# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.95358387
_cell_length_b   12.66160251
_cell_length_c   47.15057086
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   113.09346927
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni216
_cell_volume   5466.12774981
_cell_formula_units_Z   216
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
  Ni  Ni1  1  0.136398  0.042422  0.328674  1
  Ni  Ni2  1  0.636568  0.042963  0.329216  1
  Ni  Ni3  1  0.569224  0.407810  0.312826  1
  Ni  Ni4  1  0.001385  0.774312  0.297473  1
  Ni  Ni5  1  0.068671  0.407572  0.312776  1
  Ni  Ni6  1  0.502155  0.773690  0.297276  1
  Ni  Ni7  1  0.601795  0.223726  0.320427  1
  Ni  Ni8  1  0.101892  0.223733  0.320428  1
  Ni  Ni9  1  0.035598  0.591253  0.304959  1
  Ni  Ni10  1  0.470653  0.954313  0.290673  1
  Ni  Ni11  1  0.535160  0.590393  0.304978  1
  Ni  Ni12  1  0.963339  0.954286  0.290665  1
  Ni  Ni13  1  0.352698  0.225443  0.320846  1
  Ni  Ni14  1  0.851782  0.223604  0.320420  1
  Ni  Ni15  1  0.786001  0.591251  0.304949  1
  Ni  Ni16  1  0.919269  0.861066  0.336779  1
  Ni  Ni17  1  0.285185  0.591275  0.304950  1
  Ni  Ni18  1  0.717639  0.955587  0.290285  1
  Ni  Ni19  1  0.385903  0.042447  0.328693  1
  Ni  Ni20  1  0.886232  0.042962  0.329212  1
  Ni  Ni21  1  0.818871  0.407568  0.312775  1
  Ni  Ni22  1  0.252767  0.774367  0.297474  1
  Ni  Ni23  1  0.318552  0.407819  0.312826  1
  Ni  Ni24  1  0.751366  0.773679  0.297275  1
  Ni  Ni25  1  0.841025  0.952709  0.376211  1
  Ni  Ni26  1  0.341163  0.952652  0.375968  1
  Ni  Ni27  1  0.272584  0.315959  0.359730  1
  Ni  Ni28  1  0.704591  0.679625  0.344099  1
  Ni  Ni29  1  0.772687  0.315640  0.359598  1
  Ni  Ni30  1  0.204961  0.680155  0.344086  1
  Ni  Ni31  1  0.307168  0.134634  0.368001  1
  Ni  Ni32  1  0.807358  0.134990  0.368181  1
  Ni  Ni33  1  0.739094  0.498036  0.351844  1
  Ni  Ni34  1  0.170881  0.861958  0.336211  1
  Ni  Ni35  1  0.238745  0.498038  0.351845  1
  Ni  Ni36  1  0.670644  0.861483  0.336526  1
  Ni  Ni37  1  0.057699  0.134504  0.367938  1
  Ni  Ni38  1  0.556537  0.134513  0.367944  1
  Ni  Ni39  1  0.488760  0.497719  0.351886  1
  Ni  Ni40  1  0.625030  0.770399  0.383964  1
  Ni  Ni41  1  0.988901  0.497996  0.351820  1
  Ni  Ni42  1  0.421603  0.861065  0.336783  1
  Ni  Ni43  1  0.091173  0.952657  0.375962  1
  Ni  Ni44  1  0.591365  0.952708  0.376214  1
  Ni  Ni45  1  0.523149  0.315956  0.359729  1
  Ni  Ni46  1  0.955000  0.680152  0.344085  1
  Ni  Ni47  1  0.022733  0.315640  0.359599  1
  Ni  Ni48  1  0.454841  0.679625  0.344101  1
  Ni  Ni49  1  0.545405  0.861239  0.423778  1
  Ni  Ni50  1  0.045443  0.861314  0.423669  1
  Ni  Ni51  1  0.977581  0.225179  0.407679  1
  Ni  Ni52  1  0.409022  0.588426  0.391728  1
  Ni  Ni53  1  0.477331  0.225184  0.407691  1
  Ni  Ni54  1  0.909237  0.588640  0.391691  1
  Ni  Ni55  1  0.011534  0.043337  0.415743  1
  Ni  Ni56  1  0.511340  0.043334  0.415746  1
  Ni  Ni57  1  0.443094  0.406577  0.399579  1
  Ni  Ni58  1  0.874916  0.770335  0.384020  1
  Ni  Ni59  1  0.943087  0.406556  0.399503  1
  Ni  Ni60  1  0.375080  0.770329  0.384024  1
  Ni  Ni61  1  0.761483  0.043423  0.415855  1
  Ni  Ni62  1  0.261410  0.043288  0.415723  1
  Ni  Ni63  1  0.193020  0.406682  0.399556  1
  Ni  Ni64  1  0.329340  0.679199  0.431628  1
  Ni  Ni65  1  0.693278  0.406685  0.399552  1
  Ni  Ni66  1  0.125304  0.770944  0.383730  1
  Ni  Ni67  1  0.795348  0.861243  0.423774  1
  Ni  Ni68  1  0.295381  0.861308  0.423674  1
  Ni  Ni69  1  0.227419  0.225184  0.407692  1
  Ni  Ni70  1  0.659047  0.588430  0.391725  1
  Ni  Ni71  1  0.727180  0.225182  0.407678  1
  Ni  Ni72  1  0.159047  0.588637  0.391694  1
  Ni  Ni73  1  0.249709  0.770109  0.471413  1
  Ni  Ni74  1  0.749684  0.770057  0.471448  1
  Ni  Ni75  1  0.681633  0.134006  0.455511  1
  Ni  Ni76  1  0.113380  0.497423  0.439451  1
  Ni  Ni77  1  0.181705  0.133977  0.455499  1
  Ni  Ni78  1  0.613428  0.497371  0.439472  1
  Ni  Ni79  1  0.715705  0.952042  0.463532  1
  Ni  Ni80  1  0.215695  0.952042  0.463470  1
  Ni  Ni81  1  0.147627  0.315795  0.447487  1
  Ni  Ni82  1  0.579340  0.679202  0.431615  1
  Ni  Ni83  1  0.647593  0.315805  0.447479  1
  Ni  Ni84  1  0.079463  0.679434  0.431525  1
  Ni  Ni85  1  0.465666  0.952036  0.463485  1
  Ni  Ni86  1  0.965731  0.952041  0.463481  1
  Ni  Ni87  1  0.897587  0.315745  0.447449  1
  Ni  Ni88  1  0.033801  0.588284  0.479320  1
  Ni  Ni89  1  0.397589  0.315766  0.447491  1
  Ni  Ni90  1  0.829352  0.679211  0.431619  1
  Ni  Ni91  1  0.499695  0.770051  0.471456  1
  Ni  Ni92  1  0.999738  0.770116  0.471405  1
  Ni  Ni93  1  0.931769  0.134006  0.455514  1
  Ni  Ni94  1  0.363388  0.497361  0.439478  1
  Ni  Ni95  1  0.431650  0.133976  0.455496  1
  Ni  Ni96  1  0.863509  0.497433  0.439444  1
  Ni  Ni97  1  0.954144  0.679081  0.519195  1
  Ni  Ni98  1  0.454084  0.679043  0.519229  1
  Ni  Ni99  1  0.385944  0.042713  0.503256  1
  Ni  Ni100  1  0.817902  0.406488  0.487284  1
  Ni  Ni101  1  0.886005  0.042724  0.503271  1
  Ni  Ni102  1  0.317857  0.406452  0.487319  1
  Ni  Ni103  1  0.419992  0.860829  0.511245  1
  Ni  Ni104  1  0.920013  0.860830  0.511234  1
  Ni  Ni105  1  0.851942  0.224635  0.495268  1
  Ni  Ni106  1  0.283730  0.588194  0.479360  1
  Ni  Ni107  1  0.351922  0.224623  0.495281  1
  Ni  Ni108  1  0.783777  0.588223  0.479344  1
  Ni  Ni109  1  0.170002  0.860848  0.511235  1
  Ni  Ni110  1  0.670012  0.860829  0.511263  1
  Ni  Ni111  1  0.601919  0.224643  0.495275  1
  Ni  Ni112  1  0.738225  0.497316  0.527118  1
  Ni  Ni113  1  0.101953  0.224632  0.495294  1
  Ni  Ni114  1  0.533734  0.588189  0.479361  1
  Ni  Ni115  1  0.204108  0.679074  0.519210  1
  Ni  Ni116  1  0.704074  0.679049  0.519214  1
  Ni  Ni117  1  0.635947  0.042720  0.503266  1
  Ni  Ni118  1  0.067846  0.406464  0.487298  1
  Ni  Ni119  1  0.135954  0.042718  0.503261  1
  Ni  Ni120  1  0.567868  0.406476  0.487306  1
  Ni  Ni121  1  0.658463  0.588096  0.566999  1
  Ni  Ni122  1  0.158528  0.588069  0.567003  1
  Ni  Ni123  1  0.090209  0.951494  0.551041  1
  Ni  Ni124  1  0.522208  0.315357  0.535056  1
  Ni  Ni125  1  0.590261  0.951485  0.551041  1
  Ni  Ni126  1  0.022193  0.315324  0.535076  1
  Ni  Ni127  1  0.124442  0.769876  0.559084  1
  Ni  Ni128  1  0.624413  0.769862  0.559097  1
  Ni  Ni129  1  0.556203  0.133370  0.543020  1
  Ni  Ni130  1  0.988198  0.497259  0.527134  1
  Ni  Ni131  1  0.056222  0.133374  0.543061  1
  Ni  Ni132  1  0.488156  0.497228  0.527157  1
  Ni  Ni133  1  0.874397  0.769794  0.559058  1
  Ni  Ni134  1  0.374414  0.769852  0.559097  1
  Ni  Ni135  1  0.306181  0.133364  0.543024  1
  Ni  Ni136  1  0.442502  0.406075  0.574894  1
  Ni  Ni137  1  0.806240  0.133373  0.543020  1
  Ni  Ni138  1  0.238159  0.497229  0.527149  1
  Ni  Ni139  1  0.908602  0.588109  0.566989  1
  Ni  Ni140  1  0.408480  0.588056  0.567012  1
  Ni  Ni141  1  0.340235  0.951485  0.551036  1
  Ni  Ni142  1  0.772235  0.315366  0.535045  1
  Ni  Ni143  1  0.840319  0.951494  0.551046  1
  Ni  Ni144  1  0.272206  0.315315  0.535087  1
  Ni  Ni145  1  0.362783  0.496834  0.614706  1
  Ni  Ni146  1  0.862974  0.496968  0.614698  1
  Ni  Ni147  1  0.794842  0.860522  0.598941  1
  Ni  Ni148  1  0.226500  0.224049  0.582817  1
  Ni  Ni149  1  0.294723  0.860624  0.598975  1
  Ni  Ni150  1  0.726533  0.224095  0.582734  1
  Ni  Ni151  1  0.828748  0.678693  0.606873  1
  Ni  Ni152  1  0.328802  0.678816  0.606926  1
  Ni  Ni153  1  0.260382  0.042057  0.590772  1
  Ni  Ni154  1  0.692619  0.406304  0.574796  1
  Ni  Ni155  1  0.760550  0.042061  0.590770  1
  Ni  Ni156  1  0.192504  0.406090  0.574871  1
  Ni  Ni157  1  0.578700  0.678872  0.606916  1
  Ni  Ni158  1  0.078970  0.678879  0.606910  1
  Ni  Ni159  1  0.010500  0.042122  0.590857  1
  Ni  Ni160  1  0.146743  0.314734  0.622521  1
  Ni  Ni161  1  0.510452  0.042041  0.590776  1
  Ni  Ni162  1  0.942507  0.406089  0.574882  1
  Ni  Ni163  1  0.612767  0.496962  0.614703  1
  Ni  Ni164  1  0.112822  0.496840  0.614701  1
  Ni  Ni165  1  0.044521  0.860527  0.598940  1
  Ni  Ni166  1  0.476459  0.224087  0.582740  1
  Ni  Ni167  1  0.544722  0.860623  0.598978  1
  Ni  Ni168  1  0.976454  0.224054  0.582812  1
  Ni  Ni169  1  0.067037  0.405625  0.662196  1
  Ni  Ni170  1  0.567153  0.405809  0.662251  1
  Ni  Ni171  1  0.498926  0.769715  0.646825  1
  Ni  Ni172  1  0.930525  0.132604  0.630513  1
  Ni  Ni173  1  0.998887  0.769271  0.646706  1
  Ni  Ni174  1  0.430598  0.132548  0.630349  1
  Ni  Ni175  1  0.532917  0.587521  0.654577  1
  Ni  Ni176  1  0.033223  0.587522  0.654574  1
  Ni  Ni177  1  0.965093  0.951514  0.638880  1
  Ni  Ni178  1  0.396762  0.314640  0.622595  1
  Ni  Ni179  1  0.465070  0.951486  0.638832  1
  Ni  Ni180  1  0.896638  0.314648  0.622588  1
  Ni  Ni181  1  0.282993  0.587370  0.654592  1
  Ni  Ni182  1  0.782961  0.587299  0.654578  1
  Ni  Ni183  1  0.715529  0.951175  0.638699  1
  Ni  Ni184  1  0.850347  0.224005  0.669849  1
  Ni  Ni185  1  0.214329  0.951184  0.638704  1
  Ni  Ni186  1  0.647003  0.315248  0.622302  1
  Ni  Ni187  1  0.317207  0.405623  0.662199  1
  Ni  Ni188  1  0.817280  0.405809  0.662248  1
  Ni  Ni189  1  0.749018  0.769269  0.646708  1
  Ni  Ni190  1  0.180809  0.132602  0.630516  1
  Ni  Ni191  1  0.249418  0.769714  0.646824  1
  Ni  Ni192  1  0.680683  0.132554  0.630343  1
  Ni  Ni193  1  0.769947  0.311330  0.708802  1
  Ni  Ni194  1  0.270220  0.312142  0.708467  1
  Ni  Ni195  1  0.203109  0.677326  0.693668  1
  Ni  Ni196  1  0.636481  0.043135  0.677746  1
  Ni  Ni197  1  0.702638  0.676732  0.693645  1
  Ni  Ni198  1  0.135814  0.043511  0.678073  1
  Ni  Ni199  1  0.236066  0.493598  0.701429  1
  Ni  Ni200  1  0.735860  0.493169  0.701492  1
  Ni  Ni201  1  0.669491  0.859978  0.685728  1
  Ni  Ni202  1  0.101536  0.224455  0.669573  1
  Ni  Ni203  1  0.168944  0.859975  0.685728  1
  Ni  Ni204  1  0.601753  0.224890  0.669274  1
  Ni  Ni205  1  0.986568  0.493843  0.701440  1
  Ni  Ni206  1  0.485815  0.493861  0.701442  1
  Ni  Ni207  1  0.420075  0.861695  0.686132  1
  Ni  Ni208  1  0.555871  0.132960  0.715185  1
  Ni  Ni209  1  0.919176  0.859893  0.685736  1
  Ni  Ni210  1  0.352275  0.224001  0.669855  1
  Ni  Ni211  1  0.020617  0.312139  0.708464  1
  Ni  Ni212  1  0.520085  0.311377  0.708804  1
  Ni  Ni213  1  0.452685  0.677333  0.693669  1
  Ni  Ni214  1  0.886184  0.043514  0.678072  1
  Ni  Ni215  1  0.952569  0.676731  0.693644  1
  Ni  Ni216  1  0.385186  0.043159  0.677765  1
