# generated using pymatgen
data_Zr96Ni251
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   19.62997070
_cell_length_b   15.54748412
_cell_length_c   17.58569655
_cell_angle_alpha   93.70174697
_cell_angle_beta   111.73606814
_cell_angle_gamma   104.67480356
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr96Ni251
_chemical_formula_sum   'Zr96 Ni251'
_cell_volume   4747.36120202
_cell_formula_units_Z   1
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  0.272583  0.484436  0.122885  1
  Zr  Zr2  1  0.271671  0.486645  0.621569  1
  Zr  Zr3  1  0.271940  0.984317  0.122979  1
  Zr  Zr4  1  0.272217  0.986397  0.622566  1
  Zr  Zr5  1  0.605803  0.484135  0.122832  1
  Zr  Zr6  1  0.605798  0.484339  0.622722  1
  Zr  Zr7  1  0.605310  0.984038  0.122733  1
  Zr  Zr8  1  0.605080  0.984009  0.622463  1
  Zr  Zr9  1  0.940938  0.483022  0.125900  1
  Zr  Zr10  1  0.939210  0.484515  0.623232  1
  Zr  Zr11  1  0.938647  0.984893  0.122633  1
  Zr  Zr12  1  0.938881  0.984361  0.622693  1
  Zr  Zr13  1  0.061623  0.016151  0.376619  1
  Zr  Zr14  1  0.061732  0.017222  0.876405  1
  Zr  Zr15  1  0.060466  0.513346  0.371028  1
  Zr  Zr16  1  0.062395  0.517206  0.878407  1
  Zr  Zr17  1  0.394944  0.019163  0.375915  1
  Zr  Zr18  1  0.395055  0.016660  0.876851  1
  Zr  Zr19  1  0.395479  0.518734  0.376511  1
  Zr  Zr20  1  0.395230  0.517104  0.876592  1
  Zr  Zr21  1  0.728618  0.016974  0.376402  1
  Zr  Zr22  1  0.728140  0.016856  0.876163  1
  Zr  Zr23  1  0.729259  0.517179  0.376438  1
  Zr  Zr24  1  0.728635  0.516903  0.876485  1
  Zr  Zr25  1  0.281264  0.216802  0.292770  1
  Zr  Zr26  1  0.283230  0.214609  0.793742  1
  Zr  Zr27  1  0.281918  0.715558  0.292842  1
  Zr  Zr28  1  0.282804  0.714518  0.793620  1
  Zr  Zr29  1  0.617229  0.215031  0.292636  1
  Zr  Zr30  1  0.615711  0.214714  0.793041  1
  Zr  Zr31  1  0.616416  0.714783  0.292990  1
  Zr  Zr32  1  0.616007  0.714758  0.792953  1
  Zr  Zr33  1  0.950942  0.214355  0.292720  1
  Zr  Zr34  1  0.949479  0.215085  0.792959  1
  Zr  Zr35  1  0.950921  0.715232  0.293268  1
  Zr  Zr36  1  0.950049  0.714635  0.793961  1
  Zr  Zr37  1  0.051143  0.296366  0.207900  1
  Zr  Zr38  1  0.051615  0.286853  0.706057  1
  Zr  Zr39  1  0.051314  0.787859  0.204638  1
  Zr  Zr40  1  0.051005  0.786746  0.705340  1
  Zr  Zr41  1  0.385039  0.286374  0.206687  1
  Zr  Zr42  1  0.384128  0.288237  0.705747  1
  Zr  Zr43  1  0.384160  0.786306  0.206106  1
  Zr  Zr44  1  0.383728  0.787824  0.705681  1
  Zr  Zr45  1  0.719942  0.287206  0.205909  1
  Zr  Zr46  1  0.717468  0.286609  0.705621  1
  Zr  Zr47  1  0.718219  0.786485  0.205749  1
  Zr  Zr48  1  0.717892  0.786448  0.705746  1
  Zr  Zr49  1  0.095488  0.281958  0.016614  1
  Zr  Zr50  1  0.095731  0.281723  0.517700  1
  Zr  Zr51  1  0.095177  0.781476  0.017771  1
  Zr  Zr52  1  0.095520  0.780992  0.517325  1
  Zr  Zr53  1  0.429048  0.281607  0.017468  1
  Zr  Zr54  1  0.428732  0.282998  0.516968  1
  Zr  Zr55  1  0.428551  0.781448  0.017301  1
  Zr  Zr56  1  0.429058  0.783297  0.517322  1
  Zr  Zr57  1  0.761459  0.281292  0.016735  1
  Zr  Zr58  1  0.762395  0.281740  0.517436  1
  Zr  Zr59  1  0.762057  0.781796  0.016846  1
  Zr  Zr60  1  0.762331  0.781652  0.517108  1
  Zr  Zr61  1  0.237750  0.222006  0.481267  1
  Zr  Zr62  1  0.238468  0.219660  0.981740  1
  Zr  Zr63  1  0.238683  0.721220  0.482561  1
  Zr  Zr64  1  0.237904  0.719316  0.982483  1
  Zr  Zr65  1  0.571570  0.219775  0.481679  1
  Zr  Zr66  1  0.571592  0.219666  0.981898  1
  Zr  Zr67  1  0.571826  0.719701  0.481860  1
  Zr  Zr68  1  0.571592  0.719593  0.981792  1
  Zr  Zr69  1  0.905011  0.219274  0.482709  1
  Zr  Zr70  1  0.904205  0.219554  0.980866  1
  Zr  Zr71  1  0.905302  0.719281  0.481899  1
  Zr  Zr72  1  0.905352  0.720328  0.982057  1
  Zr  Zr73  1  0.124853  0.050964  0.151185  1
  Zr  Zr74  1  0.125308  0.050007  0.651305  1
  Zr  Zr75  1  0.123481  0.544940  0.158447  1
  Zr  Zr76  1  0.125167  0.550219  0.651908  1
  Zr  Zr77  1  0.458484  0.049460  0.151407  1
  Zr  Zr78  1  0.458258  0.051159  0.650904  1
  Zr  Zr79  1  0.458913  0.549559  0.151374  1
  Zr  Zr80  1  0.458485  0.551026  0.651027  1
  Zr  Zr81  1  0.791563  0.049224  0.150946  1
  Zr  Zr82  1  0.791739  0.049819  0.651124  1
  Zr  Zr83  1  0.791947  0.550136  0.150183  1
  Zr  Zr84  1  0.792306  0.549981  0.651396  1
  Zr  Zr85  1  0.208003  0.454056  0.345734  1
  Zr  Zr86  1  0.208960  0.451383  0.847877  1
  Zr  Zr87  1  0.208619  0.953407  0.347855  1
  Zr  Zr88  1  0.208701  0.951145  0.847945  1
  Zr  Zr89  1  0.542600  0.451631  0.348036  1
  Zr  Zr90  1  0.541951  0.451749  0.847527  1
  Zr  Zr91  1  0.541948  0.951784  0.347888  1
  Zr  Zr92  1  0.541781  0.951491  0.847812  1
  Zr  Zr93  1  0.876271  0.450818  0.348066  1
  Zr  Zr94  1  0.875862  0.451680  0.849533  1
  Zr  Zr95  1  0.875423  0.951254  0.347939  1
  Zr  Zr96  1  0.875237  0.951569  0.847821  1
  Ni  Ni97  1  1.000272  0.002643  -0.000252  1
  Ni  Ni98  1  1.000295  1.000548  0.499566  1
  Ni  Ni99  1  0.001049  0.500099  0.002478  1
  Ni  Ni100  1  0.000798  0.499880  0.498310  1
  Ni  Ni101  1  0.333335  1.000235  0.000012  1
  Ni  Ni102  1  0.333427  0.002539  0.499064  1
  Ni  Ni103  1  0.333917  0.500595  -0.000124  1
  Ni  Ni104  1  0.333230  0.502430  0.498195  1
  Ni  Ni105  1  0.666605  1.000265  0.999267  1
  Ni  Ni106  1  0.666815  1.000587  0.499387  1
  Ni  Ni107  1  0.667066  0.500681  0.999178  1
  Ni  Ni108  1  0.667380  0.500605  0.499501  1
  Ni  Ni109  1  0.018589  0.372671  0.075069  1
  Ni  Ni110  1  0.020195  0.376408  0.578119  1
  Ni  Ni111  1  0.019652  0.878204  0.077720  1
  Ni  Ni112  1  0.020026  0.876108  0.577641  1
  Ni  Ni113  1  0.353454  0.375920  0.078227  1
  Ni  Ni114  1  0.353130  0.377904  0.577621  1
  Ni  Ni115  1  0.352554  0.875580  0.078128  1
  Ni  Ni116  1  0.352881  0.877748  0.577682  1
  Ni  Ni117  1  0.686460  0.376265  0.077560  1
  Ni  Ni118  1  0.686755  0.376285  0.577860  1
  Ni  Ni119  1  0.686314  0.875855  0.077679  1
  Ni  Ni120  1  0.686438  0.876165  0.577755  1
  Ni  Ni121  1  0.313443  0.127072  0.420840  1
  Ni  Ni122  1  0.314180  0.124830  0.921553  1
  Ni  Ni123  1  0.313965  0.626667  0.420939  1
  Ni  Ni124  1  0.313967  0.625125  0.921601  1
  Ni  Ni125  1  0.647597  0.125464  0.421109  1
  Ni  Ni126  1  0.647073  0.124896  0.921091  1
  Ni  Ni127  1  0.647934  0.625232  0.421262  1
  Ni  Ni128  1  0.647499  0.625191  0.921066  1
  Ni  Ni129  1  0.980822  0.125581  0.421362  1
  Ni  Ni130  1  0.980547  0.125782  0.921180  1
  Ni  Ni131  1  0.981121  0.624284  0.420881  1
  Ni  Ni132  1  0.981312  0.624477  0.922598  1
  Ni  Ni133  1  0.063136  0.454131  0.737835  1
  Ni  Ni134  1  0.062894  0.954806  0.237072  1
  Ni  Ni135  1  0.063127  0.953719  0.737181  1
  Ni  Ni136  1  0.396986  0.453800  0.237504  1
  Ni  Ni137  1  0.395723  0.455254  0.736603  1
  Ni  Ni138  1  0.396270  0.953357  0.237331  1
  Ni  Ni139  1  0.396133  0.955157  0.736946  1
  Ni  Ni140  1  0.730779  0.454047  0.237077  1
  Ni  Ni141  1  0.730390  0.453969  0.737398  1
  Ni  Ni142  1  0.729563  0.953475  0.237093  1
  Ni  Ni143  1  0.729432  0.953571  0.736879  1
  Ni  Ni144  1  0.270384  0.049579  0.261755  1
  Ni  Ni145  1  0.271142  0.047456  0.762362  1
  Ni  Ni146  1  0.272333  0.549217  0.261873  1
  Ni  Ni147  1  0.271145  0.547453  0.762053  1
  Ni  Ni148  1  0.604080  0.047371  0.262047  1
  Ni  Ni149  1  0.603761  0.047640  0.761738  1
  Ni  Ni150  1  0.604709  0.547688  0.262136  1
  Ni  Ni151  1  0.604435  0.547851  0.761830  1
  Ni  Ni152  1  0.937668  0.047324  0.262101  1
  Ni  Ni153  1  0.937441  0.047665  0.762003  1
  Ni  Ni154  1  0.934145  0.548682  0.261810  1
  Ni  Ni155  1  0.938066  0.547397  0.763107  1
  Ni  Ni156  1  0.245483  0.307758  0.122000  1
  Ni  Ni157  1  0.245239  0.310900  0.621863  1
  Ni  Ni158  1  0.244448  0.807815  0.122428  1
  Ni  Ni159  1  0.244926  0.810744  0.621783  1
  Ni  Ni160  1  0.579054  0.308583  0.122241  1
  Ni  Ni161  1  0.578250  0.308857  0.621442  1
  Ni  Ni162  1  0.578312  0.808492  0.121830  1
  Ni  Ni163  1  0.578373  0.808610  0.621731  1
  Ni  Ni164  1  0.907680  0.305527  0.118387  1
  Ni  Ni165  1  0.912092  0.309259  0.622306  1
  Ni  Ni166  1  0.911582  0.808811  0.121463  1
  Ni  Ni167  1  0.911763  0.808891  0.621656  1
  Ni  Ni168  1  0.088890  0.191409  0.377314  1
  Ni  Ni169  1  0.088808  0.192558  0.877186  1
  Ni  Ni170  1  0.089488  0.692037  0.378885  1
  Ni  Ni171  1  0.088970  0.692505  0.877955  1
  Ni  Ni172  1  0.421683  0.194375  0.376682  1
  Ni  Ni173  1  0.422250  0.192345  0.877577  1
  Ni  Ni174  1  0.422070  0.694179  0.377049  1
  Ni  Ni175  1  0.422075  0.692476  0.877475  1
  Ni  Ni176  1  0.755989  0.192371  0.377590  1
  Ni  Ni177  1  0.754984  0.192164  0.876815  1
  Ni  Ni178  1  0.755833  0.692599  0.377181  1
  Ni  Ni179  1  0.755608  0.692538  0.877127  1
  Ni  Ni180  1  0.247455  0.144389  0.129437  1
  Ni  Ni181  1  0.247420  0.146534  0.629162  1
  Ni  Ni182  1  0.246285  0.641905  0.130313  1
  Ni  Ni183  1  0.246803  0.646158  0.628587  1
  Ni  Ni184  1  0.581238  0.144550  0.129430  1
  Ni  Ni185  1  0.580535  0.144421  0.628831  1
  Ni  Ni186  1  0.581090  0.644338  0.129219  1
  Ni  Ni187  1  0.580972  0.644309  0.629037  1
  Ni  Ni188  1  0.914811  0.145905  0.129929  1
  Ni  Ni189  1  0.914282  0.144591  0.629353  1
  Ni  Ni190  1  0.914398  0.644093  0.129560  1
  Ni  Ni191  1  0.914632  0.644580  0.629263  1
  Ni  Ni192  1  0.017905  0.154523  0.078885  1
  Ni  Ni193  1  0.018129  0.150349  0.578212  1
  Ni  Ni194  1  0.017904  0.649267  0.079035  1
  Ni  Ni195  1  0.018253  0.649640  0.577759  1
  Ni  Ni196  1  0.351260  0.150645  0.078133  1
  Ni  Ni197  1  0.351017  0.152430  0.577688  1
  Ni  Ni198  1  0.350818  0.650484  0.078200  1
  Ni  Ni199  1  0.350997  0.651653  0.577660  1
  Ni  Ni200  1  0.684517  0.150182  0.077893  1
  Ni  Ni201  1  0.684379  0.150545  0.577733  1
  Ni  Ni202  1  0.684716  0.650737  0.077734  1
  Ni  Ni203  1  0.684909  0.650586  0.577953  1
  Ni  Ni204  1  0.315821  0.352604  0.420808  1
  Ni  Ni205  1  0.316179  0.350831  0.921454  1
  Ni  Ni206  1  0.315684  0.852007  0.421048  1
  Ni  Ni207  1  0.315521  0.850241  0.921426  1
  Ni  Ni208  1  0.649728  0.350621  0.421155  1
  Ni  Ni209  1  0.649105  0.350902  0.920883  1
  Ni  Ni210  1  0.649353  0.850661  0.421113  1
  Ni  Ni211  1  0.648888  0.850486  0.920809  1
  Ni  Ni212  1  0.982725  0.349748  0.420993  1
  Ni  Ni213  1  0.982720  0.351281  0.921120  1
  Ni  Ni214  1  0.982780  0.850681  0.421098  1
  Ni  Ni215  1  0.982779  0.851664  0.921485  1
  Ni  Ni216  1  0.175976  0.276941  0.324931  1
  Ni  Ni217  1  0.177261  0.274642  0.825697  1
  Ni  Ni218  1  0.176298  0.776188  0.325512  1
  Ni  Ni219  1  0.176682  0.774543  0.825174  1
  Ni  Ni220  1  0.511196  0.274991  0.325472  1
  Ni  Ni221  1  0.509944  0.274889  0.825214  1
  Ni  Ni222  1  0.510609  0.775128  0.325273  1
  Ni  Ni223  1  0.509803  0.774701  0.825071  1
  Ni  Ni224  1  0.844456  0.273955  0.326006  1
  Ni  Ni225  1  0.843492  0.274848  0.825108  1
  Ni  Ni226  1  0.844158  0.774354  0.325279  1
  Ni  Ni227  1  0.843890  0.774853  0.825349  1
  Ni  Ni228  1  0.155369  0.228114  0.173876  1
  Ni  Ni229  1  0.157431  0.227042  0.674096  1
  Ni  Ni230  1  0.156088  0.724319  0.174060  1
  Ni  Ni231  1  0.157193  0.727245  0.673871  1
  Ni  Ni232  1  0.490382  0.226210  0.173810  1
  Ni  Ni233  1  0.490001  0.227888  0.673590  1
  Ni  Ni234  1  0.489998  0.726302  0.173676  1
  Ni  Ni235  1  0.489899  0.727591  0.673672  1
  Ni  Ni236  1  0.823563  0.225666  0.174441  1
  Ni  Ni237  1  0.823409  0.226539  0.673485  1
  Ni  Ni238  1  0.824011  0.726547  0.173765  1
  Ni  Ni239  1  0.824021  0.726623  0.673869  1
  Ni  Ni240  1  0.172460  0.108730  0.326211  1
  Ni  Ni241  1  0.173495  0.106976  0.826734  1
  Ni  Ni242  1  0.174537  0.612480  0.329564  1
  Ni  Ni243  1  0.173289  0.607139  0.827422  1
  Ni  Ni244  1  0.507036  0.107857  0.326145  1
  Ni  Ni245  1  0.506407  0.107363  0.826838  1
  Ni  Ni246  1  0.507212  0.607531  0.326820  1
  Ni  Ni247  1  0.506548  0.607548  0.826547  1
  Ni  Ni248  1  0.840428  0.107257  0.326192  1
  Ni  Ni249  1  0.839766  0.107194  0.826160  1
  Ni  Ni250  1  0.840810  0.607119  0.326120  1
  Ni  Ni251  1  0.840624  0.607198  0.827432  1
  Ni  Ni252  1  0.162633  0.392630  0.168966  1
  Ni  Ni253  1  0.160950  0.394694  0.672438  1
  Ni  Ni254  1  0.160554  0.894529  0.172246  1
  Ni  Ni255  1  0.160751  0.894645  0.672298  1
  Ni  Ni256  1  0.494338  0.393730  0.172759  1
  Ni  Ni257  1  0.493785  0.395174  0.671993  1
  Ni  Ni258  1  0.493642  0.893771  0.172530  1
  Ni  Ni259  1  0.493493  0.895022  0.672357  1
  Ni  Ni260  1  0.826900  0.394693  0.170736  1
  Ni  Ni261  1  0.827437  0.394218  0.673119  1
  Ni  Ni262  1  0.827292  0.894237  0.172060  1
  Ni  Ni263  1  0.827231  0.894114  0.672339  1
  Ni  Ni264  1  0.054071  0.130685  0.231404  1
  Ni  Ni265  1  0.054699  0.126602  0.732171  1
  Ni  Ni266  1  0.053177  0.630533  0.233485  1
  Ni  Ni267  1  0.054724  0.627067  0.732171  1
  Ni  Ni268  1  0.387803  0.126432  0.232056  1
  Ni  Ni269  1  0.387936  0.128132  0.731988  1
  Ni  Ni270  1  0.388688  0.626903  0.232226  1
  Ni  Ni271  1  0.387747  0.627831  0.731860  1
  Ni  Ni272  1  0.721101  0.126459  0.232139  1
  Ni  Ni273  1  0.720824  0.126551  0.731708  1
  Ni  Ni274  1  0.721614  0.626571  0.231939  1
  Ni  Ni275  1  0.721736  0.626656  0.732137  1
  Ni  Ni276  1  0.279744  0.376656  0.267274  1
  Ni  Ni277  1  0.279543  0.374611  0.767398  1
  Ni  Ni278  1  0.278935  0.875739  0.267230  1
  Ni  Ni279  1  0.279398  0.874674  0.767333  1
  Ni  Ni280  1  0.613433  0.374959  0.267249  1
  Ni  Ni281  1  0.612626  0.374946  0.766743  1
  Ni  Ni282  1  0.612561  0.874642  0.267046  1
  Ni  Ni283  1  0.612204  0.874681  0.766777  1
  Ni  Ni284  1  0.942892  0.372116  0.265550  1
  Ni  Ni285  1  0.946301  0.375305  0.767658  1
  Ni  Ni286  1  0.945982  0.874838  0.266793  1
  Ni  Ni287  1  0.945995  0.874499  0.767062  1
  Ni  Ni288  1  0.213432  0.051422  0.481733  1
  Ni  Ni289  1  0.213557  0.049384  0.981652  1
  Ni  Ni290  1  0.212386  0.550309  0.479376  1
  Ni  Ni291  1  0.213719  0.549120  0.981306  1
  Ni  Ni292  1  0.546927  0.049610  0.481445  1
  Ni  Ni293  1  0.546758  0.049298  0.981902  1
  Ni  Ni294  1  0.547367  0.549595  0.481619  1
  Ni  Ni295  1  0.547092  0.549431  0.981719  1
  Ni  Ni296  1  0.880386  0.049300  0.481761  1
  Ni  Ni297  1  0.880484  0.050279  0.982364  1
  Ni  Ni298  1  0.880972  0.549046  0.481874  1
  Ni  Ni299  1  0.881116  0.549682  0.983611  1
  Ni  Ni300  1  0.121065  0.453017  0.019966  1
  Ni  Ni301  1  0.120166  0.452156  0.516984  1
  Ni  Ni302  1  0.120039  0.952547  0.017689  1
  Ni  Ni303  1  0.120415  0.951579  0.517264  1
  Ni  Ni304  1  0.453779  0.451846  0.017440  1
  Ni  Ni305  1  0.453670  0.453320  0.517476  1
  Ni  Ni306  1  0.453249  0.951439  0.017538  1
  Ni  Ni307  1  0.453210  0.953375  0.517046  1
  Ni  Ni308  1  0.787667  0.451599  0.017796  1
  Ni  Ni309  1  0.787365  0.451979  0.517486  1
  Ni  Ni310  1  0.786546  0.951620  0.016822  1
  Ni  Ni311  1  0.786934  0.951797  0.517365  1
  Ni  Ni312  1  0.214831  0.377959  0.477898  1
  Ni  Ni313  1  0.213832  0.375364  0.978557  1
  Ni  Ni314  1  0.213775  0.876918  0.478074  1
  Ni  Ni315  1  0.213151  0.874832  0.978416  1
  Ni  Ni316  1  0.546978  0.375271  0.477721  1
  Ni  Ni317  1  0.547206  0.375274  0.978062  1
  Ni  Ni318  1  0.546758  0.875053  0.477624  1
  Ni  Ni319  1  0.546800  0.874985  0.977996  1
  Ni  Ni320  1  0.880926  0.375113  0.478424  1
  Ni  Ni321  1  0.880242  0.375540  0.978649  1
  Ni  Ni322  1  0.880421  0.874897  0.477893  1
  Ni  Ni323  1  0.880421  0.876154  0.978033  1
  Ni  Ni324  1  0.120168  0.127030  0.021403  1
  Ni  Ni325  1  0.120047  0.126015  0.521077  1
  Ni  Ni326  1  0.120314  0.624652  0.024700  1
  Ni  Ni327  1  0.119633  0.624161  0.519446  1
  Ni  Ni328  1  0.453599  0.125884  0.021518  1
  Ni  Ni329  1  0.453262  0.127712  0.520742  1
  Ni  Ni330  1  0.453586  0.626230  0.021376  1
  Ni  Ni331  1  0.453665  0.627770  0.521064  1
  Ni  Ni332  1  0.786929  0.126198  0.021310  1
  Ni  Ni333  1  0.786761  0.125982  0.521264  1
  Ni  Ni334  1  0.787104  0.626550  0.020825  1
  Ni  Ni335  1  0.787205  0.626189  0.521180  1
  Ni  Ni336  1  0.088394  0.353364  0.374215  1
  Ni  Ni337  1  0.086714  0.357338  0.870259  1
  Ni  Ni338  1  0.086587  0.856196  0.369692  1
  Ni  Ni339  1  0.086232  0.857152  0.869731  1
  Ni  Ni340  1  0.419565  0.358560  0.369756  1
  Ni  Ni341  1  0.419860  0.356814  0.870068  1
  Ni  Ni342  1  0.419337  0.858639  0.369678  1
  Ni  Ni343  1  0.419466  0.856584  0.870070  1
  Ni  Ni344  1  0.753727  0.356810  0.370090  1
  Ni  Ni345  1  0.752939  0.356474  0.869838  1
  Ni  Ni346  1  0.753081  0.856825  0.369735  1
  Ni  Ni347  1  0.752819  0.856643  0.869557  1
