# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.80254852
_cell_length_b   13.20655826
_cell_length_c   46.26831006
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.41924651
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni252
_cell_volume   6292.53365583
_cell_formula_units_Z   252
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  0.807196  0.657954  0.292788  1
  Ni  Ni2  1  0.140529  0.324620  0.292788  1
  Ni  Ni3  1  0.202369  0.670488  0.282691  1
  Ni  Ni4  1  0.420206  0.648194  0.302514  1
  Ni  Ni5  1  0.753539  0.314861  0.302514  1
  Ni  Ni6  1  0.086873  0.981527  0.302514  1
  Ni  Ni7  1  0.473862  0.991287  0.292788  1
  Ni  Ni8  1  0.535702  0.337154  0.282691  1
  Ni  Ni9  1  0.869035  0.003821  0.282691  1
  Ni  Ni10  1  0.834346  0.473846  0.309111  1
  Ni  Ni11  1  0.167679  0.140512  0.309111  1
  Ni  Ni12  1  0.224107  0.483801  0.298450  1
  Ni  Ni13  1  0.613391  0.496582  0.288986  1
  Ni  Ni14  1  0.946724  0.163249  0.288986  1
  Ni  Ni15  1  0.280057  0.829916  0.288986  1
  Ni  Ni16  1  0.501012  0.807179  0.309111  1
  Ni  Ni17  1  0.557440  0.150468  0.298450  1
  Ni  Ni18  1  0.890774  0.817135  0.298450  1
  Ni  Ni19  1  0.638136  0.628727  0.324105  1
  Ni  Ni20  1  0.971469  0.295394  0.324105  1
  Ni  Ni21  1  0.027808  0.637253  0.312703  1
  Ni  Ni22  1  0.244987  0.622015  0.333971  1
  Ni  Ni23  1  0.578321  0.288682  0.333971  1
  Ni  Ni24  1  0.911654  0.955348  0.333971  1
  Ni  Ni25  1  0.304802  0.962060  0.324105  1
  Ni  Ni26  1  0.361142  0.303920  0.312703  1
  Ni  Ni27  1  0.694475  0.970586  0.312703  1
  Ni  Ni28  1  0.654963  0.447541  0.340358  1
  Ni  Ni29  1  0.988296  0.114208  0.340358  1
  Ni  Ni30  1  0.046964  0.458465  0.330229  1
  Ni  Ni31  1  0.437022  0.468545  0.319835  1
  Ni  Ni32  1  0.770355  0.135212  0.319835  1
  Ni  Ni33  1  0.103689  0.801879  0.319835  1
  Ni  Ni34  1  0.321630  0.780874  0.340358  1
  Ni  Ni35  1  0.380297  0.125132  0.330229  1
  Ni  Ni36  1  0.713631  0.791798  0.330229  1
  Ni  Ni37  1  0.464347  0.602492  0.354603  1
  Ni  Ni38  1  0.797681  0.269159  0.354603  1
  Ni  Ni39  1  0.854697  0.612363  0.344574  1
  Ni  Ni40  1  0.072864  0.593546  0.365031  1
  Ni  Ni41  1  0.406197  0.260213  0.365031  1
  Ni  Ni42  1  0.739531  0.926880  0.365031  1
  Ni  Ni43  1  0.131014  0.935825  0.354603  1
  Ni  Ni44  1  0.188031  0.279030  0.344574  1
  Ni  Ni45  1  0.521364  0.945697  0.344574  1
  Ni  Ni46  1  0.479416  0.420974  0.371921  1
  Ni  Ni47  1  0.812750  0.087641  0.371921  1
  Ni  Ni48  1  0.871177  0.430019  0.361431  1
  Ni  Ni49  1  0.262769  0.438908  0.350695  1
  Ni  Ni50  1  0.596102  0.105575  0.350695  1
  Ni  Ni51  1  0.929435  0.772242  0.350695  1
  Ni  Ni52  1  0.146083  0.754307  0.371921  1
  Ni  Ni53  1  0.204510  0.096685  0.361431  1
  Ni  Ni54  1  0.537843  0.763352  0.361431  1
  Ni  Ni55  1  0.290222  0.574918  0.385842  1
  Ni  Ni56  1  0.623556  0.241584  0.385842  1
  Ni  Ni57  1  0.681645  0.583841  0.375688  1
  Ni  Ni58  1  0.899020  0.565802  0.396403  1
  Ni  Ni59  1  0.232353  0.232469  0.396403  1
  Ni  Ni60  1  0.565686  0.899136  0.396403  1
  Ni  Ni61  1  0.956889  0.908251  0.385842  1
  Ni  Ni62  1  0.014979  0.250508  0.375688  1
  Ni  Ni63  1  0.348312  0.917175  0.375688  1
  Ni  Ni64  1  0.305195  0.393160  0.403107  1
  Ni  Ni65  1  0.638529  0.059827  0.403107  1
  Ni  Ni66  1  0.696708  0.402113  0.392723  1
  Ni  Ni67  1  0.088025  0.411728  0.382367  1
  Ni  Ni68  1  0.421358  0.078395  0.382367  1
  Ni  Ni69  1  0.754692  0.745062  0.382367  1
  Ni  Ni70  1  0.971862  0.726494  0.403107  1
  Ni  Ni71  1  0.030042  0.068780  0.392723  1
  Ni  Ni72  1  0.363375  0.735447  0.392723  1
  Ni  Ni73  1  0.116230  0.547484  0.417163  1
  Ni  Ni74  1  0.449564  0.214151  0.417163  1
  Ni  Ni75  1  0.507485  0.556566  0.406772  1
  Ni  Ni76  1  0.724861  0.538109  0.427639  1
  Ni  Ni77  1  0.058195  0.204776  0.427639  1
  Ni  Ni78  1  0.391528  0.871442  0.427639  1
  Ni  Ni79  1  0.782897  0.880818  0.417163  1
  Ni  Ni80  1  0.840819  0.223233  0.406772  1
  Ni  Ni81  1  0.174152  0.889900  0.406772  1
  Ni  Ni82  1  0.131153  0.365478  0.434465  1
  Ni  Ni83  1  0.464486  0.032145  0.434465  1
  Ni  Ni84  1  0.522542  0.374605  0.424018  1
  Ni  Ni85  1  0.913833  0.383886  0.413628  1
  Ni  Ni86  1  0.247166  0.050553  0.413628  1
  Ni  Ni87  1  0.580500  0.717219  0.413628  1
  Ni  Ni88  1  0.797819  0.698811  0.434465  1
  Ni  Ni89  1  0.855875  0.041272  0.424018  1
  Ni  Ni90  1  0.189209  0.707939  0.424018  1
  Ni  Ni91  1  0.942188  0.519761  0.448445  1
  Ni  Ni92  1  0.275521  0.186428  0.448445  1
  Ni  Ni93  1  0.333488  0.528932  0.437981  1
  Ni  Ni94  1  0.550763  0.510514  0.458851  1
  Ni  Ni95  1  0.884096  0.177180  0.458851  1
  Ni  Ni96  1  0.217429  0.843847  0.458851  1
  Ni  Ni97  1  0.608854  0.853095  0.448445  1
  Ni  Ni98  1  0.666822  0.195599  0.437981  1
  Ni  Ni99  1  1.000155  0.862265  0.437981  1
  Ni  Ni100  1  0.957070  0.337797  0.465733  1
  Ni  Ni101  1  0.290403  0.004464  0.465733  1
  Ni  Ni102  1  0.348429  0.347040  0.455284  1
  Ni  Ni103  1  0.739768  0.356193  0.444886  1
  Ni  Ni104  1  0.073101  0.022860  0.444886  1
  Ni  Ni105  1  0.406435  0.689526  0.444886  1
  Ni  Ni106  1  0.623736  0.671131  0.465733  1
  Ni  Ni107  1  0.681762  0.013707  0.455284  1
  Ni  Ni108  1  0.015095  0.680374  0.455284  1
  Ni  Ni109  1  0.768100  0.492107  0.479696  1
  Ni  Ni110  1  0.101433  0.158773  0.479696  1
  Ni  Ni111  1  0.159456  0.501356  0.469264  1
  Ni  Ni112  1  0.376738  0.482892  0.490105  1
  Ni  Ni113  1  0.710072  0.149558  0.490105  1
  Ni  Ni114  1  0.043405  0.816225  0.490105  1
  Ni  Ni115  1  0.434766  0.825440  0.479696  1
  Ni  Ni116  1  0.492790  0.168023  0.469264  1
  Ni  Ni117  1  0.826123  0.834690  0.469264  1
  Ni  Ni118  1  0.783013  0.310140  0.496988  1
  Ni  Ni119  1  0.116346  0.976807  0.496988  1
  Ni  Ni120  1  0.174395  0.319390  0.486569  1
  Ni  Ni121  1  0.565728  0.328555  0.476141  1
  Ni  Ni122  1  0.899061  0.995222  0.476141  1
  Ni  Ni123  1  0.232395  0.661888  0.476141  1
  Ni  Ni124  1  0.449680  0.643474  0.496988  1
  Ni  Ni125  1  0.507728  0.986056  0.486569  1
  Ni  Ni126  1  0.841062  0.652723  0.486569  1
  Ni  Ni127  1  0.594034  0.464457  0.510947  1
  Ni  Ni128  1  0.927367  0.131124  0.510947  1
  Ni  Ni129  1  0.985415  0.473706  0.500528  1
  Ni  Ni130  1  0.202700  0.455291  0.521375  1
  Ni  Ni131  1  0.536034  0.121958  0.521375  1
  Ni  Ni132  1  0.869367  0.788625  0.521375  1
  Ni  Ni133  1  0.260700  0.797790  0.510947  1
  Ni  Ni134  1  0.318749  0.140373  0.500528  1
  Ni  Ni135  1  0.652082  0.807039  0.500528  1
  Ni  Ni136  1  0.608972  0.282490  0.528252  1
  Ni  Ni137  1  0.942305  0.949157  0.528252  1
  Ni  Ni138  1  1.000329  0.291740  0.517820  1
  Ni  Ni139  1  0.391690  0.300955  0.507411  1
  Ni  Ni140  1  0.725023  0.967622  0.507411  1
  Ni  Ni141  1  0.058357  0.634288  0.507411  1
  Ni  Ni142  1  0.275639  0.615823  0.528252  1
  Ni  Ni143  1  0.333662  0.958406  0.517820  1
  Ni  Ni144  1  0.666995  0.625073  0.517820  1
  Ni  Ni145  1  0.420000  0.436806  0.542232  1
  Ni  Ni146  1  0.753333  0.103473  0.542232  1
  Ni  Ni147  1  0.811359  0.446049  0.531783  1
  Ni  Ni148  1  0.028661  0.427653  0.552630  1
  Ni  Ni149  1  0.361994  0.094320  0.552630  1
  Ni  Ni150  1  0.695327  0.760987  0.552630  1
  Ni  Ni151  1  0.086666  0.770140  0.542232  1
  Ni  Ni152  1  0.144692  0.112716  0.531783  1
  Ni  Ni153  1  0.478025  0.779383  0.531783  1
  Ni  Ni154  1  0.434940  0.254914  0.559535  1
  Ni  Ni155  1  0.768273  0.921581  0.559535  1
  Ni  Ni156  1  0.826241  0.264085  0.549071  1
  Ni  Ni157  1  0.217666  0.273333  0.538665  1
  Ni  Ni158  1  0.550999  0.940000  0.538665  1
  Ni  Ni159  1  0.884333  0.606666  0.538665  1
  Ni  Ni160  1  0.101607  0.588248  0.559535  1
  Ni  Ni161  1  0.159574  0.930752  0.549071  1
  Ni  Ni162  1  0.492907  0.597418  0.549071  1
  Ni  Ni163  1  0.245886  0.409241  0.573499  1
  Ni  Ni164  1  0.579220  0.075908  0.573499  1
  Ni  Ni165  1  0.637276  0.418368  0.563051  1
  Ni  Ni166  1  0.854596  0.399960  0.583888  1
  Ni  Ni167  1  0.187929  0.066627  0.583888  1
  Ni  Ni168  1  0.521262  0.733294  0.583888  1
  Ni  Ni169  1  0.912553  0.742574  0.573499  1
  Ni  Ni170  1  0.970609  0.085035  0.563051  1
  Ni  Ni171  1  0.303943  0.751702  0.563051  1
  Ni  Ni172  1  0.260943  0.227280  0.590744  1
  Ni  Ni173  1  0.594276  0.893947  0.590744  1
  Ni  Ni174  1  0.652198  0.236362  0.580353  1
  Ni  Ni175  1  0.043567  0.245737  0.569877  1
  Ni  Ni176  1  0.376900  0.912404  0.569877  1
  Ni  Ni177  1  0.710234  0.579071  0.569877  1
  Ni  Ni178  1  0.927610  0.560613  0.590744  1
  Ni  Ni179  1  0.985532  0.903029  0.580353  1
  Ni  Ni180  1  0.318865  0.569695  0.580353  1
  Ni  Ni181  1  0.071720  0.381733  0.604793  1
  Ni  Ni182  1  0.405053  0.048400  0.604793  1
  Ni  Ni183  1  0.463233  0.390686  0.594409  1
  Ni  Ni184  1  0.680403  0.372118  0.615149  1
  Ni  Ni185  1  0.013737  0.038785  0.615149  1
  Ni  Ni186  1  0.347070  0.705452  0.615149  1
  Ni  Ni187  1  0.738387  0.715067  0.604793  1
  Ni  Ni188  1  0.796567  0.057353  0.594409  1
  Ni  Ni189  1  0.129900  0.724020  0.594409  1
  Ni  Ni190  1  0.086783  0.200005  0.621828  1
  Ni  Ni191  1  0.420117  0.866672  0.621828  1
  Ni  Ni192  1  0.478206  0.208929  0.611675  1
  Ni  Ni193  1  0.869409  0.218044  0.601113  1
  Ni  Ni194  1  0.202742  0.884711  0.601113  1
  Ni  Ni195  1  0.536076  0.551377  0.601113  1
  Ni  Ni196  1  0.753450  0.533339  0.621828  1
  Ni  Ni197  1  0.811539  0.875596  0.611675  1
  Ni  Ni198  1  0.144873  0.542262  0.611675  1
  Ni  Ni199  1  0.897252  0.353828  0.636085  1
  Ni  Ni200  1  0.230585  0.020495  0.636085  1
  Ni  Ni201  1  0.289012  0.362873  0.625595  1
  Ni  Ni202  1  0.505660  0.344938  0.646821  1
  Ni  Ni203  1  0.838993  0.011605  0.646821  1
  Ni  Ni204  1  0.172326  0.678271  0.646821  1
  Ni  Ni205  1  0.563918  0.687161  0.636085  1
  Ni  Ni206  1  0.622346  0.029539  0.625595  1
  Ni  Ni207  1  0.955679  0.696206  0.625595  1
  Ni  Ni208  1  0.913731  0.171483  0.652942  1
  Ni  Ni209  1  0.247065  0.838150  0.652942  1
  Ni  Ni210  1  0.304081  0.181355  0.642913  1
  Ni  Ni211  1  0.695564  0.190300  0.632485  1
  Ni  Ni212  1  0.028898  0.856967  0.632485  1
  Ni  Ni213  1  0.362231  0.523633  0.632485  1
  Ni  Ni214  1  0.580398  0.504816  0.652942  1
  Ni  Ni215  1  0.637414  0.848021  0.642913  1
  Ni  Ni216  1  0.970748  0.514688  0.642913  1
  Ni  Ni217  1  0.721464  0.325381  0.667287  1
  Ni  Ni218  1  0.054798  0.992048  0.667287  1
  Ni  Ni219  1  0.113465  0.336306  0.657158  1
  Ni  Ni220  1  0.331407  0.315301  0.677681  1
  Ni  Ni221  1  0.664740  0.981968  0.677681  1
  Ni  Ni222  1  0.998073  0.648635  0.677681  1
  Ni  Ni223  1  0.388131  0.658715  0.667287  1
  Ni  Ni224  1  0.446799  0.002972  0.657158  1
  Ni  Ni225  1  0.780132  0.669639  0.657158  1
  Ni  Ni226  1  0.740620  0.146593  0.684813  1
  Ni  Ni227  1  0.073953  0.813260  0.684813  1
  Ni  Ni228  1  0.130293  0.155119  0.673411  1
  Ni  Ni229  1  0.523441  0.161831  0.663545  1
  Ni  Ni230  1  0.856774  0.828498  0.663545  1
  Ni  Ni231  1  0.190108  0.495165  0.663545  1
  Ni  Ni232  1  0.407287  0.479927  0.684813  1
  Ni  Ni233  1  0.463626  0.821786  0.673411  1
  Ni  Ni234  1  0.796959  0.488453  0.673411  1
  Ni  Ni235  1  0.544321  0.300045  0.699066  1
  Ni  Ni236  1  0.877655  0.966712  0.699066  1
  Ni  Ni237  1  0.934083  0.310001  0.688405  1
  Ni  Ni238  1  0.155038  0.287264  0.708530  1
  Ni  Ni239  1  0.488371  0.953931  0.708530  1
  Ni  Ni240  1  0.821705  0.620598  0.708530  1
  Ni  Ni241  1  0.210988  0.633378  0.699066  1
  Ni  Ni242  1  0.267416  0.976667  0.688405  1
  Ni  Ni243  1  0.600749  0.643334  0.688405  1
  Ni  Ni244  1  0.566060  0.113359  0.714825  1
  Ni  Ni245  1  0.899393  0.780025  0.714825  1
  Ni  Ni246  1  0.961233  0.125893  0.704728  1
  Ni  Ni247  1  0.348222  0.135653  0.695002  1
  Ni  Ni248  1  0.681556  0.802319  0.695002  1
  Ni  Ni249  1  0.014889  0.468986  0.695002  1
  Ni  Ni250  1  0.232726  0.446692  0.714825  1
  Ni  Ni251  1  0.294566  0.792559  0.704728  1
  Ni  Ni252  1  0.627900  0.459226  0.704728  1
