# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.89937981
_cell_length_b   12.54224421
_cell_length_c   47.95604985
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.14549202
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni216
_cell_volume   5302.54955029
_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  0.027706  0.764922  0.279722  1
  Ni  Ni2  1  0.361039  0.431589  0.279722  1
  Ni  Ni3  1  0.296795  0.758427  0.289914  1
  Ni  Ni4  1  0.694373  0.098256  0.279722  1
  Ni  Ni5  1  0.630129  0.425093  0.289914  1
  Ni  Ni6  1  0.569046  0.748642  0.301210  1
  Ni  Ni7  1  0.963462  0.091760  0.289914  1
  Ni  Ni8  1  0.902380  0.415308  0.301210  1
  Ni  Ni9  1  0.235713  0.081975  0.301210  1
  Ni  Ni10  1  0.029629  0.582683  0.298626  1
  Ni  Ni11  1  0.362963  0.249349  0.298626  1
  Ni  Ni12  1  0.298904  0.580275  0.311250  1
  Ni  Ni13  1  0.696296  0.916016  0.298626  1
  Ni  Ni14  1  0.632237  0.246942  0.311250  1
  Ni  Ni15  1  0.754084  0.592076  0.287985  1
  Ni  Ni16  1  0.965570  0.913608  0.311250  1
  Ni  Ni17  1  0.087417  0.258743  0.287985  1
  Ni  Ni18  1  0.420751  0.925409  0.287985  1
  Ni  Ni19  1  0.840160  0.742168  0.314517  1
  Ni  Ni20  1  0.173493  0.408834  0.314517  1
  Ni  Ni21  1  0.111023  0.735814  0.327406  1
  Ni  Ni22  1  0.506826  0.075501  0.314517  1
  Ni  Ni23  1  0.444356  0.402481  0.327406  1
  Ni  Ni24  1  0.382118  0.730455  0.339118  1
  Ni  Ni25  1  0.777690  0.069148  0.327406  1
  Ni  Ni26  1  0.715451  0.397122  0.339118  1
  Ni  Ni27  1  0.048784  0.063788  0.339118  1
  Ni  Ni28  1  0.839109  0.563202  0.336611  1
  Ni  Ni29  1  0.172442  0.229869  0.336611  1
  Ni  Ni30  1  0.108661  0.557117  0.348799  1
  Ni  Ni31  1  0.505775  0.896535  0.336611  1
  Ni  Ni32  1  0.441994  0.223784  0.348799  1
  Ni  Ni33  1  0.566037  0.570855  0.324083  1
  Ni  Ni34  1  0.775327  0.890451  0.348799  1
  Ni  Ni35  1  0.899371  0.237522  0.324083  1
  Ni  Ni36  1  0.232704  0.904189  0.324083  1
  Ni  Ni37  1  0.652283  0.722153  0.351170  1
  Ni  Ni38  1  0.985617  0.388820  0.351170  1
  Ni  Ni39  1  0.922341  0.715559  0.363764  1
  Ni  Ni40  1  0.318950  0.055487  0.351170  1
  Ni  Ni41  1  0.255675  0.382225  0.363764  1
  Ni  Ni42  1  0.193271  0.709199  0.376188  1
  Ni  Ni43  1  0.589008  0.048892  0.363764  1
  Ni  Ni44  1  0.526605  0.375866  0.376188  1
  Ni  Ni45  1  0.859938  0.042532  0.376188  1
  Ni  Ni46  1  0.648750  0.543869  0.373629  1
  Ni  Ni47  1  0.982083  0.210536  0.373629  1
  Ni  Ni48  1  0.919740  0.536510  0.386031  1
  Ni  Ni49  1  0.315416  0.877203  0.373629  1
  Ni  Ni50  1  0.253073  0.203177  0.386031  1
  Ni  Ni51  1  0.377816  0.550998  0.361327  1
  Ni  Ni52  1  0.586406  0.869844  0.386031  1
  Ni  Ni53  1  0.711150  0.217665  0.361327  1
  Ni  Ni54  1  0.044483  0.884332  0.361327  1
  Ni  Ni55  1  0.463876  0.702319  0.388371  1
  Ni  Ni56  1  0.797210  0.368986  0.388371  1
  Ni  Ni57  1  0.734255  0.695220  0.400704  1
  Ni  Ni58  1  0.130543  0.035653  0.388371  1
  Ni  Ni59  1  0.067588  0.361886  0.400704  1
  Ni  Ni60  1  0.004715  0.688509  0.413110  1
  Ni  Ni61  1  0.400921  0.028553  0.400704  1
  Ni  Ni62  1  0.338049  0.355176  0.413110  1
  Ni  Ni63  1  0.671382  0.021843  0.413110  1
  Ni  Ni64  1  0.460405  0.523293  0.410810  1
  Ni  Ni65  1  0.793739  0.189959  0.410810  1
  Ni  Ni66  1  0.730992  0.516320  0.423139  1
  Ni  Ni67  1  0.127072  0.856626  0.410810  1
  Ni  Ni68  1  0.064325  0.182987  0.423139  1
  Ni  Ni69  1  0.189899  0.529952  0.398442  1
  Ni  Ni70  1  0.397658  0.849653  0.423139  1
  Ni  Ni71  1  0.523233  0.196619  0.398442  1
  Ni  Ni72  1  0.856566  0.863285  0.398442  1
  Ni  Ni73  1  0.275350  0.681764  0.425465  1
  Ni  Ni74  1  0.608683  0.348430  0.425465  1
  Ni  Ni75  1  0.545880  0.674924  0.437784  1
  Ni  Ni76  1  0.942017  0.015097  0.425465  1
  Ni  Ni77  1  0.879213  0.341591  0.437784  1
  Ni  Ni78  1  0.816371  0.668056  0.450138  1
  Ni  Ni79  1  0.212547  0.008258  0.437784  1
  Ni  Ni80  1  0.149704  0.334722  0.450138  1
  Ni  Ni81  1  0.483037  1.001389  0.450138  1
  Ni  Ni82  1  0.272067  0.502662  0.447901  1
  Ni  Ni83  1  0.605400  0.169329  0.447901  1
  Ni  Ni84  1  0.542621  0.495860  0.460254  1
  Ni  Ni85  1  0.938733  0.835996  0.447901  1
  Ni  Ni86  1  0.875955  0.162527  0.460254  1
  Ni  Ni87  1  1.001534  0.509433  0.435525  1
  Ni  Ni88  1  0.209288  0.829194  0.460254  1
  Ni  Ni89  1  0.334867  0.176099  0.435525  1
  Ni  Ni90  1  0.668200  0.842766  0.435525  1
  Ni  Ni91  1  0.086927  0.661252  0.462504  1
  Ni  Ni92  1  0.420260  0.327918  0.462504  1
  Ni  Ni93  1  0.357498  0.654441  0.474861  1
  Ni  Ni94  1  0.753594  0.994585  0.462504  1
  Ni  Ni95  1  0.690831  0.321108  0.474861  1
  Ni  Ni96  1  0.628025  0.647614  0.487209  1
  Ni  Ni97  1  0.024164  0.987774  0.474861  1
  Ni  Ni98  1  0.961358  0.314281  0.487209  1
  Ni  Ni99  1  0.294691  0.980947  0.487209  1
  Ni  Ni100  1  0.083701  0.482178  0.484969  1
  Ni  Ni101  1  0.417034  0.148845  0.484969  1
  Ni  Ni102  1  0.354265  0.475365  0.497333  1
  Ni  Ni103  1  0.750368  0.815512  0.484969  1
  Ni  Ni104  1  0.687599  0.142031  0.497333  1
  Ni  Ni105  1  0.813147  0.489009  0.472604  1
  Ni  Ni106  1  0.020932  0.808698  0.497333  1
  Ni  Ni107  1  0.146480  0.155676  0.472604  1
  Ni  Ni108  1  0.479814  0.822343  0.472604  1
  Ni  Ni109  1  0.898564  0.640785  0.499562  1
  Ni  Ni110  1  0.231897  0.307452  0.499562  1
  Ni  Ni111  1  0.169128  0.633971  0.511926  1
  Ni  Ni112  1  0.565230  0.974118  0.499562  1
  Ni  Ni113  1  0.502462  0.300638  0.511926  1
  Ni  Ni114  1  0.439682  0.627140  0.524291  1
  Ni  Ni115  1  0.835795  0.967305  0.511926  1
  Ni  Ni116  1  0.773015  0.293807  0.524291  1
  Ni  Ni117  1  0.106349  0.960474  0.524291  1
  Ni  Ni118  1  0.895331  0.461709  0.522034  1
  Ni  Ni119  1  0.228665  0.128375  0.522034  1
  Ni  Ni120  1  0.165902  0.454898  0.534391  1
  Ni  Ni121  1  0.561998  0.795042  0.522034  1
  Ni  Ni122  1  0.499235  0.121565  0.534391  1
  Ni  Ni123  1  0.624804  0.468536  0.509686  1
  Ni  Ni124  1  0.832569  0.788231  0.534391  1
  Ni  Ni125  1  0.958138  0.135203  0.509686  1
  Ni  Ni126  1  0.291471  0.801869  0.509686  1
  Ni  Ni127  1  0.710208  0.620290  0.536641  1
  Ni  Ni128  1  0.043541  0.286956  0.536641  1
  Ni  Ni129  1  0.980763  0.613487  0.548994  1
  Ni  Ni130  1  0.376875  0.953623  0.536641  1
  Ni  Ni131  1  0.314096  0.280154  0.548994  1
  Ni  Ni132  1  0.251295  0.606717  0.561370  1
  Ni  Ni133  1  0.647429  0.946821  0.548994  1
  Ni  Ni134  1  0.584629  0.273384  0.561370  1
  Ni  Ni135  1  0.917962  0.940051  0.561370  1
  Ni  Ni136  1  0.706949  0.441225  0.559111  1
  Ni  Ni137  1  0.040282  0.107892  0.559111  1
  Ni  Ni138  1  0.977479  0.434386  0.571430  1
  Ni  Ni139  1  0.373616  0.774559  0.559111  1
  Ni  Ni140  1  0.310812  0.101053  0.571430  1
  Ni  Ni141  1  0.436458  0.448094  0.546757  1
  Ni  Ni142  1  0.644146  0.767719  0.571430  1
  Ni  Ni143  1  0.769792  0.114761  0.546757  1
  Ni  Ni144  1  0.103125  0.781428  0.546757  1
  Ni  Ni145  1  0.521837  0.599830  0.573756  1
  Ni  Ni146  1  0.855171  0.266496  0.573756  1
  Ni  Ni147  1  0.792424  0.592857  0.586085  1
  Ni  Ni148  1  0.188504  0.933163  0.573756  1
  Ni  Ni149  1  0.125757  0.259524  0.586085  1
  Ni  Ni150  1  0.062930  0.586198  0.598453  1
  Ni  Ni151  1  0.459091  0.926190  0.586085  1
  Ni  Ni152  1  0.396263  0.252864  0.598453  1
  Ni  Ni153  1  0.729596  0.919531  0.598453  1
  Ni  Ni154  1  0.518574  0.420930  0.596191  1
  Ni  Ni155  1  0.851908  0.087597  0.596191  1
  Ni  Ni156  1  0.788953  0.413830  0.608524  1
  Ni  Ni157  1  0.185241  0.754264  0.596191  1
  Ni  Ni158  1  0.122286  0.080497  0.608524  1
  Ni  Ni159  1  0.248114  0.427641  0.583785  1
  Ni  Ni160  1  0.455619  0.747164  0.608524  1
  Ni  Ni161  1  0.581447  0.094307  0.583785  1
  Ni  Ni162  1  0.914780  0.760974  0.583785  1
  Ni  Ni163  1  0.333089  0.579639  0.610864  1
  Ni  Ni164  1  0.666423  0.246306  0.610864  1
  Ni  Ni165  1  0.604079  0.572280  0.623266  1
  Ni  Ni166  1  0.999756  0.912973  0.610864  1
  Ni  Ni167  1  0.937413  0.238947  0.623266  1
  Ni  Ni168  1  0.875013  0.565152  0.635568  1
  Ni  Ni169  1  0.270746  0.905614  0.623266  1
  Ni  Ni170  1  0.208346  0.231818  0.635568  1
  Ni  Ni171  1  0.541679  0.898485  0.635568  1
  Ni  Ni172  1  0.330488  0.400591  0.633131  1
  Ni  Ni173  1  0.663821  0.067258  0.633131  1
  Ni  Ni174  1  0.600546  0.393996  0.645725  1
  Ni  Ni175  1  0.997154  0.733925  0.633131  1
  Ni  Ni176  1  0.933879  0.060663  0.645725  1
  Ni  Ni177  1  0.059558  0.406951  0.620707  1
  Ni  Ni178  1  0.267212  0.727330  0.645725  1
  Ni  Ni179  1  0.392891  0.073617  0.620707  1
  Ni  Ni180  1  0.726224  0.740284  0.620707  1
  Ni  Ni181  1  0.144168  0.559032  0.648096  1
  Ni  Ni182  1  0.477502  0.225699  0.648096  1
  Ni  Ni183  1  0.413721  0.552948  0.660284  1
  Ni  Ni184  1  0.810835  0.892366  0.648096  1
  Ni  Ni185  1  0.747054  0.219614  0.660284  1
  Ni  Ni186  1  0.686792  0.545295  0.672812  1
  Ni  Ni187  1  0.080387  0.886281  0.660284  1
  Ni  Ni188  1  0.020125  0.211961  0.672812  1
  Ni  Ni189  1  0.353458  0.878628  0.672812  1
  Ni  Ni190  1  0.141806  0.380335  0.669489  1
  Ni  Ni191  1  0.475139  0.047002  0.669489  1
  Ni  Ni192  1  0.412670  0.373982  0.682378  1
  Ni  Ni193  1  0.808473  0.713669  0.669489  1
  Ni  Ni194  1  0.746003  0.040649  0.682378  1
  Ni  Ni195  1  0.870711  0.385695  0.657777  1
  Ni  Ni196  1  0.079336  0.707315  0.682378  1
  Ni  Ni197  1  0.204045  0.052361  0.657777  1
  Ni  Ni198  1  0.537378  0.719028  0.657777  1
  Ni  Ni199  1  0.953925  0.535875  0.685645  1
  Ni  Ni200  1  0.287259  0.202541  0.685645  1
  Ni  Ni201  1  0.223200  0.533467  0.698269  1
  Ni  Ni202  1  0.620592  0.869208  0.685645  1
  Ni  Ni203  1  0.556533  0.200134  0.698269  1
  Ni  Ni204  1  0.498745  0.524074  0.708910  1
  Ni  Ni205  1  0.889867  0.866801  0.698269  1
  Ni  Ni206  1  0.832079  0.190740  0.708910  1
  Ni  Ni207  1  0.165412  0.857407  0.708910  1
  Ni  Ni208  1  0.956034  0.357723  0.706981  1
  Ni  Ni209  1  0.289367  0.024390  0.706981  1
  Ni  Ni210  1  0.225123  0.351228  0.717172  1
  Ni  Ni211  1  0.622700  0.691057  0.706981  1
  Ni  Ni212  1  0.558456  0.017894  0.717172  1
  Ni  Ni213  1  0.683783  0.367508  0.695685  1
  Ni  Ni214  1  0.891790  0.684561  0.717172  1
  Ni  Ni215  1  0.017116  0.034175  0.695685  1
  Ni  Ni216  1  0.350449  0.700842  0.695685  1
