# generated using pymatgen
data_ZrNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.64310681
_cell_length_b   14.18458033
_cell_length_c   53.02442585
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   93.95683729
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrNi3
_chemical_formula_sum   'Zr90 Ni270'
_cell_volume   10236.919512
_cell_formula_units_Z   90
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  0.306776  0.206082  0.270772  1
  Zr  Zr2  1  0.348869  0.776113  0.331379  1
  Zr  Zr3  1  0.324754  0.488240  0.298725  1
  Zr  Zr4  1  0.640110  0.872748  0.270772  1
  Zr  Zr5  1  0.682203  0.442779  0.331379  1
  Zr  Zr6  1  0.973443  0.539415  0.270772  1
  Zr  Zr7  1  0.658087  0.154907  0.298725  1
  Zr  Zr8  1  0.015536  0.109446  0.331379  1
  Zr  Zr9  1  0.991420  0.821574  0.298725  1
  Zr  Zr10  1  0.446638  0.005331  0.290591  1
  Zr  Zr11  1  0.478703  0.573188  0.355408  1
  Zr  Zr12  1  0.459611  0.286102  0.325270  1
  Zr  Zr13  1  0.779972  0.671998  0.290591  1
  Zr  Zr14  1  0.812036  0.239855  0.355408  1
  Zr  Zr15  1  0.113305  0.338665  0.290591  1
  Zr  Zr16  1  0.792944  0.952769  0.325270  1
  Zr  Zr17  1  0.145370  0.906521  0.355408  1
  Zr  Zr18  1  0.126278  0.619436  0.325270  1
  Zr  Zr19  1  0.368492  0.062994  0.361504  1
  Zr  Zr20  1  0.407924  0.644824  0.421803  1
  Zr  Zr21  1  0.387734  0.354795  0.391247  1
  Zr  Zr22  1  0.701826  0.729660  0.361504  1
  Zr  Zr23  1  0.741257  0.311490  0.421803  1
  Zr  Zr24  1  0.035159  0.396327  0.361504  1
  Zr  Zr25  1  0.721068  0.021462  0.391247  1
  Zr  Zr26  1  0.074591  0.978157  0.421803  1
  Zr  Zr27  1  0.054401  0.688128  0.391247  1
  Zr  Zr28  1  0.497541  0.863386  0.385192  1
  Zr  Zr29  1  0.538086  0.443472  0.446176  1
  Zr  Zr30  1  0.518075  0.153058  0.415693  1
  Zr  Zr31  1  0.830875  0.530053  0.385192  1
  Zr  Zr32  1  0.871419  0.110139  0.446176  1
  Zr  Zr33  1  0.164208  0.196720  0.385192  1
  Zr  Zr34  1  0.851408  0.819725  0.415693  1
  Zr  Zr35  1  0.204752  0.776805  0.446176  1
  Zr  Zr36  1  0.184742  0.486391  0.415693  1
  Zr  Zr37  1  0.428417  0.935314  0.452080  1
  Zr  Zr38  1  0.468627  0.516018  0.512635  1
  Zr  Zr39  1  0.448516  0.225762  0.482279  1
  Zr  Zr40  1  0.761751  0.601980  0.452080  1
  Zr  Zr41  1  0.801960  0.182685  0.512635  1
  Zr  Zr42  1  0.095084  0.268647  0.452080  1
  Zr  Zr43  1  0.781850  0.892429  0.482279  1
  Zr  Zr44  1  0.135293  0.849352  0.512635  1
  Zr  Zr45  1  0.115183  0.559096  0.482279  1
  Zr  Zr46  1  0.558167  0.734153  0.476387  1
  Zr  Zr47  1  0.598376  0.314858  0.536942  1
  Zr  Zr48  1  0.578277  0.024410  0.506742  1
  Zr  Zr49  1  0.891500  0.400820  0.476387  1
  Zr  Zr50  1  0.931709  0.981525  0.536942  1
  Zr  Zr51  1  0.224833  0.067487  0.476387  1
  Zr  Zr52  1  0.911610  0.691076  0.506742  1
  Zr  Zr53  1  0.265043  0.648191  0.536942  1
  Zr  Zr54  1  0.244944  0.357743  0.506742  1
  Zr  Zr55  1  0.488708  0.806700  0.542845  1
  Zr  Zr56  1  0.529252  0.386785  0.603830  1
  Zr  Zr57  1  0.508718  0.097114  0.573328  1
  Zr  Zr58  1  0.822041  0.473366  0.542845  1
  Zr  Zr59  1  0.862585  0.053452  0.603830  1
  Zr  Zr60  1  0.155374  0.140033  0.542845  1
  Zr  Zr61  1  0.842052  0.763781  0.573328  1
  Zr  Zr62  1  0.195919  0.720119  0.603830  1
  Zr  Zr63  1  0.175385  0.430447  0.573328  1
  Zr  Zr64  1  0.618869  0.605348  0.567219  1
  Zr  Zr65  1  0.658301  0.187178  0.627517  1
  Zr  Zr66  1  0.639059  0.895377  0.597774  1
  Zr  Zr67  1  0.952203  0.272015  0.567219  1
  Zr  Zr68  1  0.991634  0.853845  0.627517  1
  Zr  Zr69  1  0.285536  0.938681  0.567219  1
  Zr  Zr70  1  0.972392  0.562043  0.597774  1
  Zr  Zr71  1  0.324968  0.520512  0.627517  1
  Zr  Zr72  1  0.305726  0.228710  0.597774  1
  Zr  Zr73  1  0.548090  0.676984  0.633613  1
  Zr  Zr74  1  0.580155  0.244840  0.698430  1
  Zr  Zr75  1  0.567183  0.964069  0.663752  1
  Zr  Zr76  1  0.881424  0.343650  0.633613  1
  Zr  Zr77  1  0.913488  0.911507  0.698430  1
  Zr  Zr78  1  0.214757  0.010317  0.633613  1
  Zr  Zr79  1  0.900516  0.630736  0.663752  1
  Zr  Zr80  1  0.246822  0.578174  0.698430  1
  Zr  Zr81  1  0.233849  0.297403  0.663752  1
  Zr  Zr82  1  0.677924  0.474059  0.657643  1
  Zr  Zr83  1  0.720017  0.044090  0.718249  1
  Zr  Zr84  1  0.702040  0.761931  0.690297  1
  Zr  Zr85  1  0.011257  0.140726  0.657643  1
  Zr  Zr86  1  0.053350  0.710757  0.718249  1
  Zr  Zr87  1  0.344591  0.807392  0.657643  1
  Zr  Zr88  1  0.035373  0.428598  0.690297  1
  Zr  Zr89  1  0.386684  0.377423  0.718249  1
  Zr  Zr90  1  0.368707  0.095265  0.690297  1
  Ni  Ni91  1  0.336496  0.131220  0.315409  1
  Ni  Ni92  1  0.322373  0.849812  0.285975  1
  Ni  Ni93  1  0.355176  0.421531  0.345234  1
  Ni  Ni94  1  0.669829  0.797887  0.315409  1
  Ni  Ni95  1  0.655706  0.516479  0.285975  1
  Ni  Ni96  1  1.003162  0.464554  0.315409  1
  Ni  Ni97  1  0.688509  0.088198  0.345234  1
  Ni  Ni98  1  0.989040  0.183146  0.285975  1
  Ni  Ni99  1  0.021843  0.754865  0.345234  1
  Ni  Ni100  1  0.257828  0.021781  0.280918  1
  Ni  Ni101  1  0.302350  0.594374  0.339697  1
  Ni  Ni102  1  0.282008  0.305573  0.310926  1
  Ni  Ni103  1  0.591161  0.688448  0.280918  1
  Ni  Ni104  1  0.635683  0.261041  0.339697  1
  Ni  Ni105  1  0.924495  0.355114  0.280918  1
  Ni  Ni106  1  0.615341  0.972239  0.310926  1
  Ni  Ni107  1  0.969017  0.927707  0.339697  1
  Ni  Ni108  1  0.948675  0.638906  0.310926  1
  Ni  Ni109  1  0.468861  0.930813  0.338161  1
  Ni  Ni110  1  0.449651  0.641742  0.309041  1
  Ni  Ni111  1  0.430878  0.358224  0.280152  1
  Ni  Ni112  1  0.802195  0.597480  0.338161  1
  Ni  Ni113  1  0.782984  0.308409  0.309041  1
  Ni  Ni114  1  0.135528  0.264147  0.338161  1
  Ni  Ni115  1  0.764211  0.024891  0.280152  1
  Ni  Ni116  1  0.116318  0.975076  0.309041  1
  Ni  Ni117  1  0.097545  0.691557  0.280152  1
  Ni  Ni118  1  0.481165  0.188139  0.286567  1
  Ni  Ni119  1  0.526337  0.753802  0.344953  1
  Ni  Ni120  1  0.506151  0.468312  0.315185  1
  Ni  Ni121  1  0.814498  0.854806  0.286567  1
  Ni  Ni122  1  0.859670  0.420469  0.344953  1
  Ni  Ni123  1  0.147831  0.521473  0.286567  1
  Ni  Ni124  1  0.839484  0.134979  0.315185  1
  Ni  Ni125  1  0.193003  0.087136  0.344953  1
  Ni  Ni126  1  0.172817  0.801645  0.315185  1
  Ni  Ni127  1  0.514758  0.108358  0.330543  1
  Ni  Ni128  1  0.495567  0.821144  0.300894  1
  Ni  Ni129  1  0.486173  0.536345  0.272634  1
  Ni  Ni130  1  0.848091  0.775024  0.330543  1
  Ni  Ni131  1  0.828900  0.487811  0.300894  1
  Ni  Ni132  1  0.181425  0.441691  0.330543  1
  Ni  Ni133  1  0.819506  0.203011  0.272634  1
  Ni  Ni134  1  0.162234  0.154477  0.300894  1
  Ni  Ni135  1  0.152839  0.869678  0.272634  1
  Ni  Ni136  1  0.293972  0.953736  0.323045  1
  Ni  Ni137  1  0.276344  0.670664  0.293508  1
  Ni  Ni138  1  0.310198  0.239626  0.354731  1
  Ni  Ni139  1  0.627305  0.620403  0.323045  1
  Ni  Ni140  1  0.609677  0.337331  0.293508  1
  Ni  Ni141  1  0.960638  0.287069  0.323045  1
  Ni  Ni142  1  0.643531  0.906292  0.354731  1
  Ni  Ni143  1  0.943010  0.003998  0.293508  1
  Ni  Ni144  1  0.976865  0.572959  0.354731  1
  Ni  Ni145  1  0.396979  0.999516  0.406877  1
  Ni  Ni146  1  0.376862  0.708820  0.376368  1
  Ni  Ni147  1  0.416703  0.289949  0.436819  1
  Ni  Ni148  1  0.730312  0.666183  0.406877  1
  Ni  Ni149  1  0.710195  0.375486  0.376368  1
  Ni  Ni150  1  0.063645  0.332849  0.406877  1
  Ni  Ni151  1  0.750037  0.956616  0.436819  1
  Ni  Ni152  1  0.043529  0.042153  0.376368  1
  Ni  Ni153  1  0.083370  0.623283  0.436819  1
  Ni  Ni154  1  0.321649  0.884362  0.370602  1
  Ni  Ni155  1  0.360815  0.464196  0.431377  1
  Ni  Ni156  1  0.340810  0.174235  0.400920  1
  Ni  Ni157  1  0.654982  0.551028  0.370602  1
  Ni  Ni158  1  0.694148  0.130862  0.431377  1
  Ni  Ni159  1  0.988315  0.217695  0.370602  1
  Ni  Ni160  1  0.674143  0.840902  0.400920  1
  Ni  Ni161  1  0.027481  0.797529  0.431377  1
  Ni  Ni162  1  0.007476  0.507569  0.400920  1
  Ni  Ni163  1  0.529460  0.799120  0.430841  1
  Ni  Ni164  1  0.509578  0.508521  0.400831  1
  Ni  Ni165  1  0.489698  0.217480  0.370219  1
  Ni  Ni166  1  0.862793  0.465787  0.430841  1
  Ni  Ni167  1  0.842911  0.175188  0.400831  1
  Ni  Ni168  1  0.196127  0.132454  0.430841  1
  Ni  Ni169  1  0.823031  0.884147  0.370219  1
  Ni  Ni170  1  0.176245  0.841854  0.400831  1
  Ni  Ni171  1  0.156365  0.550814  0.370219  1
  Ni  Ni172  1  0.545330  0.043240  0.375336  1
  Ni  Ni173  1  0.585458  0.624356  0.436619  1
  Ni  Ni174  1  0.565181  0.333643  0.406274  1
  Ni  Ni175  1  0.878663  0.709907  0.375336  1
  Ni  Ni176  1  0.918792  0.291023  0.436619  1
  Ni  Ni177  1  0.211997  0.376574  0.375336  1
  Ni  Ni178  1  0.898515  1.000309  0.406274  1
  Ni  Ni179  1  0.252125  0.957690  0.436619  1
  Ni  Ni180  1  0.231848  0.666976  0.406274  1
  Ni  Ni181  1  0.575632  0.977912  0.421833  1
  Ni  Ni182  1  0.555600  0.687784  0.392040  1
  Ni  Ni183  1  0.535651  0.397004  0.361941  1
  Ni  Ni184  1  0.908966  0.644579  0.421833  1
  Ni  Ni185  1  0.888933  0.354451  0.392040  1
  Ni  Ni186  1  0.242299  0.311245  0.421833  1
  Ni  Ni187  1  0.868984  0.063671  0.361941  1
  Ni  Ni188  1  0.222266  0.021118  0.392040  1
  Ni  Ni189  1  0.202318  0.730338  0.361941  1
  Ni  Ni190  1  0.350663  0.820338  0.415605  1
  Ni  Ni191  1  0.330524  0.529903  0.385191  1
  Ni  Ni192  1  0.370700  0.111008  0.445883  1
  Ni  Ni193  1  0.683996  0.487005  0.415605  1
  Ni  Ni194  1  0.663857  0.196570  0.385191  1
  Ni  Ni195  1  0.017329  0.153672  0.415605  1
  Ni  Ni196  1  0.704033  0.777675  0.445883  1
  Ni  Ni197  1  0.997191  0.863236  0.385191  1
  Ni  Ni198  1  0.037366  0.444341  0.445883  1
  Ni  Ni199  1  0.456983  0.870773  0.497498  1
  Ni  Ni200  1  0.436777  0.580185  0.467238  1
  Ni  Ni201  1  0.477220  0.161169  0.527837  1
  Ni  Ni202  1  0.790317  0.537440  0.497498  1
  Ni  Ni203  1  0.770110  0.246851  0.467238  1
  Ni  Ni204  1  0.123650  0.204107  0.497498  1
  Ni  Ni205  1  0.810553  0.827835  0.527837  1
  Ni  Ni206  1  0.103443  0.913518  0.467238  1
  Ni  Ni207  1  0.143886  0.494502  0.527837  1
  Ni  Ni208  1  0.380948  0.754628  0.461660  1
  Ni  Ni209  1  0.421138  0.335323  0.522278  1
  Ni  Ni210  1  0.401055  0.045145  0.491941  1
  Ni  Ni211  1  0.714282  0.421294  0.461660  1
  Ni  Ni212  1  0.754472  1.001990  0.522278  1
  Ni  Ni213  1  0.047615  0.087961  0.461660  1
  Ni  Ni214  1  0.734388  0.711811  0.491941  1
  Ni  Ni215  1  0.087805  0.668656  0.522278  1
  Ni  Ni216  1  0.067721  0.378478  0.491941  1
  Ni  Ni217  1  0.590017  0.669987  0.521783  1
  Ni  Ni218  1  0.569810  0.379398  0.491524  1
  Ni  Ni219  1  0.549574  0.089003  0.461185  1
  Ni  Ni220  1  0.923350  0.336654  0.521783  1
  Ni  Ni221  1  0.903143  0.046065  0.491524  1
  Ni  Ni222  1  0.256683  0.003321  0.521783  1
  Ni  Ni223  1  0.882907  0.755670  0.461185  1
  Ni  Ni224  1  0.236477  0.712732  0.491524  1
  Ni  Ni225  1  0.216240  0.422336  0.461185  1
  Ni  Ni226  1  0.605655  0.914849  0.466743  1
  Ni  Ni227  1  0.645845  0.495544  0.527361  1
  Ni  Ni228  1  0.625739  0.205027  0.497081  1
  Ni  Ni229  1  0.938989  0.581515  0.466743  1
  Ni  Ni230  1  0.979178  0.162211  0.527361  1
  Ni  Ni231  1  0.272322  0.248182  0.466743  1
  Ni  Ni232  1  0.959072  0.871694  0.497081  1
  Ni  Ni233  1  0.312512  0.828877  0.527361  1
  Ni  Ni234  1  0.292405  0.538360  0.497081  1
  Ni  Ni235  1  0.635972  0.849099  0.512778  1
  Ni  Ni236  1  0.615735  0.558565  0.482536  1
  Ni  Ni237  1  0.595508  0.267998  0.452223  1
  Ni  Ni238  1  0.969306  0.515766  0.512778  1
  Ni  Ni239  1  0.949068  0.225232  0.482536  1
  Ni  Ni240  1  0.302639  0.182432  0.512778  1
  Ni  Ni241  1  0.928841  0.934664  0.452223  1
  Ni  Ni242  1  0.282401  0.891899  0.482536  1
  Ni  Ni243  1  0.262174  0.601331  0.452223  1
  Ni  Ni244  1  0.411059  0.691606  0.506486  1
  Ni  Ni245  1  0.390821  0.401073  0.476243  1
  Ni  Ni246  1  0.431286  0.982174  0.536798  1
  Ni  Ni247  1  0.744392  0.358273  0.506486  1
  Ni  Ni248  1  0.724154  0.067739  0.476243  1
  Ni  Ni249  1  0.077725  0.024940  0.506486  1
  Ni  Ni250  1  0.764619  0.648841  0.536798  1
  Ni  Ni251  1  0.057488  0.734406  0.476243  1
  Ni  Ni252  1  0.097952  0.315507  0.536798  1
  Ni  Ni253  1  0.517215  0.741651  0.588191  1
  Ni  Ni254  1  0.497333  0.451051  0.558181  1
  Ni  Ni255  1  0.537096  0.032691  0.618802  1
  Ni  Ni256  1  0.850549  0.408317  0.588191  1
  Ni  Ni257  1  0.830667  0.117718  0.558181  1
  Ni  Ni258  1  0.183882  0.074984  0.588191  1
  Ni  Ni259  1  0.870429  0.699358  0.618802  1
  Ni  Ni260  1  0.164000  0.784385  0.558181  1
  Ni  Ni261  1  0.203762  0.366025  0.618802  1
  Ni  Ni262  1  0.441335  0.625815  0.552402  1
  Ni  Ni263  1  0.481463  0.206931  0.613686  1
  Ni  Ni264  1  0.461612  0.916529  0.582748  1
  Ni  Ni265  1  0.774668  0.292482  0.552402  1
  Ni  Ni266  1  0.814797  0.873598  0.613686  1
  Ni  Ni267  1  0.108002  0.959149  0.552402  1
  Ni  Ni268  1  0.794945  0.583196  0.582748  1
  Ni  Ni269  1  0.148130  0.540265  0.613686  1
  Ni  Ni270  1  0.128279  0.249862  0.582748  1
  Ni  Ni271  1  0.649932  0.541352  0.612653  1
  Ni  Ni272  1  0.629815  0.250656  0.582144  1
  Ni  Ni273  1  0.610090  0.960222  0.552202  1
  Ni  Ni274  1  0.983265  0.208019  0.612653  1
  Ni  Ni275  1  0.963148  0.917322  0.582144  1
  Ni  Ni276  1  0.316598  0.874685  0.612653  1
  Ni  Ni277  1  0.943423  0.626889  0.552202  1
  Ni  Ni278  1  0.296481  0.583989  0.582144  1
  Ni  Ni279  1  0.276757  0.293556  0.552202  1
  Ni  Ni280  1  0.665979  0.785976  0.557644  1
  Ni  Ni281  1  0.705145  0.365810  0.618420  1
  Ni  Ni282  1  0.685984  0.075936  0.588101  1
  Ni  Ni283  1  0.999312  0.452643  0.557644  1
  Ni  Ni284  1  0.038478  0.032477  0.618420  1
  Ni  Ni285  1  0.332645  0.119309  0.557644  1
  Ni  Ni286  1  0.019317  0.742603  0.588101  1
  Ni  Ni287  1  0.371811  0.699143  0.618420  1
  Ni  Ni288  1  0.352650  0.409270  0.588101  1
  Ni  Ni289  1  0.696269  0.720269  0.603831  1
  Ni  Ni290  1  0.676131  0.429834  0.573417  1
  Ni  Ni291  1  0.656094  0.139164  0.543139  1
  Ni  Ni292  1  0.029603  0.386935  0.603831  1
  Ni  Ni293  1  0.009464  0.096500  0.573417  1
  Ni  Ni294  1  0.362936  0.053602  0.603831  1
  Ni  Ni295  1  0.989427  0.805830  0.543139  1
  Ni  Ni296  1  0.342797  0.763167  0.573417  1
  Ni  Ni297  1  0.322760  0.472497  0.543139  1
  Ni  Ni298  1  0.471194  0.562387  0.596982  1
  Ni  Ni299  1  0.451161  0.272260  0.567189  1
  Ni  Ni300  1  0.491142  0.853167  0.627081  1
  Ni  Ni301  1  0.804527  0.229054  0.596982  1
  Ni  Ni302  1  0.784494  0.938926  0.567189  1
  Ni  Ni303  1  0.137860  0.895721  0.596982  1
  Ni  Ni304  1  0.824476  0.519834  0.627081  1
  Ni  Ni305  1  0.117828  0.605593  0.567189  1
  Ni  Ni306  1  0.157809  0.186501  0.627081  1
  Ni  Ni307  1  0.577142  0.608429  0.679980  1
  Ni  Ni308  1  0.557932  0.319358  0.650861  1
  Ni  Ni309  1  0.595916  0.891948  0.708870  1
  Ni  Ni310  1  0.910476  0.275096  0.679980  1
  Ni  Ni311  1  0.891265  0.986025  0.650861  1
  Ni  Ni312  1  0.243809  0.941763  0.679980  1
  Ni  Ni313  1  0.929249  0.558614  0.708870  1
  Ni  Ni314  1  0.224599  0.652692  0.650861  1
  Ni  Ni315  1  0.262582  0.225281  0.708870  1
  Ni  Ni316  1  0.500457  0.496369  0.644069  1
  Ni  Ni317  1  0.545629  0.062032  0.702454  1
  Ni  Ni318  1  0.520643  0.781860  0.673836  1
  Ni  Ni319  1  0.833790  0.163036  0.644069  1
  Ni  Ni320  1  0.878962  0.728699  0.702454  1
  Ni  Ni321  1  0.167123  0.829703  0.644069  1
  Ni  Ni322  1  0.853976  0.448526  0.673836  1
  Ni  Ni323  1  0.212295  0.395366  0.702454  1
  Ni  Ni324  1  0.187309  0.115193  0.673836  1
  Ni  Ni325  1  0.704421  0.400359  0.703047  1
  Ni  Ni326  1  0.690298  0.118951  0.673612  1
  Ni  Ni327  1  0.671617  0.828640  0.643787  1
  Ni  Ni328  1  0.037754  0.067026  0.703047  1
  Ni  Ni329  1  0.023631  0.785618  0.673612  1
  Ni  Ni330  1  0.371087  0.733693  0.703047  1
  Ni  Ni331  1  0.004951  0.495307  0.643787  1
  Ni  Ni332  1  0.356964  0.452285  0.673612  1
  Ni  Ni333  1  0.338284  0.161974  0.643787  1
  Ni  Ni334  1  0.724443  0.655798  0.649325  1
  Ni  Ni335  1  0.768965  0.228391  0.708103  1
  Ni  Ni336  1  0.744786  0.944599  0.678095  1
  Ni  Ni337  1  0.057777  0.322464  0.649325  1
  Ni  Ni338  1  0.102299  0.895057  0.708103  1
  Ni  Ni339  1  0.391110  0.989131  0.649325  1
  Ni  Ni340  1  0.078119  0.611266  0.678095  1
  Ni  Ni341  1  0.435632  0.561724  0.708103  1
  Ni  Ni342  1  0.411452  0.277933  0.678095  1
  Ni  Ni343  1  0.750450  0.579507  0.695514  1
  Ni  Ni344  1  0.732822  0.296436  0.665977  1
  Ni  Ni345  1  0.716595  0.010546  0.634291  1
  Ni  Ni346  1  0.083783  0.246174  0.695514  1
  Ni  Ni347  1  0.066155  0.963102  0.665977  1
  Ni  Ni348  1  0.417116  0.912841  0.695514  1
  Ni  Ni349  1  0.049929  0.677213  0.634291  1
  Ni  Ni350  1  0.399488  0.629769  0.665977  1
  Ni  Ni351  1  0.383262  0.343880  0.634291  1
  Ni  Ni352  1  0.531226  0.429028  0.688127  1
  Ni  Ni353  1  0.512035  0.141814  0.658478  1
  Ni  Ni354  1  0.540621  0.713827  0.716388  1
  Ni  Ni355  1  0.864560  0.095694  0.688127  1
  Ni  Ni356  1  0.845369  0.808481  0.658478  1
  Ni  Ni357  1  0.197893  0.762361  0.688127  1
  Ni  Ni358  1  0.873954  0.380494  0.716388  1
  Ni  Ni359  1  0.178702  0.475147  0.658478  1
  Ni  Ni360  1  0.207287  0.047160  0.716388  1
