# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53219353
_cell_length_b   12.50326400
_cell_length_c   47.98314910
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.13976768
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni162
_cell_volume   3916.23063874
_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  0.550316  0.178805  0.316441  1
  Ni  Ni2  1  0.531873  0.856548  0.298746  1
  Ni  Ni3  1  0.504005  0.537841  0.283468  1
  Ni  Ni4  1  0.883649  0.845472  0.316441  1
  Ni  Ni5  1  0.865207  0.523214  0.298746  1
  Ni  Ni6  1  0.216983  0.512138  0.316441  1
  Ni  Ni7  1  0.837338  0.204508  0.283468  1
  Ni  Ni8  1  0.198540  0.189881  0.298746  1
  Ni  Ni9  1  0.170671  0.871175  0.283468  1
  Ni  Ni10  1  0.634522  0.359319  0.296440  1
  Ni  Ni11  1  0.607235  0.040721  0.280961  1
  Ni  Ni12  1  0.657971  0.680090  0.313693  1
  Ni  Ni13  1  0.967855  0.025986  0.296440  1
  Ni  Ni14  1  0.940568  0.707388  0.280961  1
  Ni  Ni15  1  0.301189  0.692653  0.296440  1
  Ni  Ni16  1  0.991305  0.346757  0.313693  1
  Ni  Ni17  1  0.273901  0.374054  0.280961  1
  Ni  Ni18  1  0.324638  0.013423  0.313693  1
  Ni  Ni19  1  0.620079  0.140947  0.366174  1
  Ni  Ni20  1  0.596322  0.820350  0.349548  1
  Ni  Ni21  1  0.575200  0.498684  0.332997  1
  Ni  Ni22  1  0.953412  0.807614  0.366174  1
  Ni  Ni23  1  0.929655  0.487017  0.349548  1
  Ni  Ni24  1  0.286745  0.474280  0.366174  1
  Ni  Ni25  1  0.908533  0.165351  0.332997  1
  Ni  Ni26  1  0.262989  0.153683  0.349548  1
  Ni  Ni27  1  0.241867  0.832018  0.332997  1
  Ni  Ni28  1  0.704071  0.321978  0.346826  1
  Ni  Ni29  1  0.681861  1.000983  0.330315  1
  Ni  Ni30  1  0.726438  0.643124  0.363504  1
  Ni  Ni31  1  0.037405  0.988645  0.346826  1
  Ni  Ni32  1  0.015194  0.667649  0.330315  1
  Ni  Ni33  1  0.370738  0.655312  0.346826  1
  Ni  Ni34  1  0.059771  0.309790  0.363504  1
  Ni  Ni35  1  0.348527  0.334316  0.330315  1
  Ni  Ni36  1  0.393104  0.976457  0.363504  1
  Ni  Ni37  1  0.689102  0.103479  0.416213  1
  Ni  Ni38  1  0.666200  0.782633  0.399542  1
  Ni  Ni39  1  0.643147  0.461715  0.382902  1
  Ni  Ni40  1  0.022435  0.770146  0.416213  1
  Ni  Ni41  1  0.999534  0.449299  0.399542  1
  Ni  Ni42  1  0.355768  0.436812  0.416213  1
  Ni  Ni43  1  0.976480  0.128382  0.382902  1
  Ni  Ni44  1  0.332867  0.115966  0.399542  1
  Ni  Ni45  1  0.309814  0.795048  0.382902  1
  Ni  Ni46  1  0.772223  0.284592  0.396865  1
  Ni  Ni47  1  0.749418  0.963770  0.380201  1
  Ni  Ni48  1  0.795098  0.605476  0.413535  1
  Ni  Ni49  1  0.105556  0.951258  0.396865  1
  Ni  Ni50  1  0.082752  0.630437  0.380201  1
  Ni  Ni51  1  0.438889  0.617925  0.396865  1
  Ni  Ni52  1  0.128431  0.272142  0.413535  1
  Ni  Ni53  1  0.416085  0.297103  0.380201  1
  Ni  Ni54  1  0.461765  0.938809  0.413535  1
  Ni  Ni55  1  0.757998  0.066049  0.466241  1
  Ni  Ni56  1  0.735061  0.745185  0.449565  1
  Ni  Ni57  1  0.712116  0.424325  0.432896  1
  Ni  Ni58  1  0.091331  0.732716  0.466241  1
  Ni  Ni59  1  0.068395  0.411852  0.449565  1
  Ni  Ni60  1  0.424664  0.399383  0.466241  1
  Ni  Ni61  1  0.045449  0.090991  0.432896  1
  Ni  Ni62  1  0.401728  0.078519  0.449565  1
  Ni  Ni63  1  0.378783  0.757658  0.432896  1
  Ni  Ni64  1  0.840950  0.247179  0.446894  1
  Ni  Ni65  1  0.818012  0.926340  0.430221  1
  Ni  Ni66  1  0.863876  0.568043  0.463570  1
  Ni  Ni67  1  0.174284  0.913845  0.446894  1
  Ni  Ni68  1  0.151345  0.593007  0.430221  1
  Ni  Ni69  1  0.507617  0.580512  0.446894  1
  Ni  Ni70  1  0.197209  0.234709  0.463570  1
  Ni  Ni71  1  0.484678  0.259673  0.430221  1
  Ni  Ni72  1  0.530542  0.901376  0.463570  1
  Ni  Ni73  1  0.826826  0.028617  0.516267  1
  Ni  Ni74  1  0.803885  0.707761  0.499592  1
  Ni  Ni75  1  0.780948  0.386901  0.482917  1
  Ni  Ni76  1  0.160159  0.695283  0.516267  1
  Ni  Ni77  1  0.137218  0.374428  0.499592  1
  Ni  Ni78  1  0.493492  0.361950  0.516267  1
  Ni  Ni79  1  0.114282  0.053568  0.482917  1
  Ni  Ni80  1  0.470552  0.041094  0.499592  1
  Ni  Ni81  1  0.447615  0.720235  0.482917  1
  Ni  Ni82  1  0.909755  0.209755  0.496922  1
  Ni  Ni83  1  0.886814  0.888900  0.480247  1
  Ni  Ni84  1  0.932692  0.530615  0.513597  1
  Ni  Ni85  1  0.243088  0.876422  0.496922  1
  Ni  Ni86  1  0.220147  0.555566  0.480247  1
  Ni  Ni87  1  0.576422  0.543089  0.496922  1
  Ni  Ni88  1  0.266025  0.197282  0.513597  1
  Ni  Ni89  1  0.553481  0.222233  0.480247  1
  Ni  Ni90  1  0.599358  0.863948  0.513597  1
  Ni  Ni91  1  0.895628  0.991176  0.566292  1
  Ni  Ni92  1  0.872690  0.670338  0.549620  1
  Ni  Ni93  1  0.849764  0.349474  0.532944  1
  Ni  Ni94  1  0.228962  0.657843  0.566292  1
  Ni  Ni95  1  0.206023  0.337004  0.549620  1
  Ni  Ni96  1  0.562295  0.324510  0.566292  1
  Ni  Ni97  1  0.183097  0.016140  0.532944  1
  Ni  Ni98  1  0.539356  0.003671  0.549620  1
  Ni  Ni99  1  0.516431  0.682807  0.532944  1
  Ni  Ni100  1  0.978579  0.172331  0.546949  1
  Ni  Ni101  1  0.955642  0.851467  0.530273  1
  Ni  Ni102  1  1.001524  0.493192  0.563618  1
  Ni  Ni103  1  0.311912  0.838998  0.546949  1
  Ni  Ni104  1  0.288976  0.518134  0.530273  1
  Ni  Ni105  1  0.645245  0.505664  0.546949  1
  Ni  Ni106  1  0.334857  0.159858  0.563618  1
  Ni  Ni107  1  0.622309  0.184800  0.530273  1
  Ni  Ni108  1  0.668191  0.826525  0.563618  1
  Ni  Ni109  1  0.964222  0.953746  0.616313  1
  Ni  Ni110  1  0.941417  0.632925  0.599648  1
  Ni  Ni111  1  0.918542  0.312041  0.582979  1
  Ni  Ni112  1  0.297555  0.620413  0.616313  1
  Ni  Ni113  1  0.274751  0.299591  0.599648  1
  Ni  Ni114  1  0.630888  0.287080  0.616313  1
  Ni  Ni115  1  0.251875  0.978707  0.582979  1
  Ni  Ni116  1  0.608084  0.966258  0.599648  1
  Ni  Ni117  1  0.585209  0.645374  0.582979  1
  Ni  Ni118  1  0.047440  0.134884  0.596971  1
  Ni  Ni119  1  0.024538  0.814037  0.580301  1
  Ni  Ni120  1  0.070493  0.455801  0.613612  1
  Ni  Ni121  1  0.380773  0.801550  0.596971  1
  Ni  Ni122  1  0.357872  0.480704  0.580301  1
  Ni  Ni123  1  0.714106  0.468217  0.596971  1
  Ni  Ni124  1  0.403826  0.122468  0.613612  1
  Ni  Ni125  1  0.691205  0.147371  0.580301  1
  Ni  Ni126  1  0.737159  0.789135  0.613612  1
  Ni  Ni127  1  0.031779  0.916534  0.666199  1
  Ni  Ni128  1  0.009569  0.595538  0.649688  1
  Ni  Ni129  1  0.987202  0.274393  0.633010  1
  Ni  Ni130  1  0.365112  0.583200  0.666199  1
  Ni  Ni131  1  0.342902  0.262205  0.649688  1
  Ni  Ni132  1  0.698446  0.249867  0.666199  1
  Ni  Ni133  1  0.320536  0.941059  0.633010  1
  Ni  Ni134  1  0.676235  0.928871  0.649688  1
  Ni  Ni135  1  0.653869  0.607726  0.633010  1
  Ni  Ni136  1  0.117318  0.097166  0.646966  1
  Ni  Ni137  1  0.093561  0.776569  0.630340  1
  Ni  Ni138  1  0.138440  0.418832  0.663516  1
  Ni  Ni139  1  0.450651  0.763833  0.646966  1
  Ni  Ni140  1  0.426895  0.443236  0.630340  1
  Ni  Ni141  1  0.783985  0.430500  0.646966  1
  Ni  Ni142  1  0.471773  0.085499  0.663516  1
  Ni  Ni143  1  0.760228  0.109903  0.630340  1
  Ni  Ni144  1  0.805107  0.752165  0.663516  1
  Ni  Ni145  1  0.106405  0.876795  0.715553  1
  Ni  Ni146  1  0.079118  0.558197  0.700074  1
  Ni  Ni147  1  0.055669  0.237426  0.682820  1
  Ni  Ni148  1  0.439739  0.543462  0.715553  1
  Ni  Ni149  1  0.412451  0.224864  0.700074  1
  Ni  Ni150  1  0.773072  0.210129  0.715553  1
  Ni  Ni151  1  0.389002  0.904093  0.682820  1
  Ni  Ni152  1  0.745784  0.891530  0.700074  1
  Ni  Ni153  1  0.722335  0.570760  0.682820  1
  Ni  Ni154  1  0.181767  0.060969  0.697767  1
  Ni  Ni155  1  0.163324  0.738711  0.680073  1
  Ni  Ni156  1  0.209635  0.379675  0.713046  1
  Ni  Ni157  1  0.515100  0.727635  0.697767  1
  Ni  Ni158  1  0.496657  0.405378  0.680073  1
  Ni  Ni159  1  0.848433  0.394302  0.697767  1
  Ni  Ni160  1  0.542969  0.046342  0.713046  1
  Ni  Ni161  1  0.829991  0.072045  0.680073  1
  Ni  Ni162  1  0.876302  0.713008  0.713046  1
