr86  1  0.295944  0.177953  0.599481  1
  Zr  Zr87  1  0.674698  0.839568  0.670618  1
  Zr  Zr88  1  0.795944  0.177953  0.599481  1
  Zr  Zr89  1  0.423765  0.730115  0.621572  1
  Zr  Zr90  1  0.303599  0.388424  0.691045  1
  Zr  Zr91  1  0.923765  0.730115  0.621572  1
  Zr  Zr92  1  0.803599  0.388424  0.691045  1
  Zr  Zr93  1  0.948458  0.112154  0.670187  1
  Zr  Zr94  1  0.070185  0.445985  0.599565  1
  Zr  Zr95  1  0.448458  0.112154  0.670187  1
  Zr  Zr96  1  0.570185  0.445985  0.599565  1
  Ni  Ni97  1  0.919264  0.254060  0.360369  1
  Ni  Ni98  1  0.065698  0.564677  0.292395  1
  Ni  Ni99  1  0.419264  0.254060  0.360369  1
  Ni  Ni100  1  0.565698  0.564677  0.292395  1
  Ni  Ni101  1  0.425428  0.766612  0.432370  1
  Ni  Ni102  1  0.542805  0.100720  0.360303  1
  Ni  Ni103  1  0.925428  0.766612  0.432370  1
  Ni  Ni104  1  0.042805  0.100720  0.360303  1
  Ni  Ni105  1  0.935892  0.726160  0.292841  1
  Ni  Ni106  1  0.795367  0.410942  0.360354  1
  Ni  Ni107  1  0.435892  0.726160  0.292841  1
  Ni  Ni108  1  0.295367  0.410942  0.360354  1
  Ni  Ni109  1  0.425462  0.678051  0.383848  1
  Ni  Ni110  1  0.548146  0.002201  0.314010  1
  Ni  Ni111  1  0.925462  0.678051  0.383848  1
  Ni  Ni112  1  0.048146  0.002201  0.314010  1
  Ni  Ni113  1  0.923480  0.825505  0.339066  1
  Ni  Ni114  1  0.799647  0.498327  0.409484  1
  Ni  Ni115  1  0.423480  0.825505  0.339066  1
  Ni  Ni116  1  0.299647  0.498327  0.409484  1
  Ni  Ni117  1  0.645898  0.145532  0.334623  1
  Ni  Ni118  1  0.530502  0.806440  0.405139  1
  Ni  Ni119  1  0.145898  0.145532  0.334623  1
  Ni  Ni120  1  0.030502  0.806440  0.405139  1
  Ni  Ni121  1  0.693063  0.368376  0.388375  1
  Ni  Ni122  1  0.821056  0.697782  0.316564  1
  Ni  Ni123  1  0.193063  0.368376  0.388375  1
  Ni  Ni124  1  0.321056  0.697782  0.316564  1
  Ni  Ni125  1  0.777015  0.024630  0.354370  1
  Ni  Ni126  1  0.656673  0.693779  0.426456  1
  Ni  Ni127  1  0.277015  0.024630  0.354370  1
  Ni  Ni128  1  0.156673  0.693779  0.426456  1
  Ni  Ni129  1  0.836710  0.288566  0.319919  1
  Ni  Ni130  1  0.718576  0.951479  0.392267  1
  Ni  Ni131  1  0.336710  0.288566  0.319919  1
  Ni  Ni132  1  0.218576  0.951479  0.392267  1
  Ni  Ni133  1  0.504615  0.223723  0.401275  1
  Ni  Ni134  1  0.628974  0.557613  0.333166  1
  Ni  Ni135  1  0.004615  0.223723  0.401275  1
  Ni  Ni136  1  0.128974  0.557613  0.333166  1
  Ni  Ni137  1  0.570307  0.374145  0.410781  1
  Ni  Ni138  1  0.695213  0.710089  0.340579  1
  Ni  Ni139  1  0.070307  0.374145  0.410781  1
  Ni  Ni140  1  0.195213  0.710089  0.340579  1
  Ni  Ni141  1  0.767829  0.135649  0.314051  1
  Ni  Ni142  1  0.652629  0.802068  0.383146  1
  Ni  Ni143  1  0.267829  0.135649  0.314051  1
  Ni  Ni144  1  0.152629  0.802068  0.383146  1
  Ni  Ni145  1  0.697490  0.265778  0.432727  1
  Ni  Ni146  1  0.822023  0.596065  0.360446  1
  Ni  Ni147  1  0.197490  0.265778  0.432727  1
  Ni  Ni148  1  0.322023  0.596065  0.360446  1
  Ni  Ni149  1  0.637313  0.247696  0.293379  1
  Ni  Ni150  1  0.526518  0.909111  0.360656  1
  Ni  Ni151  1  0.137313  0.247696  0.293379  1
  Ni  Ni152  1  0.026518  0.909111  0.360656  1
  Ni  Ni153  1  0.675521  0.465412  0.430170  1
  Ni  Ni154  1  0.797840  0.799128  0.357873  1
  Ni  Ni155  1  0.175521  0.465412  0.430170  1
  Ni  Ni156  1  0.297840  0.799128  0.357873  1
  Ni  Ni157  1  0.667114  0.038327  0.295950  1
  Ni  Ni158  1  0.549957  0.709450  0.363786  1
  Ni  Ni159  1  0.167114  0.038327  0.295950  1
  Ni  Ni160  1  0.049957  0.709450  0.363786  1
  Ni  Ni161  1  0.796689  0.087254  0.404262  1
  Ni  Ni162  1  0.912344  0.423084  0.334139  1
  Ni  Ni163  1  0.296689  0.087254  0.404262  1
  Ni  Ni164  1  0.412344  0.423084  0.334139  1
  Ni  Ni165  1  0.545681  0.413526  0.319430  1
  Ni  Ni166  1  0.424845  0.089008  0.389045  1
  Ni  Ni167  1  0.045681  0.413526  0.319430  1
  Ni  Ni168  1  0.924845  0.089008  0.389045  1
  Ni  Ni169  1  0.545278  0.304486  0.358314  1
  Ni  Ni170  1  0.426190  0.973243  0.430236  1
  Ni  Ni171  1  0.045278  0.304486  0.358314  1
  Ni  Ni172  1  0.926190  0.973243  0.430236  1
  Ni  Ni173  1  0.795014  0.203100  0.362921  1
  Ni  Ni174  1  0.925412  0.523175  0.293977  1
  Ni  Ni175  1  0.295014  0.203100  0.362921  1
  Ni  Ni176  1  0.425412  0.523175  0.293977  1
  Ni  Ni177  1  0.569522  0.477725  0.368009  1
  Ni  Ni178  1  0.693291  0.818896  0.298573  1
  Ni  Ni179  1  0.069522  0.477725  0.368009  1
  Ni  Ni180  1  0.193291  0.818896  0.298573  1
  Ni  Ni181  1  0.680209  0.587617  0.503904  1
  Ni  Ni182  1  0.801271  0.920941  0.432574  1
  Ni  Ni183  1  0.180209  0.587617  0.503904  1
  Ni  Ni184  1  0.301271  0.920941  0.432574  1
  Ni  Ni185  1  0.183950  0.099844  0.574816  1
  Ni  Ni186  1  0.305055  0.432651  0.503780  1
  Ni  Ni187  1  0.683950  0.099844  0.574816  1
  Ni  Ni188  1  0.805055  0.432651  0.503780  1
  Ni  Ni189  1  0.676120  0.075947  0.432538  1
  Ni  Ni190  1  0.555194  0.742411  0.503865  1
  Ni  Ni191  1  0.176120  0.075947  0.432538  1
  Ni  Ni192  1  0.055194  0.742411  0.503865  1
  Ni  Ni193  1  0.183407  0.009539  0.526683  1
  Ni  Ni194  1  0.304661  0.342817  0.455399  1
  Ni  Ni195  1  0.683407  0.009539  0.526683  1
  Ni  Ni196  1  0.804661  0.342817  0.455399  1
  Ni  Ni197  1  0.676774  0.166584  0.480561  1
  Ni  Ni198  1  0.555646  0.832367  0.551983  1
  Ni  Ni199  1  0.176774  0.166584  0.480561  1
  Ni  Ni200  1  0.055646  0.832367  0.551983  1
  Ni  Ni201  1  0.410412  0.471853  0.476430  1
  Ni  Ni202  1  0.289607  0.139366  0.547626  1
  Ni  Ni203  1  0.910412  0.471853  0.476430  1
  Ni  Ni204  1  0.789607  0.139366  0.547626  1
  Ni  Ni205  1  0.449547  0.703140  0.530984  1
  Ni  Ni206  1  0.570167  0.036472  0.459707  1
  Ni  Ni207  1  0.949547  0.703140  0.530984  1
  Ni  Ni208  1  0.070167  0.036472  0.459707  1
  Ni  Ni209  1  0.536308  0.358948  0.497713  1
  Ni  Ni210  1  0.414905  0.025954  0.569016  1
  Ni  Ni211  1  0.036308  0.358948  0.497713  1
  Ni  Ni212  1  0.914905  0.025954  0.569016  1
  Ni  Ni213  1  0.596774  0.618461  0.463341  1
  Ni  Ni214  1  0.475026  0.285623  0.534268  1
  Ni  Ni215  1  0.096774  0.618461  0.463341  1
  Ni  Ni216  1  0.975026  0.285623  0.534268  1
  Ni  Ni217  1  0.263519  0.556651  0.544437  1
  Ni  Ni218  1  0.384799  0.889873  0.473066  1
  Ni  Ni219  1  0.763519  0.556651  0.544437  1
  Ni  Ni220  1  0.884799  0.889873  0.473066  1
  Ni  Ni221  1  0.327399  0.708221  0.552956  1
  Ni  Ni222  1  0.448044  0.041627  0.481496  1
  Ni  Ni223  1  0.827399  0.708221  0.552956  1
  Ni  Ni224  1  0.948044  0.041627  0.481496  1
  Ni  Ni225  1  0.532704  0.466961  0.454810  1
  Ni  Ni226  1  0.411940  0.133953  0.525904  1
  Ni  Ni227  1  0.032704  0.466961  0.454810  1
  Ni  Ni228  1  0.911940  0.133953  0.525904  1
  Ni  Ni229  1  0.455048  0.598524  0.575106  1
  Ni  Ni230  1  0.576294  0.932285  0.503812  1
  Ni  Ni231  1  0.955048  0.598524  0.575106  1
  Ni  Ni232  1  0.076294  0.932285  0.503812  1
  Ni  Ni233  1  0.404535  0.576776  0.432364  1
  Ni  Ni234  1  0.283834  0.243150  0.503586  1
  Ni  Ni235  1  0.904535  0.576776  0.432364  1
  Ni  Ni236  1  0.783834  0.243150  0.503586  1
  Ni  Ni237  1  0.432669  0.798500  0.572804  1
  Ni  Ni238  1  0.553938  0.131819  0.501626  1
  Ni  Ni239  1  0.932669  0.798500  0.572804  1
  Ni  Ni240  1  0.053938  0.131819  0.501626  1
  Ni  Ni241  1  0.427613  0.377314  0.434341  1
  Ni  Ni242  1  0.306312  0.043952  0.505649  1
  Ni  Ni243  1  0.927613  0.377314  0.434341  1
  Ni  Ni244  1  0.806312  0.043952  0.505649  1
  Ni  Ni245  1  0.554898  0.420783  0.547153  1
  Ni  Ni246  1  0.676087  0.754010  0.475949  1
  Ni  Ni247  1  0.054898  0.420783  0.547153  1
  Ni  Ni248  1  0.176087  0.754010  0.475949  1
  Ni  Ni249  1  0.304808  0.754663  0.460255  1
  Ni  Ni250  1  0.183966  0.421550  0.531679  1
  Ni  Ni251  1  0.804808  0.754663  0.460255  1
  Ni  Ni252  1  0.683966  0.421550  0.531679  1
  Ni  Ni253  1  0.305290  0.639590  0.501451  1
  Ni  Ni254  1  0.183713  0.307088  0.572536  1
  Ni  Ni255  1  0.805290  0.639590  0.501451  1
  Ni  Ni256  1  0.683713  0.307088  0.572536  1
  Ni  Ni257  1  0.554987  0.535462  0.506091  1
  Ni  Ni258  1  0.675990  0.869307  0.434857  1
  Ni  Ni259  1  0.054987  0.535462  0.506091  1
  Ni  Ni260  1  0.175990  0.869307  0.434857  1
  Ni  Ni261  1  0.323693  0.816302  0.509736  1
  Ni  Ni262  1  0.444619  0.149848  0.438304  1
  Ni  Ni263  1  0.823693  0.816302  0.509736  1
  Ni  Ni264  1  0.944619  0.149848  0.438304  1
  Ni  Ni265  1  0.438892  0.922588  0.646911  1
  Ni  Ni266  1  0.558708  0.254471  0.574778  1
  Ni  Ni267  1  0.938892  0.922588  0.646911  1
  Ni  Ni268  1  0.058708  0.254471  0.574778  1
  Ni  Ni269  1  0.924411  0.450811  0.713460  1
  Ni  Ni270  1  0.061798  0.767016  0.646221  1
  Ni  Ni271  1  0.424411  0.450811  0.713460  1
  Ni  Ni272  1  0.561798  0.767016  0.646221  1
  Ni  Ni273  1  0.434259  0.408877  0.575057  1
  Ni  Ni274  1  0.315937  0.074330  0.646976  1
  Ni  Ni275  1  0.934259  0.408877  0.575057  1
  Ni  Ni276  1  0.815937  0.074330  0.646976  1
  Ni  Ni277  1  0.938008  0.353265  0.667425  1
  Ni  Ni278  1  0.061293  0.676576  0.598118  1
  Ni  Ni279  1  0.438008  0.353265  0.667425  1
  Ni  Ni280  1  0.561293  0.676576  0.598118  1
  Ni  Ni281  1  0.434105  0.494808  0.623763  1
  Ni  Ni282  1  0.309200  0.165463  0.693888  1
  Ni  Ni283  1  0.934105  0.494808  0.623763  1
  Ni  Ni284  1  0.809200  0.165463  0.693888  1
  Ni  Ni285  1  0.165996  0.808299  0.618684  1
  Ni  Ni286  1  0.040318  0.475605  0.690544  1
  Ni  Ni287  1  0.665996  0.808299  0.618684  1
  Ni  Ni288  1  0.540318  0.475605  0.690544  1
  Ni  Ni289  1  0.213552  0.030704  0.673018  1
  Ni  Ni290  1  0.329867  0.369012  0.602624  1
  Ni  Ni291  1  0.713552  0.030704  0.673018  1
  Ni  Ni292  1  0.829867  0.369012  0.602624  1
  Ni  Ni293  1  0.289152  0.696353  0.640419  1
  Ni  Ni294  1  0.167078  0.354155  0.708917  1
  Ni  Ni295  1  0.789152  0.696353  0.640419  1
  Ni  Ni296  1  0.667078  0.354155  0.708917  1
  Ni  Ni297  1  0.354633  0.951892  0.605975  1
  Ni  Ni298  1  0.239481  0.611228  0.678890  1
  Ni  Ni299  1  0.854633  0.951892  0.605975  1
  Ni  Ni300  1  0.739481  0.611228  0.678890  1
  Ni  Ni301  1  0.022961  0.884722  0.687194  1
  Ni  Ni302  1  0.141494  0.223886  0.615092  1
  Ni  Ni303  1  0.522961  0.884722  0.687194  1
  Ni  Ni304  1  0.641494  0.223886  0.615092  1
  Ni  Ni305  1  0.090995  0.038240  0.693080  1
  Ni  Ni306  1  0.207136  0.374311  0.624769  1
  Ni  Ni307  1  0.590995  0.038240  0.693080  1
  Ni  Ni308  1  0.707136  0.374311  0.624769  1
  Ni  Ni309  1  0.289115  0.801114  0.596856  1
  Ni  Ni310  1  0.166582  0.465520  0.667639  1
  Ni  Ni311  1  0.789115  0.801114  0.596856  1
  Ni  Ni312  1  0.666582  0.465520  0.667639  1
  Ni  Ni313  1  0.220927  0.927168  0.713795  1
  Ni  Ni314  1  0.334100  0.264988  0.646416  1
  Ni  Ni315  1  0.720927  0.927168  0.713795  1
  Ni  Ni316  1  0.834100  0.264988  0.646416  1
  Ni  Ni317  1  0.162296  0.909947  0.574653  1
  Ni  Ni318  1  0.037588  0.578545  0.646551  1
  Ni  Ni319  1  0.662296  0.909947  0.574653  1
  Ni  Ni320  1  0.537588  0.578545  0.646551  1
  Ni  Ni321  1  0.189346  0.136341  0.711991  1
  Ni  Ni322  1  0.309086  0.466616  0.644270  1
  Ni  Ni323  1  0.689346  0.136341  0.711991  1
  Ni  Ni324  1  0.809086  0.466616  0.644270  1
  Ni  Ni325  1  0.184497  0.709874  0.577303  1
  Ni  Ni326  1  0.063667  0.376888  0.649253  1
  Ni  Ni327  1  0.684497  0.709874  0.577303  1
  Ni  Ni328  1  0.563667  0.376888  0.649253  1
  Ni  Ni329  1  0.314070  0.759260  0.689144  1
  Ni  Ni330  1  0.434299  0.087517  0.618523  1
  Ni  Ni331  1  0.814070  0.759260  0.689144  1
  Ni  Ni332  1  0.934299  0.087517  0.618523  1
  Ni  Ni333  1  0.063394  0.087333  0.602799  1
  Ni  Ni334  1  0.945888  0.752310  0.672313  1
  Ni  Ni335  1  0.563394  0.087333  0.602799  1
  Ni  Ni336  1  0.445888  0.752310  0.672313  1
  Ni  Ni337  1  0.063491  0.973796  0.644303  1
  Ni  Ni338  1  0.942081  0.653727  0.712862  1
  Ni  Ni339  1  0.563491  0.973796  0.644303  1
  Ni  Ni340  1  0.442081  0.653727  0.712862  1
  Ni  Ni341  1  0.313590  0.869390  0.649246  1
  Ni  Ni342  1  0.434002  0.201790  0.577071  1
  Ni  Ni343  1  0.813590  0.869390  0.649246  1
  Ni  Ni344  1  0.934002  0.201790  0.577071  1
  Ni  Ni345  1  0.082272  0.150971  0.653143  1
  Ni  Ni346  1  0.203197  0.482762  0.581687  1
  Ni  Ni347  1  0.582272  0.150971  0.653143  1
  Ni  Ni348  1  0.703197  0.482762  0.581687  1
