# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.92037373
_cell_length_b   12.42923510
_cell_length_c   48.02930697
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.07314114
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni216
_cell_volume   5274.29118893
_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  0.023515  0.766541  0.277459  1
  Ni  Ni2  1  0.356848  0.433208  0.277459  1
  Ni  Ni3  1  0.298687  0.751475  0.288693  1
  Ni  Ni4  1  0.690181  0.099875  0.277459  1
  Ni  Ni5  1  0.632021  0.418142  0.288693  1
  Ni  Ni6  1  0.569709  0.745671  0.301034  1
  Ni  Ni7  1  0.965354  0.084808  0.288693  1
  Ni  Ni8  1  0.903042  0.412338  0.301034  1
  Ni  Ni9  1  0.236375  0.079004  0.301034  1
  Ni  Ni10  1  0.027209  0.580199  0.298182  1
  Ni  Ni11  1  0.360543  0.246865  0.298182  1
  Ni  Ni12  1  0.295981  0.575976  0.312057  1
  Ni  Ni13  1  0.693876  0.913532  0.298182  1
  Ni  Ni14  1  0.629314  0.242643  0.312057  1
  Ni  Ni15  1  0.751376  0.588868  0.286635  1
  Ni  Ni16  1  0.962647  0.909310  0.312057  1
  Ni  Ni17  1  0.084710  0.255534  0.286635  1
  Ni  Ni18  1  0.418043  0.922201  0.286635  1
  Ni  Ni19  1  0.839812  0.739529  0.314190  1
  Ni  Ni20  1  0.173146  0.406196  0.314190  1
  Ni  Ni21  1  0.110872  0.733154  0.326577  1
  Ni  Ni22  1  0.506479  0.072862  0.314190  1
  Ni  Ni23  1  0.444205  0.399821  0.326577  1
  Ni  Ni24  1  0.382354  0.726480  0.338700  1
  Ni  Ni25  1  0.777538  0.066488  0.326577  1
  Ni  Ni26  1  0.715687  0.393147  0.338700  1
  Ni  Ni27  1  0.049021  0.059814  0.338700  1
  Ni  Ni28  1  0.837386  0.560468  0.336492  1
  Ni  Ni29  1  0.170719  0.227134  0.336492  1
  Ni  Ni30  1  0.106681  0.554162  0.348769  1
  Ni  Ni31  1  0.504053  0.893801  0.336492  1
  Ni  Ni32  1  0.440014  0.220829  0.348769  1
  Ni  Ni33  1  0.565688  0.567076  0.323992  1
  Ni  Ni34  1  0.773348  0.887495  0.348769  1
  Ni  Ni35  1  0.899021  0.233742  0.323992  1
  Ni  Ni36  1  0.232354  0.900409  0.323992  1
  Ni  Ni37  1  0.651930  0.719214  0.351009  1
  Ni  Ni38  1  0.985263  0.385881  0.351009  1
  Ni  Ni39  1  0.922192  0.712554  0.363296  1
  Ni  Ni40  1  0.318596  0.052547  0.351009  1
  Ni  Ni41  1  0.255526  0.379220  0.363296  1
  Ni  Ni42  1  0.193083  0.705491  0.375640  1
  Ni  Ni43  1  0.588859  0.045887  0.363296  1
  Ni  Ni44  1  0.526416  0.372157  0.375640  1
  Ni  Ni45  1  0.859749  0.038824  0.375640  1
  Ni  Ni46  1  0.648231  0.540021  0.373380  1
  Ni  Ni47  1  0.981564  0.206688  0.373380  1
  Ni  Ni48  1  0.918855  0.533071  0.385817  1
  Ni  Ni49  1  0.314897  0.873354  0.373380  1
  Ni  Ni50  1  0.252189  0.199737  0.385817  1
  Ni  Ni51  1  0.377433  0.547053  0.361272  1
  Ni  Ni52  1  0.585522  0.866404  0.385817  1
  Ni  Ni53  1  0.710766  0.213720  0.361272  1
  Ni  Ni54  1  0.044100  0.880386  0.361272  1
  Ni  Ni55  1  0.463590  0.698530  0.387994  1
  Ni  Ni56  1  0.796923  0.365196  0.387994  1
  Ni  Ni57  1  0.734088  0.691498  0.400317  1
  Ni  Ni58  1  0.130256  0.031863  0.387994  1
  Ni  Ni59  1  0.067421  0.358164  0.400317  1
  Ni  Ni60  1  0.004666  0.684632  0.412639  1
  Ni  Ni61  1  0.400755  0.024831  0.400317  1
  Ni  Ni62  1  0.338000  0.351299  0.412639  1
  Ni  Ni63  1  0.671333  0.017966  0.412639  1
  Ni  Ni64  1  0.460164  0.519135  0.410505  1
  Ni  Ni65  1  0.793498  0.185802  0.410505  1
  Ni  Ni66  1  0.730651  0.512198  0.422817  1
  Ni  Ni67  1  0.126831  0.852469  0.410505  1
  Ni  Ni68  1  0.063984  0.178864  0.422817  1
  Ni  Ni69  1  0.189347  0.526114  0.398169  1
  Ni  Ni70  1  0.397317  0.845531  0.422817  1
  Ni  Ni71  1  0.522681  0.192781  0.398169  1
  Ni  Ni72  1  0.856014  0.859447  0.398169  1
  Ni  Ni73  1  0.275273  0.677622  0.424993  1
  Ni  Ni74  1  0.608606  0.344289  0.424993  1
  Ni  Ni75  1  0.545850  0.670702  0.437340  1
  Ni  Ni76  1  0.941940  0.010956  0.424993  1
  Ni  Ni77  1  0.879183  0.337369  0.437340  1
  Ni  Ni78  1  0.816441  0.663745  0.449669  1
  Ni  Ni79  1  0.212516  0.004035  0.437340  1
  Ni  Ni80  1  0.149775  0.330412  0.449669  1
  Ni  Ni81  1  0.483108  0.997078  0.449669  1
  Ni  Ni82  1  0.271874  0.498282  0.447517  1
  Ni  Ni83  1  0.605207  0.164948  0.447517  1
  Ni  Ni84  1  0.542480  0.491331  0.459856  1
  Ni  Ni85  1  0.938541  0.831615  0.447517  1
  Ni  Ni86  1  0.875814  0.157998  0.459856  1
  Ni  Ni87  1  1.001241  0.505251  0.435176  1
  Ni  Ni88  1  0.209147  0.824665  0.459856  1
  Ni  Ni89  1  0.334574  0.171918  0.435176  1
  Ni  Ni90  1  0.667907  0.838585  0.435176  1
  Ni  Ni91  1  0.087033  0.656790  0.462008  1
  Ni  Ni92  1  0.420367  0.323456  0.462008  1
  Ni  Ni93  1  0.357628  0.649832  0.474354  1
  Ni  Ni94  1  0.753700  0.990123  0.462008  1
  Ni  Ni95  1  0.690962  0.316499  0.474354  1
  Ni  Ni96  1  0.628222  0.642893  0.486693  1
  Ni  Ni97  1  0.024295  0.983165  0.474354  1
  Ni  Ni98  1  0.961555  0.309560  0.486693  1
  Ni  Ni99  1  0.294889  0.976226  0.486693  1
  Ni  Ni100  1  0.083654  0.477439  0.484536  1
  Ni  Ni101  1  0.416988  0.144106  0.484536  1
  Ni  Ni102  1  0.354254  0.470479  0.496877  1
  Ni  Ni103  1  0.750321  0.810772  0.484536  1
  Ni  Ni104  1  0.687587  0.137146  0.496877  1
  Ni  Ni105  1  0.813050  0.484396  0.472193  1
  Ni  Ni106  1  0.020920  0.803813  0.496877  1
  Ni  Ni107  1  0.146384  0.151063  0.472193  1
  Ni  Ni108  1  0.479717  0.817730  0.472193  1
  Ni  Ni109  1  0.898816  0.635943  0.499030  1
  Ni  Ni110  1  0.232149  0.302609  0.499030  1
  Ni  Ni111  1  0.169415  0.628983  0.511372  1
  Ni  Ni112  1  0.565482  0.969276  0.499030  1
  Ni  Ni113  1  0.502748  0.295650  0.511372  1
  Ni  Ni114  1  0.440019  0.622026  0.523714  1
  Ni  Ni115  1  0.836082  0.962316  0.511372  1
  Ni  Ni116  1  0.773352  0.288692  0.523714  1
  Ni  Ni117  1  0.106686  0.955359  0.523714  1
  Ni  Ni118  1  0.895441  0.456590  0.521554  1
  Ni  Ni119  1  0.228774  0.123257  0.521554  1
  Ni  Ni120  1  0.166036  0.449632  0.533899  1
  Ni  Ni121  1  0.562108  0.789924  0.521554  1
  Ni  Ni122  1  0.499369  0.116299  0.533899  1
  Ni  Ni123  1  0.624847  0.463529  0.509215  1
  Ni  Ni124  1  0.832703  0.782966  0.533899  1
  Ni  Ni125  1  0.958181  0.130196  0.509215  1
  Ni  Ni126  1  0.291514  0.796863  0.509215  1
  Ni  Ni127  1  0.710589  0.615091  0.536051  1
  Ni  Ni128  1  0.043922  0.281757  0.536051  1
  Ni  Ni129  1  0.981195  0.608140  0.548390  1
  Ni  Ni130  1  0.377256  0.948424  0.536051  1
  Ni  Ni131  1  0.314529  0.274807  0.548390  1
  Ni  Ni132  1  0.251829  0.601171  0.560731  1
  Ni  Ni133  1  0.647862  0.941474  0.548390  1
  Ni  Ni134  1  0.585162  0.267837  0.560731  1
  Ni  Ni135  1  0.918495  0.934504  0.560731  1
  Ni  Ni136  1  0.707220  0.435720  0.558568  1
  Ni  Ni137  1  0.040553  0.102387  0.558568  1
  Ni  Ni138  1  0.977796  0.428800  0.570915  1
  Ni  Ni139  1  0.373886  0.769053  0.558568  1
  Ni  Ni140  1  0.311130  0.095466  0.570915  1
  Ni  Ni141  1  0.436628  0.442677  0.546239  1
  Ni  Ni142  1  0.644463  0.762133  0.570915  1
  Ni  Ni143  1  0.769961  0.109344  0.546239  1
  Ni  Ni144  1  0.103295  0.776010  0.546239  1
  Ni  Ni145  1  0.522419  0.594224  0.573090  1
  Ni  Ni146  1  0.855752  0.260891  0.573090  1
  Ni  Ni147  1  0.792905  0.587287  0.585402  1
  Ni  Ni148  1  0.189085  0.927558  0.573090  1
  Ni  Ni149  1  0.126238  0.253954  0.585402  1
  Ni  Ni150  1  0.063722  0.580308  0.597738  1
  Ni  Ni151  1  0.459572  0.920620  0.585402  1
  Ni  Ni152  1  0.397055  0.246975  0.597738  1
  Ni  Ni153  1  0.730389  0.913641  0.597738  1
  Ni  Ni154  1  0.518981  0.414924  0.595590  1
  Ni  Ni155  1  0.852315  0.081591  0.595590  1
  Ni  Ni156  1  0.789480  0.407893  0.607913  1
  Ni  Ni157  1  0.185648  0.748258  0.595590  1
  Ni  Ni158  1  0.122813  0.074559  0.607913  1
  Ni  Ni159  1  0.248403  0.421790  0.583268  1
  Ni  Ni160  1  0.456146  0.741226  0.607913  1
  Ni  Ni161  1  0.581736  0.088456  0.583268  1
  Ni  Ni162  1  0.915070  0.755123  0.583268  1
  Ni  Ni163  1  0.334214  0.573351  0.610090  1
  Ni  Ni164  1  0.667547  0.240018  0.610090  1
  Ni  Ni165  1  0.604839  0.566401  0.622527  1
  Ni  Ni166  1  1.000881  0.906685  0.610090  1
  Ni  Ni167  1  0.938172  0.233068  0.622527  1
  Ni  Ni168  1  0.875636  0.559369  0.634636  1
  Ni  Ni169  1  0.271505  0.899734  0.622527  1
  Ni  Ni170  1  0.208970  0.226036  0.634636  1
  Ni  Ni171  1  0.542303  0.892702  0.634636  1
  Ni  Ni172  1  0.330877  0.393868  0.632611  1
  Ni  Ni173  1  0.664210  0.060535  0.632611  1
  Ni  Ni174  1  0.601140  0.387208  0.644898  1
  Ni  Ni175  1  0.997544  0.727202  0.632611  1
  Ni  Ni176  1  0.934473  0.053875  0.644898  1
  Ni  Ni177  1  0.059987  0.400932  0.620268  1
  Ni  Ni178  1  0.267806  0.720541  0.644898  1
  Ni  Ni179  1  0.393320  0.067598  0.620268  1
  Ni  Ni180  1  0.726653  0.734265  0.620268  1
  Ni  Ni181  1  0.146388  0.552260  0.647139  1
  Ni  Ni182  1  0.479722  0.218927  0.647139  1
  Ni  Ni183  1  0.415683  0.545954  0.659415  1
  Ni  Ni184  1  0.813055  0.885594  0.647139  1
  Ni  Ni185  1  0.749017  0.212621  0.659415  1
  Ni  Ni186  1  0.687382  0.539346  0.671915  1
  Ni  Ni187  1  0.082350  0.879288  0.659415  1
  Ni  Ni188  1  0.020715  0.206013  0.671915  1
  Ni  Ni189  1  0.354048  0.872680  0.671915  1
  Ni  Ni190  1  0.142197  0.373268  0.669331  1
  Ni  Ni191  1  0.475531  0.039935  0.669331  1
  Ni  Ni192  1  0.413257  0.366893  0.681717  1
  Ni  Ni193  1  0.808864  0.706601  0.669331  1
  Ni  Ni194  1  0.746590  0.033560  0.681717  1
  Ni  Ni195  1  0.870715  0.379942  0.657208  1
  Ni  Ni196  1  0.079924  0.700226  0.681717  1
  Ni  Ni197  1  0.204049  0.046608  0.657208  1
  Ni  Ni198  1  0.537382  0.713275  0.657208  1
  Ni  Ni199  1  0.957088  0.530446  0.683850  1
  Ni  Ni200  1  0.290422  0.197113  0.683850  1
  Ni  Ni201  1  0.225860  0.526224  0.697726  1
  Ni  Ni202  1  0.623755  0.863779  0.683850  1
  Ni  Ni203  1  0.559193  0.192890  0.697726  1
  Ni  Ni204  1  0.501693  0.517554  0.709273  1
  Ni  Ni205  1  0.892526  0.859557  0.697726  1
  Ni  Ni206  1  0.835026  0.184221  0.709273  1
  Ni  Ni207  1  0.168360  0.850888  0.709273  1
  Ni  Ni208  1  0.954382  0.354947  0.707214  1
  Ni  Ni209  1  0.287715  0.021614  0.707214  1
  Ni  Ni210  1  0.229555  0.339881  0.718449  1
  Ni  Ni211  1  0.621049  0.688280  0.707214  1
  Ni  Ni212  1  0.562888  0.006547  0.718449  1
  Ni  Ni213  1  0.683361  0.360751  0.694873  1
  Ni  Ni214  1  0.896221  0.673214  0.718449  1
  Ni  Ni215  1  0.016694  0.027418  0.694873  1
  Ni  Ni216  1  0.350027  0.694084  0.694873  1
