# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.94158441
_cell_length_b   12.65620744
_cell_length_c   47.30753236
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   66.90653073
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni216
_cell_volume   5475.37855325
_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  0.492552  0.286301  0.292489  1
  Ni  Ni2  1  0.995041  0.283480  0.291810  1
  Ni  Ni3  1  0.362179  0.547104  0.321300  1
  Ni  Ni4  1  0.428006  0.916157  0.306585  1
  Ni  Ni5  1  0.862721  0.549901  0.322899  1
  Ni  Ni6  1  0.927443  0.916388  0.306596  1
  Ni  Ni7  1  0.211480  0.100196  0.298909  1
  Ni  Ni8  1  0.709806  0.100178  0.298913  1
  Ni  Ni9  1  0.074589  0.369376  0.331461  1
  Ni  Ni10  1  0.144486  0.732509  0.314406  1
  Ni  Ni11  1  0.780289  0.460990  0.286016  1
  Ni  Ni12  1  0.645393  0.730702  0.313910  1
  Ni  Ni13  1  0.460049  0.101382  0.298899  1
  Ni  Ni14  1  0.960550  0.100382  0.298858  1
  Ni  Ni15  1  0.326312  0.368939  0.331868  1
  Ni  Ni16  1  0.394365  0.732457  0.314289  1
  Ni  Ni17  1  0.826774  0.368014  0.332110  1
  Ni  Ni18  1  0.894659  0.732459  0.314291  1
  Ni  Ni19  1  0.242693  0.286308  0.292488  1
  Ni  Ni20  1  0.743038  0.283437  0.291813  1
  Ni  Ni21  1  0.112248  0.547109  0.321301  1
  Ni  Ni22  1  0.177632  0.916389  0.306594  1
  Ni  Ni23  1  0.608918  0.549895  0.322891  1
  Ni  Ni24  1  0.677299  0.916149  0.306587  1
  Ni  Ni25  1  0.291994  0.187379  0.339111  1
  Ni  Ni26  1  0.792259  0.187029  0.339018  1
  Ni  Ni27  1  0.155002  0.461003  0.370645  1
  Ni  Ni28  1  0.223808  0.823816  0.354257  1
  Ni  Ni29  1  0.655513  0.460930  0.370946  1
  Ni  Ni30  1  0.723935  0.823403  0.354138  1
  Ni  Ni31  1  0.007930  0.005711  0.346538  1
  Ni  Ni32  1  0.507846  0.005882  0.346509  1
  Ni  Ni33  1  0.871902  0.277850  0.378886  1
  Ni  Ni34  1  0.940936  0.641944  0.362204  1
  Ni  Ni35  1  0.577606  0.369370  0.331461  1
  Ni  Ni36  1  0.438743  0.641944  0.362199  1
  Ni  Ni37  1  0.258109  0.005648  0.346534  1
  Ni  Ni38  1  0.757815  0.005641  0.346538  1
  Ni  Ni39  1  0.121540  0.278428  0.378668  1
  Ni  Ni40  1  0.190303  0.641021  0.361783  1
  Ni  Ni41  1  0.621687  0.278424  0.378670  1
  Ni  Ni42  1  0.689817  0.641980  0.362253  1
  Ni  Ni43  1  0.042271  0.187038  0.339015  1
  Ni  Ni44  1  0.542195  0.187379  0.339113  1
  Ni  Ni45  1  0.905195  0.460929  0.370949  1
  Ni  Ni46  1  0.973970  0.823814  0.354260  1
  Ni  Ni47  1  0.405632  0.460998  0.370644  1
  Ni  Ni48  1  0.474254  0.823406  0.354135  1
  Ni  Ni49  1  0.087940  0.095985  0.386400  1
  Ni  Ni50  1  0.587772  0.096086  0.386411  1
  Ni  Ni51  1  0.951286  0.369162  0.418342  1
  Ni  Ni52  1  0.019948  0.732430  0.401918  1
  Ni  Ni53  1  0.451275  0.369290  0.418247  1
  Ni  Ni54  1  0.519469  0.732475  0.401951  1
  Ni  Ni55  1  0.803732  0.914070  0.394072  1
  Ni  Ni56  1  0.303876  0.914079  0.394066  1
  Ni  Ni57  1  0.667358  0.187025  0.426132  1
  Ni  Ni58  1  0.735174  0.551372  0.410327  1
  Ni  Ni59  1  0.371647  0.278356  0.378787  1
  Ni  Ni60  1  0.235249  0.551207  0.410091  1
  Ni  Ni61  1  0.053707  0.914264  0.394111  1
  Ni  Ni62  1  0.553807  0.914073  0.394037  1
  Ni  Ni63  1  0.917459  0.186830  0.426198  1
  Ni  Ni64  1  0.985295  0.551292  0.410248  1
  Ni  Ni65  1  0.417362  0.187027  0.426157  1
  Ni  Ni66  1  0.485128  0.551287  0.410243  1
  Ni  Ni67  1  0.837743  0.095978  0.386404  1
  Ni  Ni68  1  0.337810  0.096088  0.386408  1
  Ni  Ni69  1  0.701290  0.369159  0.418342  1
  Ni  Ni70  1  0.769761  0.732473  0.401956  1
  Ni  Ni71  1  0.201158  0.369295  0.418246  1
  Ni  Ni72  1  0.269317  0.732432  0.401914  1
  Ni  Ni73  1  0.883346  0.004951  0.433940  1
  Ni  Ni74  1  0.383429  0.004957  0.433913  1
  Ni  Ni75  1  0.747011  0.277795  0.465849  1
  Ni  Ni76  1  0.815079  0.641744  0.449867  1
  Ni  Ni77  1  0.246964  0.277870  0.465808  1
  Ni  Ni78  1  0.314964  0.641693  0.449803  1
  Ni  Ni79  1  0.599293  0.823195  0.441761  1
  Ni  Ni80  1  0.099266  0.823243  0.441781  1
  Ni  Ni81  1  0.462980  0.095898  0.473703  1
  Ni  Ni82  1  0.530962  0.459863  0.457884  1
  Ni  Ni83  1  0.167363  0.187033  0.426126  1
  Ni  Ni84  1  0.030978  0.459873  0.457889  1
  Ni  Ni85  1  0.849362  0.823180  0.441770  1
  Ni  Ni86  1  0.349229  0.823193  0.441757  1
  Ni  Ni87  1  0.712957  0.095884  0.473712  1
  Ni  Ni88  1  0.780985  0.459854  0.457919  1
  Ni  Ni89  1  0.212988  0.095902  0.473698  1
  Ni  Ni90  1  0.280951  0.459884  0.457829  1
  Ni  Ni91  1  0.633389  0.004947  0.433920  1
  Ni  Ni92  1  0.133456  0.004962  0.433933  1
  Ni  Ni93  1  0.496990  0.277863  0.465813  1
  Ni  Ni94  1  0.564973  0.641744  0.449858  1
  Ni  Ni95  1  0.997020  0.277801  0.465844  1
  Ni  Ni96  1  0.065123  0.641693  0.449813  1
  Ni  Ni97  1  0.678909  0.914053  0.481572  1
  Ni  Ni98  1  0.178889  0.914088  0.481574  1
  Ni  Ni99  1  0.542598  0.186742  0.513458  1
  Ni  Ni100  1  0.610705  0.550471  0.497504  1
  Ni  Ni101  1  0.042604  0.186709  0.513460  1
  Ni  Ni102  1  0.110713  0.550475  0.497493  1
  Ni  Ni103  1  0.394716  0.732352  0.489497  1
  Ni  Ni104  1  0.894805  0.732327  0.489524  1
  Ni  Ni105  1  0.258460  0.005021  0.521362  1
  Ni  Ni106  1  0.326650  0.368547  0.505464  1
  Ni  Ni107  1  0.962989  0.095841  0.473729  1
  Ni  Ni108  1  0.826717  0.368512  0.505501  1
  Ni  Ni109  1  0.644756  0.732354  0.489522  1
  Ni  Ni110  1  0.144760  0.732338  0.489509  1
  Ni  Ni111  1  0.508473  0.005017  0.521356  1
  Ni  Ni112  1  0.576679  0.368531  0.505487  1
  Ni  Ni113  1  0.008439  0.005000  0.521373  1
  Ni  Ni114  1  0.076681  0.368544  0.505487  1
  Ni  Ni115  1  0.428882  0.914081  0.481559  1
  Ni  Ni116  1  0.928879  0.914060  0.481587  1
  Ni  Ni117  1  0.292593  0.186740  0.513443  1
  Ni  Ni118  1  0.360671  0.550466  0.497475  1
  Ni  Ni119  1  0.792573  0.186712  0.513475  1
  Ni  Ni120  1  0.860722  0.550478  0.497522  1
  Ni  Ni121  1  0.474370  0.823156  0.529206  1
  Ni  Ni122  1  0.974422  0.823085  0.529238  1
  Ni  Ni123  1  0.338056  0.095948  0.561178  1
  Ni  Ni124  1  0.406363  0.459111  0.545094  1
  Ni  Ni125  1  0.837965  0.095925  0.561205  1
  Ni  Ni126  1  0.906454  0.459145  0.545137  1
  Ni  Ni127  1  0.190405  0.641121  0.537129  1
  Ni  Ni128  1  0.690420  0.641128  0.537141  1
  Ni  Ni129  1  0.053967  0.914063  0.568945  1
  Ni  Ni130  1  0.122287  0.277418  0.553173  1
  Ni  Ni131  1  0.758472  0.004958  0.521383  1
  Ni  Ni132  1  0.622251  0.277472  0.553207  1
  Ni  Ni133  1  0.440397  0.641130  0.537091  1
  Ni  Ni134  1  0.940427  0.641118  0.537157  1
  Ni  Ni135  1  0.303968  0.914076  0.568967  1
  Ni  Ni136  1  0.372258  0.277425  0.553174  1
  Ni  Ni137  1  0.804060  0.913884  0.569001  1
  Ni  Ni138  1  0.872310  0.277403  0.553192  1
  Ni  Ni139  1  0.224400  0.823147  0.529209  1
  Ni  Ni140  1  0.724432  0.823093  0.529236  1
  Ni  Ni141  1  0.088004  0.095935  0.561187  1
  Ni  Ni142  1  0.156377  0.459151  0.545124  1
  Ni  Ni143  1  0.588088  0.095938  0.561196  1
  Ni  Ni144  1  0.656486  0.459105  0.545107  1
  Ni  Ni145  1  0.270080  0.731954  0.576721  1
  Ni  Ni146  1  0.770092  0.731844  0.576804  1
  Ni  Ni147  1  0.133548  0.004942  0.608782  1
  Ni  Ni148  1  0.202010  0.367902  0.592857  1
  Ni  Ni149  1  0.633731  0.004831  0.608770  1
  Ni  Ni150  1  0.702292  0.367918  0.592871  1
  Ni  Ni151  1  0.986158  0.549731  0.584759  1
  Ni  Ni152  1  0.486212  0.549611  0.584599  1
  Ni  Ni153  1  0.849808  0.822488  0.616551  1
  Ni  Ni154  1  0.917529  0.186752  0.601080  1
  Ni  Ni155  1  0.553973  0.914073  0.568939  1
  Ni  Ni156  1  0.417786  0.186763  0.601072  1
  Ni  Ni157  1  0.236124  0.549665  0.584704  1
  Ni  Ni158  1  0.736252  0.549667  0.584712  1
  Ni  Ni159  1  0.099588  0.823013  0.616354  1
  Ni  Ni160  1  0.167658  0.186762  0.601041  1
  Ni  Ni161  1  0.599500  0.823020  0.616352  1
  Ni  Ni162  1  0.667569  0.186929  0.601119  1
  Ni  Ni163  1  0.020095  0.731839  0.576803  1
  Ni  Ni164  1  0.519982  0.731961  0.576722  1
  Ni  Ni165  1  0.883532  0.004821  0.608774  1
  Ni  Ni166  1  0.952155  0.367896  0.592864  1
  Ni  Ni167  1  0.383597  0.004948  0.608779  1
  Ni  Ni168  1  0.451844  0.367923  0.592865  1
  Ni  Ni169  1  0.066025  0.640332  0.624298  1
  Ni  Ni170  1  0.565573  0.640500  0.624053  1
  Ni  Ni171  1  0.929460  0.913296  0.656220  1
  Ni  Ni172  1  0.997131  0.277352  0.640939  1
  Ni  Ni173  1  0.429221  0.913549  0.656293  1
  Ni  Ni174  1  0.497191  0.277873  0.641094  1
  Ni  Ni175  1  0.782720  0.458376  0.632460  1
  Ni  Ni176  1  0.281044  0.458376  0.632455  1
  Ni  Ni177  1  0.643749  0.732385  0.663391  1
  Ni  Ni178  1  0.713457  0.095267  0.648637  1
  Ni  Ni179  1  0.349570  0.822962  0.616458  1
  Ni  Ni180  1  0.213385  0.095417  0.648612  1
  Ni  Ni181  1  0.031950  0.458236  0.632427  1
  Ni  Ni182  1  0.532156  0.457824  0.632184  1
  Ni  Ni183  1  0.895473  0.731251  0.664003  1
  Ni  Ni184  1  0.963311  0.095197  0.648638  1
  Ni  Ni185  1  0.395148  0.731895  0.663748  1
  Ni  Ni186  1  0.463669  0.095206  0.648633  1
  Ni  Ni187  1  0.815764  0.640332  0.624301  1
  Ni  Ni188  1  0.316043  0.640498  0.624051  1
  Ni  Ni189  1  0.679437  0.913305  0.656217  1
  Ni  Ni190  1  0.747088  0.277868  0.641097  1
  Ni  Ni191  1  0.179426  0.913548  0.656296  1
  Ni  Ni192  1  0.247670  0.277358  0.640935  1
  Ni  Ni193  1  0.862232  0.551262  0.672250  1
  Ni  Ni194  1  0.361149  0.549937  0.671042  1
  Ni  Ni195  1  0.728666  0.816115  0.703459  1
  Ni  Ni196  1  0.793006  0.185954  0.688530  1
  Ni  Ni197  1  0.227156  0.818549  0.703910  1
  Ni  Ni198  1  0.293776  0.185601  0.688512  1
  Ni  Ni199  1  0.575363  0.371520  0.681479  1
  Ni  Ni200  1  0.076743  0.368766  0.680838  1
  Ni  Ni201  1  0.444261  0.633674  0.710315  1
  Ni  Ni202  1  0.511144  0.001389  0.696295  1
  Ni  Ni203  1  0.146067  0.732379  0.663390  1
  Ni  Ni204  1  0.009768  0.001373  0.696299  1
  Ni  Ni205  1  0.825461  0.370981  0.681276  1
  Ni  Ni206  1  0.325805  0.370985  0.681275  1
  Ni  Ni207  1  0.691426  0.636356  0.709812  1
  Ni  Ni208  1  0.760338  0.001630  0.696248  1
  Ni  Ni209  1  0.194427  0.636335  0.709810  1
  Ni  Ni210  1  0.259923  0.002451  0.696283  1
  Ni  Ni211  1  0.611118  0.549938  0.671045  1
  Ni  Ni212  1  0.108720  0.551256  0.672240  1
  Ni  Ni213  1  0.476556  0.818552  0.703910  1
  Ni  Ni214  1  0.543337  0.185958  0.688528  1
  Ni  Ni215  1  0.977493  0.816073  0.703461  1
  Ni  Ni216  1  0.042920  0.185591  0.688514  1
