# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.56107612
_cell_length_b   13.14548301
_cell_length_c   46.50325508
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   109.00863584
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni204
_cell_volume   4948.06937715
_cell_formula_units_Z   204
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  0.638204  0.692452  0.294630  1
  Ni  Ni2  1  0.138204  0.692452  0.294630  1
  Ni  Ni3  1  0.053996  0.036539  0.286213  1
  Ni  Ni4  1  0.485212  0.374969  0.278631  1
  Ni  Ni5  1  0.553996  0.036539  0.286213  1
  Ni  Ni6  1  0.985212  0.374969  0.278631  1
  Ni  Ni7  1  0.737972  0.536549  0.286211  1
  Ni  Ni8  1  0.237972  0.536549  0.286211  1
  Ni  Ni9  1  0.145163  0.874959  0.278633  1
  Ni  Ni10  1  0.309665  0.192455  0.294631  1
  Ni  Ni11  1  0.645163  0.874959  0.278633  1
  Ni  Ni12  1  0.809665  0.192455  0.294631  1
  Ni  Ni13  1  0.381812  0.674874  0.321923  1
  Ni  Ni14  1  0.881812  0.674874  0.321923  1
  Ni  Ni15  1  0.798592  0.014281  0.313531  1
  Ni  Ni16  1  0.223136  0.352921  0.304517  1
  Ni  Ni17  1  0.298592  0.014281  0.313531  1
  Ni  Ni18  1  0.723136  0.352921  0.304517  1
  Ni  Ni19  1  0.471104  0.514279  0.313531  1
  Ni  Ni20  1  0.971104  0.514279  0.313531  1
  Ni  Ni21  1  0.885194  0.852921  0.304520  1
  Ni  Ni22  1  0.048475  0.174872  0.321924  1
  Ni  Ni23  1  0.385194  0.852921  0.304520  1
  Ni  Ni24  1  0.548475  0.174872  0.321924  1
  Ni  Ni25  1  0.122270  0.655176  0.348401  1
  Ni  Ni26  1  0.622270  0.655176  0.348401  1
  Ni  Ni27  1  0.539843  0.994744  0.339723  1
  Ni  Ni28  1  0.963243  0.334240  0.331323  1
  Ni  Ni29  1  0.039843  0.994744  0.339723  1
  Ni  Ni30  1  0.463243  0.334240  0.331323  1
  Ni  Ni31  1  0.210315  0.494744  0.339723  1
  Ni  Ni32  1  0.710315  0.494744  0.339723  1
  Ni  Ni33  1  0.626410  0.834241  0.331324  1
  Ni  Ni34  1  0.788316  0.155175  0.348401  1
  Ni  Ni35  1  0.126410  0.834241  0.331324  1
  Ni  Ni36  1  0.288316  0.155175  0.348401  1
  Ni  Ni37  1  0.862134  0.635550  0.374583  1
  Ni  Ni38  1  0.362134  0.635550  0.374583  1
  Ni  Ni39  1  0.280529  0.975497  0.365939  1
  Ni  Ni40  1  0.703160  0.315362  0.357301  1
  Ni  Ni41  1  0.780529  0.975497  0.365939  1
  Ni  Ni42  1  0.203160  0.315362  0.357301  1
  Ni  Ni43  1  0.950379  0.475496  0.365939  1
  Ni  Ni44  1  0.450379  0.475496  0.365939  1
  Ni  Ni45  1  0.367613  0.815363  0.357303  1
  Ni  Ni46  1  0.528825  0.135550  0.374583  1
  Ni  Ni47  1  0.867613  0.815363  0.357303  1
  Ni  Ni48  1  0.028825  0.135550  0.374583  1
  Ni  Ni49  1  0.602063  0.615738  0.400983  1
  Ni  Ni50  1  0.102063  0.615738  0.400983  1
  Ni  Ni51  1  0.020928  0.955733  0.392256  1
  Ni  Ni52  1  0.442521  0.295495  0.383605  1
  Ni  Ni53  1  0.520928  0.955733  0.392256  1
  Ni  Ni54  1  0.942521  0.295495  0.383605  1
  Ni  Ni55  1  0.690213  0.455731  0.392255  1
  Ni  Ni56  1  0.190213  0.455731  0.392255  1
  Ni  Ni57  1  0.108382  0.795495  0.383606  1
  Ni  Ni58  1  0.269082  0.115738  0.400984  1
  Ni  Ni59  1  0.608382  0.795495  0.383606  1
  Ni  Ni60  1  0.769082  0.115738  0.400984  1
  Ni  Ni61  1  0.342147  0.596049  0.427281  1
  Ni  Ni62  1  0.842147  0.596049  0.427281  1
  Ni  Ni63  1  0.761297  0.935958  0.418547  1
  Ni  Ni64  1  0.182257  0.275767  0.409822  1
  Ni  Ni65  1  0.261297  0.935958  0.418547  1
  Ni  Ni66  1  0.682257  0.275767  0.409822  1
  Ni  Ni67  1  0.430067  0.435957  0.418547  1
  Ni  Ni68  1  0.930067  0.435957  0.418547  1
  Ni  Ni69  1  0.848917  0.775767  0.409823  1
  Ni  Ni70  1  0.009308  0.096049  0.427282  1
  Ni  Ni71  1  0.348917  0.775767  0.409823  1
  Ni  Ni72  1  0.509308  0.096049  0.427282  1
  Ni  Ni73  1  0.082220  0.576304  0.453602  1
  Ni  Ni74  1  0.582220  0.576304  0.453602  1
  Ni  Ni75  1  0.501570  0.916222  0.444848  1
  Ni  Ni76  1  0.922214  0.256086  0.436122  1
  Ni  Ni77  1  1.001570  0.916222  0.444848  1
  Ni  Ni78  1  0.422214  0.256086  0.436122  1
  Ni  Ni79  1  0.170056  0.416221  0.444848  1
  Ni  Ni80  1  0.670056  0.416221  0.444848  1
  Ni  Ni81  1  0.589278  0.756086  0.436123  1
  Ni  Ni82  1  0.749487  0.076304  0.453603  1
  Ni  Ni83  1  0.089278  0.756086  0.436123  1
  Ni  Ni84  1  0.249487  0.076304  0.453603  1
  Ni  Ni85  1  0.822330  0.556585  0.479904  1
  Ni  Ni86  1  0.322330  0.556585  0.479904  1
  Ni  Ni87  1  0.241798  0.896492  0.471152  1
  Ni  Ni88  1  0.662261  0.236372  0.462403  1
  Ni  Ni89  1  0.741798  0.896492  0.471152  1
  Ni  Ni90  1  0.162261  0.236372  0.462403  1
  Ni  Ni91  1  0.910097  0.396492  0.471152  1
  Ni  Ni92  1  0.410097  0.396492  0.471152  1
  Ni  Ni93  1  0.329515  0.736372  0.462404  1
  Ni  Ni94  1  0.489656  0.056585  0.479905  1
  Ni  Ni95  1  0.829515  0.736372  0.462404  1
  Ni  Ni96  1  0.989656  0.056585  0.479905  1
  Ni  Ni97  1  0.562468  0.536863  0.506204  1
  Ni  Ni98  1  0.062468  0.536863  0.506204  1
  Ni  Ni99  1  0.981957  0.876760  0.497453  1
  Ni  Ni100  1  0.402365  0.216656  0.488701  1
  Ni  Ni101  1  0.481957  0.876760  0.497453  1
  Ni  Ni102  1  0.902365  0.216656  0.488701  1
  Ni  Ni103  1  0.650202  0.376759  0.497453  1
  Ni  Ni104  1  0.150202  0.376759  0.497453  1
  Ni  Ni105  1  0.069692  0.716656  0.488701  1
  Ni  Ni106  1  0.229795  0.036863  0.506205  1
  Ni  Ni107  1  0.569692  0.716656  0.488701  1
  Ni  Ni108  1  0.729795  0.036863  0.506205  1
  Ni  Ni109  1  0.302645  0.517147  0.532502  1
  Ni  Ni110  1  0.802645  0.517147  0.532502  1
  Ni  Ni111  1  0.722063  0.857028  0.523754  1
  Ni  Ni112  1  0.142503  0.196934  0.515001  1
  Ni  Ni113  1  0.222063  0.857028  0.523754  1
  Ni  Ni114  1  0.642503  0.196934  0.515001  1
  Ni  Ni115  1  0.390362  0.357027  0.523754  1
  Ni  Ni116  1  0.890362  0.357027  0.523754  1
  Ni  Ni117  1  0.809830  0.696934  0.515002  1
  Ni  Ni118  1  0.969899  0.017147  0.532503  1
  Ni  Ni119  1  0.309830  0.696934  0.515002  1
  Ni  Ni120  1  0.469899  0.017147  0.532503  1
  Ni  Ni121  1  0.042882  0.497433  0.558783  1
  Ni  Ni122  1  0.542882  0.497433  0.558783  1
  Ni  Ni123  1  0.462104  0.837298  0.550058  1
  Ni  Ni124  1  0.882673  0.177216  0.541303  1
  Ni  Ni125  1  0.962104  0.837298  0.550058  1
  Ni  Ni126  1  0.382673  0.177216  0.541303  1
  Ni  Ni127  1  0.130590  0.337298  0.550058  1
  Ni  Ni128  1  0.630590  0.337298  0.550058  1
  Ni  Ni129  1  0.549940  0.677216  0.541304  1
  Ni  Ni130  1  0.709946  0.997433  0.558784  1
  Ni  Ni131  1  0.049940  0.677216  0.541304  1
  Ni  Ni132  1  0.209946  0.997433  0.558784  1
  Ni  Ni133  1  0.783243  0.477752  0.585083  1
  Ni  Ni134  1  0.283243  0.477752  0.585083  1
  Ni  Ni135  1  0.202092  0.817562  0.576359  1
  Ni  Ni136  1  0.622852  0.157470  0.567624  1
  Ni  Ni137  1  0.702092  0.817562  0.576359  1
  Ni  Ni138  1  0.122852  0.157470  0.567624  1
  Ni  Ni139  1  0.870863  0.317561  0.576358  1
  Ni  Ni140  1  0.370863  0.317561  0.576358  1
  Ni  Ni141  1  0.290013  0.657470  0.567624  1
  Ni  Ni142  1  0.449903  0.977752  0.585084  1
  Ni  Ni143  1  0.790013  0.657470  0.567624  1
  Ni  Ni144  1  0.949903  0.977752  0.585084  1
  Ni  Ni145  1  0.523777  0.458024  0.611299  1
  Ni  Ni146  1  0.023777  0.458024  0.611299  1
  Ni  Ni147  1  0.941947  0.797788  0.602651  1
  Ni  Ni148  1  0.363077  0.137781  0.593921  1
  Ni  Ni149  1  0.441947  0.797788  0.602651  1
  Ni  Ni150  1  0.863077  0.137781  0.593921  1
  Ni  Ni151  1  0.611231  0.297787  0.602650  1
  Ni  Ni152  1  0.111231  0.297787  0.602650  1
  Ni  Ni153  1  0.030097  0.637781  0.593922  1
  Ni  Ni154  1  0.189639  0.958025  0.611301  1
  Ni  Ni155  1  0.530097  0.637781  0.593922  1
  Ni  Ni156  1  0.689639  0.958025  0.611301  1
  Ni  Ni157  1  0.264546  0.438156  0.637603  1
  Ni  Ni158  1  0.764546  0.438156  0.637603  1
  Ni  Ni159  1  0.681781  0.778023  0.628967  1
  Ni  Ni160  1  0.103335  0.117969  0.620322  1
  Ni  Ni161  1  0.181781  0.778023  0.628967  1
  Ni  Ni162  1  0.603335  0.117969  0.620322  1
  Ni  Ni163  1  0.351631  0.278022  0.628966  1
  Ni  Ni164  1  0.851631  0.278022  0.628966  1
  Ni  Ni165  1  0.770026  0.617970  0.620323  1
  Ni  Ni166  1  0.929000  0.938157  0.637604  1
  Ni  Ni167  1  0.270026  0.617970  0.620323  1
  Ni  Ni168  1  0.429000  0.938157  0.637604  1
  Ni  Ni169  1  0.005750  0.419278  0.663581  1
  Ni  Ni170  1  0.505750  0.419278  0.663581  1
  Ni  Ni171  1  0.421845  0.758776  0.655183  1
  Ni  Ni172  1  0.843844  0.098344  0.646504  1
  Ni  Ni173  1  0.921845  0.758776  0.655183  1
  Ni  Ni174  1  0.343844  0.098344  0.646504  1
  Ni  Ni175  1  0.092317  0.258775  0.655182  1
  Ni  Ni176  1  0.592317  0.258775  0.655182  1
  Ni  Ni177  1  0.509890  0.598343  0.646505  1
  Ni  Ni178  1  0.668917  0.919280  0.663583  1
  Ni  Ni179  1  0.009890  0.598343  0.646505  1
  Ni  Ni180  1  0.168917  0.919280  0.663583  1
  Ni  Ni181  1  0.746966  0.400599  0.690386  1
  Ni  Ni182  1  0.246966  0.400599  0.690386  1
  Ni  Ni183  1  0.161056  0.739240  0.681375  1
  Ni  Ni184  1  0.583685  0.078648  0.672982  1
  Ni  Ni185  1  0.661056  0.739240  0.681375  1
  Ni  Ni186  1  0.083685  0.078648  0.672982  1
  Ni  Ni187  1  0.833568  0.239238  0.681374  1
  Ni  Ni188  1  0.333568  0.239238  0.681374  1
  Ni  Ni189  1  0.250348  0.578645  0.672982  1
  Ni  Ni190  1  0.409024  0.900599  0.690389  1
  Ni  Ni191  1  0.750348  0.578645  0.672982  1
  Ni  Ni192  1  0.909024  0.900599  0.690389  1
  Ni  Ni193  1  0.486997  0.378560  0.716273  1
  Ni  Ni194  1  0.986997  0.378560  0.716273  1
  Ni  Ni195  1  0.894188  0.716970  0.708694  1
  Ni  Ni196  1  0.322495  0.061064  0.700275  1
  Ni  Ni197  1  0.394188  0.716970  0.708694  1
  Ni  Ni198  1  0.822495  0.061064  0.700275  1
  Ni  Ni199  1  0.578163  0.216980  0.708693  1
  Ni  Ni200  1  0.078163  0.216980  0.708693  1
  Ni  Ni201  1  0.993955  0.561067  0.700276  1
  Ni  Ni202  1  0.146948  0.878550  0.716274  1
  Ni  Ni203  1  0.493955  0.561067  0.700276  1
  Ni  Ni204  1  0.646948  0.878550  0.716274  1
