# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.90524820
_cell_length_b   12.56947070
_cell_length_c   48.02049615
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.14288888
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni216
_cell_volume   5324.67710259
_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  0.022216  0.760633  0.279034  1
  Ni  Ni2  1  0.355549  0.427300  0.279034  1
  Ni  Ni3  1  0.293878  0.759614  0.290028  1
  Ni  Ni4  1  0.688883  0.093967  0.279034  1
  Ni  Ni5  1  0.627212  0.426281  0.290028  1
  Ni  Ni6  1  0.567916  0.749593  0.301751  1
  Ni  Ni7  1  0.960545  0.092947  0.290028  1
  Ni  Ni8  1  0.901250  0.416260  0.301751  1
  Ni  Ni9  1  0.234583  0.082927  0.301751  1
  Ni  Ni10  1  0.035077  0.581002  0.299205  1
  Ni  Ni11  1  0.368410  0.247668  0.299205  1
  Ni  Ni12  1  0.302039  0.579153  0.311356  1
  Ni  Ni13  1  0.701743  0.914335  0.299205  1
  Ni  Ni14  1  0.635372  0.245819  0.311356  1
  Ni  Ni15  1  0.760041  0.593671  0.287670  1
  Ni  Ni16  1  0.968706  0.912486  0.311356  1
  Ni  Ni17  1  0.093374  0.260338  0.287670  1
  Ni  Ni18  1  0.426707  0.927004  0.287670  1
  Ni  Ni19  1  0.841369  0.740747  0.314997  1
  Ni  Ni20  1  0.174702  0.407414  0.314997  1
  Ni  Ni21  1  0.111019  0.734719  0.327241  1
  Ni  Ni22  1  0.508035  0.074080  0.314997  1
  Ni  Ni23  1  0.444352  0.401386  0.327241  1
  Ni  Ni24  1  0.381304  0.730422  0.339054  1
  Ni  Ni25  1  0.777685  0.068053  0.327241  1
  Ni  Ni26  1  0.714637  0.397089  0.339054  1
  Ni  Ni27  1  0.047971  0.063755  0.339054  1
  Ni  Ni28  1  0.840594  0.562351  0.336168  1
  Ni  Ni29  1  0.173927  0.229017  0.336168  1
  Ni  Ni30  1  0.110550  0.556202  0.348637  1
  Ni  Ni31  1  0.507260  0.895684  0.336168  1
  Ni  Ni32  1  0.443883  0.222868  0.348637  1
  Ni  Ni33  1  0.568540  0.571047  0.323567  1
  Ni  Ni34  1  0.777217  0.889535  0.348637  1
  Ni  Ni35  1  0.901873  0.237714  0.323567  1
  Ni  Ni36  1  0.235207  0.904380  0.323567  1
  Ni  Ni37  1  0.652641  0.721162  0.351033  1
  Ni  Ni38  1  0.985974  0.387828  0.351033  1
  Ni  Ni39  1  0.923280  0.714350  0.363941  1
  Ni  Ni40  1  0.319307  0.054495  0.351033  1
  Ni  Ni41  1  0.256613  0.381017  0.363941  1
  Ni  Ni42  1  0.193926  0.708296  0.376195  1
  Ni  Ni43  1  0.589946  0.047683  0.363941  1
  Ni  Ni44  1  0.527259  0.374962  0.376195  1
  Ni  Ni45  1  0.860593  0.041629  0.376195  1
  Ni  Ni46  1  0.649732  0.543333  0.373406  1
  Ni  Ni47  1  0.983066  0.210000  0.373406  1
  Ni  Ni48  1  0.920650  0.535483  0.385825  1
  Ni  Ni49  1  0.316399  0.876667  0.373406  1
  Ni  Ni50  1  0.253983  0.202150  0.385825  1
  Ni  Ni51  1  0.379542  0.550306  0.360950  1
  Ni  Ni52  1  0.587317  0.868817  0.385825  1
  Ni  Ni53  1  0.712875  0.216972  0.360950  1
  Ni  Ni54  1  0.046208  0.883639  0.360950  1
  Ni  Ni55  1  0.464331  0.701586  0.388310  1
  Ni  Ni56  1  0.797664  0.368253  0.388310  1
  Ni  Ni57  1  0.734764  0.694348  0.400682  1
  Ni  Ni58  1  0.130998  0.034919  0.388310  1
  Ni  Ni59  1  0.068097  0.361014  0.400682  1
  Ni  Ni60  1  0.005311  0.687530  0.413146  1
  Ni  Ni61  1  0.401430  0.027681  0.400682  1
  Ni  Ni62  1  0.338645  0.354197  0.413146  1
  Ni  Ni63  1  0.671978  0.020864  0.413146  1
  Ni  Ni64  1  0.461160  0.522568  0.410626  1
  Ni  Ni65  1  0.794493  0.189235  0.410626  1
  Ni  Ni66  1  0.731699  0.515542  0.422987  1
  Ni  Ni67  1  0.127827  0.855902  0.410626  1
  Ni  Ni68  1  0.065033  0.182209  0.422987  1
  Ni  Ni69  1  0.190947  0.529210  0.398298  1
  Ni  Ni70  1  0.398366  0.848876  0.422987  1
  Ni  Ni71  1  0.524281  0.195876  0.398298  1
  Ni  Ni72  1  0.857614  0.862543  0.398298  1
  Ni  Ni73  1  0.275889  0.680978  0.425449  1
  Ni  Ni74  1  0.609222  0.347644  0.425449  1
  Ni  Ni75  1  0.546332  0.674082  0.437731  1
  Ni  Ni76  1  0.942556  0.014311  0.425449  1
  Ni  Ni77  1  0.879665  0.340749  0.437731  1
  Ni  Ni78  1  0.816781  0.667186  0.450115  1
  Ni  Ni79  1  0.212998  0.007416  0.437731  1
  Ni  Ni80  1  0.150114  0.333852  0.450115  1
  Ni  Ni81  1  0.483447  1.000519  0.450115  1
  Ni  Ni82  1  0.272733  0.501882  0.447779  1
  Ni  Ni83  1  0.606066  0.168548  0.447779  1
  Ni  Ni84  1  0.543220  0.495091  0.460124  1
  Ni  Ni85  1  0.939400  0.835215  0.447779  1
  Ni  Ni86  1  0.876553  0.161758  0.460124  1
  Ni  Ni87  1  1.002220  0.508582  0.435389  1
  Ni  Ni88  1  0.209886  0.828425  0.460124  1
  Ni  Ni89  1  0.335553  0.175248  0.435389  1
  Ni  Ni90  1  0.668887  0.841915  0.435389  1
  Ni  Ni91  1  0.087363  0.660382  0.462487  1
  Ni  Ni92  1  0.420696  0.327048  0.462487  1
  Ni  Ni93  1  0.357903  0.653612  0.474830  1
  Ni  Ni94  1  0.754030  0.993715  0.462487  1
  Ni  Ni95  1  0.691236  0.320278  0.474830  1
  Ni  Ni96  1  0.628377  0.646752  0.487174  1
  Ni  Ni97  1  0.024569  0.986945  0.474830  1
  Ni  Ni98  1  0.961710  0.313419  0.487174  1
  Ni  Ni99  1  0.295043  0.980086  0.487174  1
  Ni  Ni100  1  0.084249  0.481361  0.484852  1
  Ni  Ni101  1  0.417582  0.148028  0.484852  1
  Ni  Ni102  1  0.354809  0.474567  0.497216  1
  Ni  Ni103  1  0.750915  0.814694  0.484852  1
  Ni  Ni104  1  0.688143  0.141234  0.497216  1
  Ni  Ni105  1  0.813725  0.488181  0.472479  1
  Ni  Ni106  1  0.021476  0.807901  0.497216  1
  Ni  Ni107  1  0.147058  0.154848  0.472479  1
  Ni  Ni108  1  0.480391  0.821514  0.472479  1
  Ni  Ni109  1  0.898888  0.639911  0.499533  1
  Ni  Ni110  1  0.232222  0.306578  0.499533  1
  Ni  Ni111  1  0.169449  0.633117  0.511898  1
  Ni  Ni112  1  0.565555  0.973244  0.499533  1
  Ni  Ni113  1  0.502782  0.299784  0.511898  1
  Ni  Ni114  1  0.439973  0.626297  0.524271  1
  Ni  Ni115  1  0.836116  0.966451  0.511898  1
  Ni  Ni116  1  0.773307  0.292964  0.524271  1
  Ni  Ni117  1  0.106640  0.959631  0.524271  1
  Ni  Ni118  1  0.895795  0.460867  0.521919  1
  Ni  Ni119  1  0.229129  0.127533  0.521919  1
  Ni  Ni120  1  0.166335  0.454097  0.534263  1
  Ni  Ni121  1  0.562462  0.794200  0.521919  1
  Ni  Ni122  1  0.499668  0.120764  0.534263  1
  Ni  Ni123  1  0.625321  0.467726  0.509575  1
  Ni  Ni124  1  0.833001  0.787430  0.534263  1
  Ni  Ni125  1  0.958655  0.134393  0.509575  1
  Ni  Ni126  1  0.291988  0.801060  0.509575  1
  Ni  Ni127  1  0.710478  0.619387  0.536626  1
  Ni  Ni128  1  0.043811  0.286054  0.536626  1
  Ni  Ni129  1  0.980965  0.612597  0.548971  1
  Ni  Ni130  1  0.377145  0.952720  0.536626  1
  Ni  Ni131  1  0.314298  0.279263  0.548971  1
  Ni  Ni132  1  0.251478  0.605897  0.561360  1
  Ni  Ni133  1  0.647631  0.945930  0.548971  1
  Ni  Ni134  1  0.584811  0.272563  0.561360  1
  Ni  Ni135  1  0.918144  0.939230  0.561360  1
  Ni  Ni136  1  0.707366  0.440396  0.559019  1
  Ni  Ni137  1  0.040699  0.107063  0.559019  1
  Ni  Ni138  1  0.977809  0.433501  0.571300  1
  Ni  Ni139  1  0.374033  0.773729  0.559019  1
  Ni  Ni140  1  0.311142  0.100168  0.571300  1
  Ni  Ni141  1  0.436917  0.447293  0.546634  1
  Ni  Ni142  1  0.644476  0.766834  0.571300  1
  Ni  Ni143  1  0.770251  0.113959  0.546634  1
  Ni  Ni144  1  0.103584  0.780626  0.546634  1
  Ni  Ni145  1  0.521998  0.598936  0.573763  1
  Ni  Ni146  1  0.855332  0.265603  0.573763  1
  Ni  Ni147  1  0.792538  0.591910  0.586124  1
  Ni  Ni148  1  0.188665  0.932270  0.573763  1
  Ni  Ni149  1  0.125871  0.258577  0.586124  1
  Ni  Ni150  1  0.062750  0.585269  0.598451  1
  Ni  Ni151  1  0.459204  0.925244  0.586124  1
  Ni  Ni152  1  0.396084  0.251935  0.598451  1
  Ni  Ni153  1  0.729417  0.918602  0.598451  1
  Ni  Ni154  1  0.518934  0.420131  0.596068  1
  Ni  Ni155  1  0.852267  0.086798  0.596068  1
  Ni  Ni156  1  0.789367  0.412892  0.608439  1
  Ni  Ni157  1  0.185601  0.753464  0.596068  1
  Ni  Ni158  1  0.122700  0.079559  0.608439  1
  Ni  Ni159  1  0.248386  0.426948  0.583603  1
  Ni  Ni160  1  0.456034  0.746226  0.608439  1
  Ni  Ni161  1  0.581720  0.093615  0.583603  1
  Ni  Ni162  1  0.915053  0.760282  0.583603  1
  Ni  Ni163  1  0.333048  0.578995  0.610925  1
  Ni  Ni164  1  0.666381  0.245662  0.610925  1
  Ni  Ni165  1  0.603965  0.571145  0.623344  1
  Ni  Ni166  1  0.999714  0.912328  0.610925  1
  Ni  Ni167  1  0.937299  0.237812  0.623344  1
  Ni  Ni168  1  0.874156  0.564173  0.635799  1
  Ni  Ni169  1  0.270632  0.904478  0.623344  1
  Ni  Ni170  1  0.207490  0.230839  0.635799  1
  Ni  Ni171  1  0.540823  0.897506  0.635799  1
  Ni  Ni172  1  0.330418  0.400128  0.632808  1
  Ni  Ni173  1  0.663751  0.066795  0.632808  1
  Ni  Ni174  1  0.601057  0.393317  0.645716  1
  Ni  Ni175  1  0.997085  0.733462  0.632808  1
  Ni  Ni176  1  0.934390  0.059984  0.645716  1
  Ni  Ni177  1  0.059772  0.406183  0.620555  1
  Ni  Ni178  1  0.267724  0.726650  0.645716  1
  Ni  Ni179  1  0.393105  0.072850  0.620555  1
  Ni  Ni180  1  0.726438  0.739516  0.620555  1
  Ni  Ni181  1  0.143148  0.558277  0.648112  1
  Ni  Ni182  1  0.476481  0.224943  0.648112  1
  Ni  Ni183  1  0.413104  0.552128  0.660581  1
  Ni  Ni184  1  0.809814  0.891610  0.648112  1
  Ni  Ni185  1  0.746438  0.218794  0.660581  1
  Ni  Ni186  1  0.685158  0.543431  0.673182  1
  Ni  Ni187  1  0.079771  0.885461  0.660581  1
  Ni  Ni188  1  0.018491  0.210098  0.673182  1
  Ni  Ni189  1  0.351824  0.876765  0.673182  1
  Ni  Ni190  1  0.142679  0.379759  0.669508  1
  Ni  Ni191  1  0.476012  0.046426  0.669508  1
  Ni  Ni192  1  0.412329  0.373731  0.681753  1
  Ni  Ni193  1  0.809346  0.713093  0.669508  1
  Ni  Ni194  1  0.745663  0.040398  0.681753  1
  Ni  Ni195  1  0.872394  0.384056  0.657695  1
  Ni  Ni196  1  0.078996  0.707065  0.681753  1
  Ni  Ni197  1  0.205727  0.050723  0.657695  1
  Ni  Ni198  1  0.539060  0.717390  0.657695  1
  Ni  Ni199  1  0.951659  0.535326  0.685393  1
  Ni  Ni200  1  0.284992  0.201993  0.685393  1
  Ni  Ni201  1  0.218621  0.533477  0.697545  1
  Ni  Ni202  1  0.618326  0.868659  0.685393  1
  Ni  Ni203  1  0.551954  0.200143  0.697545  1
  Ni  Ni204  1  0.493657  0.520807  0.709080  1
  Ni  Ni205  1  0.885288  0.866810  0.697545  1
  Ni  Ni206  1  0.826990  0.187474  0.709080  1
  Ni  Ni207  1  0.160324  0.854141  0.709080  1
  Ni  Ni208  1  0.959819  0.354865  0.706722  1
  Ni  Ni209  1  0.293153  0.021531  0.706722  1
  Ni  Ni210  1  0.231482  0.353845  0.717716  1
  Ni  Ni211  1  0.626486  0.688198  0.706722  1
  Ni  Ni212  1  0.564815  0.020512  0.717716  1
  Ni  Ni213  1  0.685781  0.364885  0.694998  1
  Ni  Ni214  1  0.898148  0.687179  0.717716  1
  Ni  Ni215  1  0.019115  0.031552  0.694998  1
  Ni  Ni216  1  0.352448  0.698219  0.694998  1
