# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.92747973
_cell_length_b   12.64488010
_cell_length_c   47.35480225
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   113.09346927
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni216
_cell_volume   5468.17517156
_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  0.312156  0.098896  0.298746  1
  Ni  Ni2  1  0.810803  0.098906  0.298746  1
  Ni  Ni3  1  0.446086  0.370170  0.330973  1
  Ni  Ni4  1  0.878464  0.732879  0.314210  1
  Ni  Ni5  1  0.243013  0.462003  0.284713  1
  Ni  Ni6  1  0.378128  0.732206  0.313872  1
  Ni  Ni7  1  0.779727  0.284671  0.291879  1
  Ni  Ni8  1  0.278199  0.281286  0.291486  1
  Ni  Ni9  1  0.911556  0.548659  0.321238  1
  Ni  Ni10  1  0.345300  0.916051  0.306417  1
  Ni  Ni11  1  0.414007  0.551245  0.322624  1
  Ni  Ni12  1  0.844933  0.915973  0.306437  1
  Ni  Ni13  1  0.528955  0.284668  0.291878  1
  Ni  Ni14  1  0.027122  0.281314  0.291486  1
  Ni  Ni15  1  0.661121  0.548660  0.321239  1
  Ni  Ni16  1  0.095101  0.915972  0.306436  1
  Ni  Ni17  1  0.161255  0.551244  0.322627  1
  Ni  Ni18  1  0.594819  0.916054  0.306417  1
  Ni  Ni19  1  0.562088  0.100119  0.298721  1
  Ni  Ni20  1  0.061486  0.098924  0.298692  1
  Ni  Ni21  1  0.696976  0.369959  0.331219  1
  Ni  Ni22  1  0.128460  0.732872  0.314098  1
  Ni  Ni23  1  0.196622  0.369245  0.331416  1
  Ni  Ni24  1  0.628463  0.732873  0.314099  1
  Ni  Ni25  1  0.015054  0.006127  0.346368  1
  Ni  Ni26  1  0.515123  0.006265  0.346344  1
  Ni  Ni27  1  0.151397  0.278875  0.378437  1
  Ni  Ni28  1  0.584312  0.642731  0.362013  1
  Ni  Ni29  1  0.948075  0.370168  0.330976  1
  Ni  Ni30  1  0.082361  0.642730  0.362012  1
  Ni  Ni31  1  0.480825  0.187755  0.338841  1
  Ni  Ni32  1  0.980807  0.187585  0.338752  1
  Ni  Ni33  1  0.617602  0.461686  0.370290  1
  Ni  Ni34  1  0.049078  0.824371  0.354101  1
  Ni  Ni35  1  0.117912  0.461615  0.370516  1
  Ni  Ni36  1  0.549013  0.824139  0.354025  1
  Ni  Ni37  1  0.230765  0.187582  0.338752  1
  Ni  Ni38  1  0.730917  0.187754  0.338842  1
  Ni  Ni39  1  0.367639  0.461617  0.370515  1
  Ni  Ni40  1  0.799258  0.824370  0.354102  1
  Ni  Ni41  1  0.868013  0.461685  0.370290  1
  Ni  Ni42  1  0.299091  0.824138  0.354024  1
  Ni  Ni43  1  0.265105  0.006091  0.346375  1
  Ni  Ni44  1  0.764970  0.006092  0.346376  1
  Ni  Ni45  1  0.401558  0.279281  0.378291  1
  Ni  Ni46  1  0.832921  0.641901  0.361646  1
  Ni  Ni47  1  0.901640  0.279279  0.378293  1
  Ni  Ni48  1  0.333403  0.642856  0.362069  1
  Ni  Ni49  1  0.719344  0.914851  0.393881  1
  Ni  Ni50  1  0.219401  0.914854  0.393879  1
  Ni  Ni51  1  0.855828  0.187834  0.425824  1
  Ni  Ni52  1  0.287900  0.551929  0.410003  1
  Ni  Ni53  1  0.651596  0.279274  0.378367  1
  Ni  Ni54  1  0.787838  0.551815  0.409809  1
  Ni  Ni55  1  0.185454  0.096850  0.386138  1
  Ni  Ni56  1  0.685381  0.096909  0.386152  1
  Ni  Ni57  1  0.321848  0.369857  0.417982  1
  Ni  Ni58  1  0.753784  0.733140  0.401717  1
  Ni  Ni59  1  0.821947  0.369957  0.417913  1
  Ni  Ni60  1  0.253389  0.733182  0.401759  1
  Ni  Ni61  1  0.935301  0.096849  0.386140  1
  Ni  Ni62  1  0.435437  0.096912  0.386150  1
  Ni  Ni63  1  0.071862  0.369854  0.417983  1
  Ni  Ni64  1  0.503671  0.733182  0.401761  1
  Ni  Ni65  1  0.571859  0.369959  0.417912  1
  Ni  Ni66  1  0.003232  0.733141  0.401715  1
  Ni  Ni67  1  0.969458  0.915024  0.393908  1
  Ni  Ni68  1  0.469364  0.914834  0.393852  1
  Ni  Ni69  1  0.105764  0.187692  0.425867  1
  Ni  Ni70  1  0.537914  0.551857  0.409937  1
  Ni  Ni71  1  0.605845  0.187850  0.425841  1
  Ni  Ni72  1  0.037807  0.551854  0.409935  1
  Ni  Ni73  1  0.423865  0.823921  0.441526  1
  Ni  Ni74  1  0.923889  0.823968  0.441538  1
  Ni  Ni75  1  0.560197  0.096628  0.473410  1
  Ni  Ni76  1  0.992142  0.460505  0.457572  1
  Ni  Ni77  1  0.355844  0.187837  0.425821  1
  Ni  Ni78  1  0.492150  0.460511  0.457575  1
  Ni  Ni79  1  0.889753  0.005774  0.433680  1
  Ni  Ni80  1  0.389814  0.005763  0.433660  1
  Ni  Ni81  1  0.026140  0.278514  0.465531  1
  Ni  Ni82  1  0.458121  0.642361  0.449583  1
  Ni  Ni83  1  0.526164  0.278579  0.465503  1
  Ni  Ni84  1  0.957996  0.642322  0.449528  1
  Ni  Ni85  1  0.639772  0.005758  0.433663  1
  Ni  Ni86  1  0.139844  0.005779  0.433678  1
  Ni  Ni87  1  0.776180  0.278576  0.465506  1
  Ni  Ni88  1  0.208039  0.642360  0.449578  1
  Ni  Ni89  1  0.276146  0.278517  0.465527  1
  Ni  Ni90  1  0.708121  0.642323  0.449533  1
  Ni  Ni91  1  0.673922  0.823917  0.441531  1
  Ni  Ni92  1  0.173808  0.823924  0.441525  1
  Ni  Ni93  1  0.810166  0.096617  0.473416  1
  Ni  Ni94  1  0.242146  0.460497  0.457602  1
  Ni  Ni95  1  0.310211  0.096626  0.473410  1
  Ni  Ni96  1  0.742150  0.460528  0.457527  1
  Ni  Ni97  1  0.128319  0.732976  0.489227  1
  Ni  Ni98  1  0.628381  0.732965  0.489240  1
  Ni  Ni99  1  0.264650  0.005611  0.521059  1
  Ni  Ni100  1  0.696452  0.369226  0.505165  1
  Ni  Ni101  1  0.060164  0.096584  0.473430  1
  Ni  Ni102  1  0.196457  0.369192  0.505194  1
  Ni  Ni103  1  0.594247  0.914743  0.481295  1
  Ni  Ni104  1  0.094261  0.914768  0.481302  1
  Ni  Ni105  1  0.730552  0.187399  0.513143  1
  Ni  Ni106  1  0.162413  0.551112  0.497216  1
  Ni  Ni107  1  0.230529  0.187370  0.513147  1
  Ni  Ni108  1  0.662425  0.551114  0.497200  1
  Ni  Ni109  1  0.344246  0.914759  0.481290  1
  Ni  Ni110  1  0.844241  0.914752  0.481306  1
  Ni  Ni111  1  0.480550  0.187397  0.513135  1
  Ni  Ni112  1  0.912389  0.551108  0.497190  1
  Ni  Ni113  1  0.980511  0.187373  0.513154  1
  Ni  Ni114  1  0.412428  0.551117  0.497226  1
  Ni  Ni115  1  0.378353  0.732980  0.489244  1
  Ni  Ni116  1  0.878349  0.732966  0.489230  1
  Ni  Ni117  1  0.514649  0.005607  0.521051  1
  Ni  Ni118  1  0.946455  0.369208  0.505183  1
  Ni  Ni119  1  0.014626  0.005596  0.521064  1
  Ni  Ni120  1  0.446457  0.369213  0.505183  1
  Ni  Ni121  1  0.832690  0.641737  0.536854  1
  Ni  Ni122  1  0.332698  0.641746  0.536867  1
  Ni  Ni123  1  0.969066  0.914523  0.568643  1
  Ni  Ni124  1  0.400842  0.278063  0.552849  1
  Ni  Ni125  1  0.764613  0.005567  0.521067  1
  Ni  Ni126  1  0.900864  0.278114  0.552870  1
  Ni  Ni127  1  0.298669  0.823713  0.528929  1
  Ni  Ni128  1  0.798675  0.823673  0.528943  1
  Ni  Ni129  1  0.435067  0.096474  0.560834  1
  Ni  Ni130  1  0.866684  0.459808  0.544816  1
  Ni  Ni131  1  0.934983  0.096457  0.560844  1
  Ni  Ni132  1  0.366739  0.459815  0.544841  1
  Ni  Ni133  1  0.048689  0.823708  0.528931  1
  Ni  Ni134  1  0.548674  0.823678  0.528941  1
  Ni  Ni135  1  0.185015  0.096465  0.560840  1
  Ni  Ni136  1  0.616716  0.459821  0.544829  1
  Ni  Ni137  1  0.685079  0.096465  0.560837  1
  Ni  Ni138  1  0.116748  0.459803  0.544828  1
  Ni  Ni139  1  0.082686  0.641750  0.536835  1
  Ni  Ni140  1  0.582706  0.641742  0.536868  1
  Ni  Ni141  1  0.219068  0.914545  0.568661  1
  Ni  Ni142  1  0.650847  0.278075  0.552850  1
  Ni  Ni143  1  0.718994  0.914395  0.568674  1
  Ni  Ni144  1  0.150836  0.278056  0.552862  1
  Ni  Ni145  1  0.536975  0.550379  0.584470  1
  Ni  Ni146  1  0.036955  0.550354  0.584393  1
  Ni  Ni147  1  0.673259  0.823005  0.616248  1
  Ni  Ni148  1  0.105328  0.187308  0.600668  1
  Ni  Ni149  1  0.469053  0.914530  0.568638  1
  Ni  Ni150  1  0.605522  0.187315  0.600662  1
  Ni  Ni151  1  0.003041  0.732457  0.576490  1
  Ni  Ni152  1  0.502998  0.732404  0.576527  1
  Ni  Ni153  1  0.139430  0.005412  0.608421  1
  Ni  Ni154  1  0.571051  0.368581  0.592530  1
  Ni  Ni155  1  0.639524  0.005363  0.608384  1
  Ni  Ni156  1  0.071246  0.368645  0.592549  1
  Ni  Ni157  1  0.752989  0.732399  0.576526  1
  Ni  Ni158  1  0.252989  0.732462  0.576491  1
  Ni  Ni159  1  0.889359  0.005360  0.608388  1
  Ni  Ni160  1  0.321081  0.368577  0.592535  1
  Ni  Ni161  1  0.389508  0.005416  0.608417  1
  Ni  Ni162  1  0.820948  0.368649  0.592544  1
  Ni  Ni163  1  0.786928  0.550344  0.584455  1
  Ni  Ni164  1  0.286981  0.550346  0.584462  1
  Ni  Ni165  1  0.923452  0.823380  0.616117  1
  Ni  Ni166  1  0.355420  0.187298  0.600647  1
  Ni  Ni167  1  0.423439  0.823384  0.616115  1
  Ni  Ni168  1  0.855506  0.187478  0.600683  1
  Ni  Ni169  1  0.241895  0.458976  0.632191  1
  Ni  Ni170  1  0.740563  0.458977  0.632187  1
  Ni  Ni171  1  0.377816  0.732859  0.663298  1
  Ni  Ni172  1  0.809800  0.096155  0.648162  1
  Ni  Ni173  1  0.173454  0.823403  0.616174  1
  Ni  Ni174  1  0.309741  0.096032  0.648185  1
  Ni  Ni175  1  0.707218  0.640813  0.624058  1
  Ni  Ni176  1  0.207132  0.640972  0.623957  1
  Ni  Ni177  1  0.843869  0.914396  0.655807  1
  Ni  Ni178  1  0.275543  0.277905  0.640500  1
  Ni  Ni179  1  0.343876  0.914242  0.655924  1
  Ni  Ni180  1  0.775915  0.278314  0.640593  1
  Ni  Ni181  1  0.457098  0.640816  0.624059  1
  Ni  Ni182  1  0.957333  0.640970  0.623956  1
  Ni  Ni183  1  0.593963  0.914393  0.655807  1
  Ni  Ni184  1  0.025867  0.278313  0.640596  1
  Ni  Ni185  1  0.093801  0.914241  0.655926  1
  Ni  Ni186  1  0.525834  0.277906  0.640497  1
  Ni  Ni187  1  0.491120  0.458751  0.632096  1
  Ni  Ni188  1  0.991022  0.458567  0.631990  1
  Ni  Ni189  1  0.627753  0.732068  0.663723  1
  Ni  Ni190  1  0.059630  0.095992  0.648195  1
  Ni  Ni191  1  0.128057  0.732686  0.663473  1
  Ni  Ni192  1  0.559811  0.095993  0.648192  1
  Ni  Ni193  1  0.947302  0.371216  0.680926  1
  Ni  Ni194  1  0.446525  0.369657  0.680473  1
  Ni  Ni195  1  0.080089  0.636767  0.710363  1
  Ni  Ni196  1  0.513860  0.003454  0.695870  1
  Ni  Ni197  1  0.878472  0.732858  0.663299  1
  Ni  Ni198  1  0.012961  0.003462  0.695872  1
  Ni  Ni199  1  0.413926  0.551300  0.671943  1
  Ni  Ni200  1  0.911826  0.550245  0.671125  1
  Ni  Ni201  1  0.547160  0.819680  0.703156  1
  Ni  Ni202  1  0.980117  0.186993  0.688101  1
  Ni  Ni203  1  0.047582  0.821166  0.703517  1
  Ni  Ni204  1  0.480274  0.186742  0.688095  1
  Ni  Ni205  1  0.161836  0.550244  0.671126  1
  Ni  Ni206  1  0.660792  0.551301  0.671945  1
  Ni  Ni207  1  0.296960  0.821164  0.703516  1
  Ni  Ni208  1  0.730234  0.186992  0.688099  1
  Ni  Ni209  1  0.795919  0.819705  0.703156  1
  Ni  Ni210  1  0.229835  0.186744  0.688097  1
  Ni  Ni211  1  0.196942  0.370771  0.680752  1
  Ni  Ni212  1  0.697219  0.370770  0.680748  1
  Ni  Ni213  1  0.331299  0.638142  0.710158  1
  Ni  Ni214  1  0.763685  0.004018  0.695798  1
  Ni  Ni215  1  0.830258  0.638151  0.710159  1
  Ni  Ni216  1  0.263754  0.004146  0.695862  1
