# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.39380225
_cell_length_b   12.45502744
_cell_length_c   46.99770375
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.07967390
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni162
_cell_volume   3740.19613583
_cell_formula_units_Z   162
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  0.550258  0.201998  0.315810  1
  Ni  Ni2  1  0.527733  0.881724  0.300891  1
  Ni  Ni3  1  0.507036  0.556660  0.286854  1
  Ni  Ni4  1  0.883592  0.868665  0.315810  1
  Ni  Ni5  1  0.861066  0.548390  0.300891  1
  Ni  Ni6  1  0.216925  0.535331  0.315810  1
  Ni  Ni7  1  0.840370  0.223327  0.286854  1
  Ni  Ni8  1  0.194399  0.215057  0.300891  1
  Ni  Ni9  1  0.173703  0.889994  0.286854  1
  Ni  Ni10  1  0.637831  0.382434  0.298090  1
  Ni  Ni11  1  0.622917  0.063887  0.284887  1
  Ni  Ni12  1  0.657960  0.701574  0.312923  1
  Ni  Ni13  1  0.971164  0.049101  0.298090  1
  Ni  Ni14  1  0.956251  0.730554  0.284887  1
  Ni  Ni15  1  0.304497  0.715768  0.298090  1
  Ni  Ni16  1  0.991293  0.368240  0.312923  1
  Ni  Ni17  1  0.289584  0.397220  0.284887  1
  Ni  Ni18  1  0.324627  0.034907  0.312923  1
  Ni  Ni19  1  0.620908  0.160233  0.365380  1
  Ni  Ni20  1  0.599588  0.838293  0.348445  1
  Ni  Ni21  1  0.575950  0.517092  0.332464  1
  Ni  Ni22  1  0.954241  0.826900  0.365380  1
  Ni  Ni23  1  0.932922  0.504960  0.348445  1
  Ni  Ni24  1  0.287574  0.493566  0.365380  1
  Ni  Ni25  1  0.909283  0.183759  0.332464  1
  Ni  Ni26  1  0.266255  0.171626  0.348445  1
  Ni  Ni27  1  0.242616  0.850425  0.332464  1
  Ni  Ni28  1  0.705850  0.340121  0.345699  1
  Ni  Ni29  1  0.681619  0.021741  0.330358  1
  Ni  Ni30  1  0.726429  0.660695  0.362484  1
  Ni  Ni31  1  0.039183  1.006788  0.345699  1
  Ni  Ni32  1  0.014952  0.688408  0.330358  1
  Ni  Ni33  1  0.372517  0.673455  0.345699  1
  Ni  Ni34  1  0.059763  0.327362  0.362484  1
  Ni  Ni35  1  0.348285  0.355074  0.330358  1
  Ni  Ni36  1  0.393096  0.994029  0.362484  1
  Ni  Ni37  1  0.690198  0.124826  0.415999  1
  Ni  Ni38  1  0.667638  0.802615  0.399073  1
  Ni  Ni39  1  0.644835  0.480559  0.382298  1
  Ni  Ni40  1  0.023532  0.791493  0.415999  1
  Ni  Ni41  1  1.000971  0.469282  0.399073  1
  Ni  Ni42  1  0.356865  0.458159  0.415999  1
  Ni  Ni43  1  0.978168  0.147226  0.382298  1
  Ni  Ni44  1  0.334305  0.135948  0.399073  1
  Ni  Ni45  1  0.311502  0.813892  0.382298  1
  Ni  Ni46  1  0.774192  0.304705  0.396496  1
  Ni  Ni47  1  0.750653  0.982649  0.379715  1
  Ni  Ni48  1  0.797124  0.626607  0.413261  1
  Ni  Ni49  1  0.107525  0.971371  0.396496  1
  Ni  Ni50  1  0.083987  0.649315  0.379715  1
  Ni  Ni51  1  0.440859  0.638038  0.396496  1
  Ni  Ni52  1  0.130457  0.293274  0.413261  1
  Ni  Ni53  1  0.417320  0.315982  0.379715  1
  Ni  Ni54  1  0.463791  0.959940  0.413261  1
  Ni  Ni55  1  0.759067  0.090612  0.466425  1
  Ni  Ni56  1  0.736039  0.768701  0.449599  1
  Ni  Ni57  1  0.713173  0.446801  0.432833  1
  Ni  Ni58  1  0.092401  0.757278  0.466425  1
  Ni  Ni59  1  0.069372  0.435367  0.449599  1
  Ni  Ni60  1  0.425734  0.423945  0.466425  1
  Ni  Ni61  1  0.046506  0.113468  0.432833  1
  Ni  Ni62  1  0.402705  0.102034  0.449599  1
  Ni  Ni63  1  0.379839  0.780134  0.432833  1
  Ni  Ni64  1  0.843489  0.270625  0.446862  1
  Ni  Ni65  1  0.820371  0.948607  0.430088  1
  Ni  Ni66  1  0.866498  0.592539  0.463644  1
  Ni  Ni67  1  0.176823  0.937292  0.446862  1
  Ni  Ni68  1  0.153704  0.615273  0.430088  1
  Ni  Ni69  1  0.510156  0.603958  0.446862  1
  Ni  Ni70  1  0.199831  0.259205  0.463644  1
  Ni  Ni71  1  0.487038  0.281940  0.430088  1
  Ni  Ni72  1  0.533165  0.925872  0.463644  1
  Ni  Ni73  1  0.828206  0.056296  0.516835  1
  Ni  Ni74  1  0.805153  0.734407  0.500033  1
  Ni  Ni75  1  0.782145  0.412509  0.483237  1
  Ni  Ni76  1  0.161540  0.722963  0.516835  1
  Ni  Ni77  1  0.138486  0.401073  0.500033  1
  Ni  Ni78  1  0.494873  0.389630  0.516835  1
  Ni  Ni79  1  0.115478  0.079175  0.483237  1
  Ni  Ni80  1  0.471820  0.067740  0.500033  1
  Ni  Ni81  1  0.448811  0.745842  0.483237  1
  Ni  Ni82  1  0.912624  0.236285  0.497248  1
  Ni  Ni83  1  0.889570  0.914395  0.480447  1
  Ni  Ni84  1  0.935632  0.558183  0.514045  1
  Ni  Ni85  1  0.245957  0.902952  0.497248  1
  Ni  Ni86  1  0.222903  0.581062  0.480447  1
  Ni  Ni87  1  0.579290  0.569618  0.497248  1
  Ni  Ni88  1  0.268965  0.224850  0.514045  1
  Ni  Ni89  1  0.556237  0.247729  0.480447  1
  Ni  Ni90  1  0.602299  0.891516  0.514045  1
  Ni  Ni91  1  0.897406  0.022085  0.567194  1
  Ni  Ni92  1  0.874287  0.700067  0.550420  1
  Ni  Ni93  1  0.851278  0.378153  0.533638  1
  Ni  Ni94  1  0.230739  0.688752  0.567194  1
  Ni  Ni95  1  0.207620  0.366733  0.550420  1
  Ni  Ni96  1  0.564072  0.355418  0.567194  1
  Ni  Ni97  1  0.184612  0.044820  0.533638  1
  Ni  Ni98  1  0.540954  0.033400  0.550420  1
  Ni  Ni99  1  0.517945  0.711486  0.533638  1
  Ni  Ni100  1  0.981738  0.201991  0.547683  1
  Ni  Ni101  1  0.958709  0.880080  0.530856  1
  Ni  Ni102  1  0.004604  0.523891  0.564448  1
  Ni  Ni103  1  0.315071  0.868658  0.547683  1
  Ni  Ni104  1  0.292043  0.546747  0.530856  1
  Ni  Ni105  1  0.648404  0.535324  0.547683  1
  Ni  Ni106  1  0.337937  0.190557  0.564448  1
  Ni  Ni107  1  0.625376  0.213413  0.530856  1
  Ni  Ni108  1  0.671270  0.857224  0.564448  1
  Ni  Ni109  1  0.967123  0.988043  0.617567  1
  Ni  Ni110  1  0.943584  0.665987  0.600786  1
  Ni  Ni111  1  0.920653  0.344085  0.584020  1
  Ni  Ni112  1  0.300456  0.654710  0.617567  1
  Ni  Ni113  1  0.276918  0.332654  0.600786  1
  Ni  Ni114  1  0.633790  0.321376  0.617567  1
  Ni  Ni115  1  0.253986  0.010751  0.584020  1
  Ni  Ni116  1  0.610251  0.999320  0.600786  1
  Ni  Ni117  1  0.587319  0.677418  0.584020  1
  Ni  Ni118  1  0.050138  0.168077  0.598209  1
  Ni  Ni119  1  0.027578  0.845866  0.581283  1
  Ni  Ni120  1  0.072942  0.490133  0.614983  1
  Ni  Ni121  1  0.383472  0.834743  0.598209  1
  Ni  Ni122  1  0.360911  0.512532  0.581283  1
  Ni  Ni123  1  0.716805  0.501410  0.598209  1
  Ni  Ni124  1  0.406275  0.156799  0.614983  1
  Ni  Ni125  1  0.694245  0.179199  0.581283  1
  Ni  Ni126  1  0.739608  0.823466  0.614983  1
  Ni  Ni127  1  0.036158  0.948951  0.666924  1
  Ni  Ni128  1  0.011926  0.630570  0.651582  1
  Ni  Ni129  1  0.991347  0.309996  0.634797  1
  Ni  Ni130  1  0.369491  0.615617  0.666924  1
  Ni  Ni131  1  0.345260  0.297237  0.651582  1
  Ni  Ni132  1  0.702824  0.282284  0.666924  1
  Ni  Ni133  1  0.324680  0.976663  0.634797  1
  Ni  Ni134  1  0.678593  0.963904  0.651582  1
  Ni  Ni135  1  0.658014  0.643330  0.634797  1
  Ni  Ni136  1  0.118188  0.132399  0.648837  1
  Ni  Ni137  1  0.096869  0.810459  0.631902  1
  Ni  Ni138  1  0.141827  0.453600  0.664818  1
  Ni  Ni139  1  0.451521  0.799065  0.648837  1
  Ni  Ni140  1  0.430202  0.477125  0.631902  1
  Ni  Ni141  1  0.784855  0.465732  0.648837  1
  Ni  Ni142  1  0.475160  0.120266  0.664818  1
  Ni  Ni143  1  0.763535  0.143792  0.631902  1
  Ni  Ni144  1  0.808494  0.786933  0.664818  1
  Ni  Ni145  1  0.094859  0.906805  0.712395  1
  Ni  Ni146  1  0.079946  0.588257  0.699192  1
  Ni  Ni147  1  0.059816  0.269118  0.684359  1
  Ni  Ni148  1  0.428193  0.573471  0.712395  1
  Ni  Ni149  1  0.413279  0.254924  0.699192  1
  Ni  Ni150  1  0.761526  0.240138  0.712395  1
  Ni  Ni151  1  0.393150  0.935785  0.684359  1
  Ni  Ni152  1  0.746612  0.921591  0.699192  1
  Ni  Ni153  1  0.726483  0.602451  0.684359  1
  Ni  Ni154  1  0.190044  0.088968  0.696391  1
  Ni  Ni155  1  0.167518  0.768694  0.681471  1
  Ni  Ni156  1  0.210740  0.414031  0.710427  1
  Ni  Ni157  1  0.523377  0.755635  0.696391  1
  Ni  Ni158  1  0.500852  0.435360  0.681471  1
  Ni  Ni159  1  0.856711  0.422301  0.696391  1
  Ni  Ni160  1  0.544073  0.080698  0.710427  1
  Ni  Ni161  1  0.834185  0.102027  0.681471  1
  Ni  Ni162  1  0.877407  0.747365  0.710427  1
