# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.55060018
_cell_length_b   13.21001490
_cell_length_c   46.38768790
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.89105451
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni204
_cell_volume   4957.42513677
_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  0.640596  0.696070  0.295856  1
  Ni  Ni2  1  0.140596  0.696070  0.295856  1
  Ni  Ni3  1  0.058709  0.037743  0.287754  1
  Ni  Ni4  1  0.485998  0.377683  0.280055  1
  Ni  Ni5  1  0.558709  0.037743  0.287754  1
  Ni  Ni6  1  0.985998  0.377683  0.280055  1
  Ni  Ni7  1  0.734566  0.537760  0.287754  1
  Ni  Ni8  1  0.234566  0.537760  0.287754  1
  Ni  Ni9  1  0.147164  0.877662  0.280057  1
  Ni  Ni10  1  0.310982  0.196078  0.295857  1
  Ni  Ni11  1  0.647164  0.877662  0.280057  1
  Ni  Ni12  1  0.810982  0.196078  0.295857  1
  Ni  Ni13  1  0.383286  0.678084  0.322397  1
  Ni  Ni14  1  0.883286  0.678084  0.322397  1
  Ni  Ni15  1  0.801983  0.017542  0.314063  1
  Ni  Ni16  1  0.224393  0.356146  0.305182  1
  Ni  Ni17  1  0.301983  0.017542  0.314063  1
  Ni  Ni18  1  0.724393  0.356146  0.305182  1
  Ni  Ni19  1  0.471067  0.517543  0.314064  1
  Ni  Ni20  1  0.971067  0.517543  0.314064  1
  Ni  Ni21  1  0.887241  0.856146  0.305186  1
  Ni  Ni22  1  0.050300  0.178080  0.322397  1
  Ni  Ni23  1  0.387241  0.856146  0.305186  1
  Ni  Ni24  1  0.550300  0.178080  0.322397  1
  Ni  Ni25  1  0.123653  0.658202  0.348986  1
  Ni  Ni26  1  0.623653  0.658202  0.348986  1
  Ni  Ni27  1  0.542425  0.997649  0.340339  1
  Ni  Ni28  1  0.964364  0.337153  0.331990  1
  Ni  Ni29  1  0.042425  0.997649  0.340339  1
  Ni  Ni30  1  0.464364  0.337153  0.331990  1
  Ni  Ni31  1  0.210727  0.497649  0.340338  1
  Ni  Ni32  1  0.710727  0.497649  0.340338  1
  Ni  Ni33  1  0.628285  0.837151  0.331992  1
  Ni  Ni34  1  0.790051  0.158201  0.348987  1
  Ni  Ni35  1  0.128285  0.837151  0.331992  1
  Ni  Ni36  1  0.290051  0.158201  0.348987  1
  Ni  Ni37  1  0.863626  0.638942  0.375175  1
  Ni  Ni38  1  0.363626  0.638942  0.375175  1
  Ni  Ni39  1  0.282776  0.978744  0.366570  1
  Ni  Ni40  1  0.704310  0.318423  0.357911  1
  Ni  Ni41  1  0.782776  0.978744  0.366570  1
  Ni  Ni42  1  0.204310  0.318423  0.357911  1
  Ni  Ni43  1  0.951469  0.478744  0.366570  1
  Ni  Ni44  1  0.451469  0.478744  0.366570  1
  Ni  Ni45  1  0.369610  0.818423  0.357913  1
  Ni  Ni46  1  0.530815  0.138942  0.375176  1
  Ni  Ni47  1  0.869610  0.818423  0.357913  1
  Ni  Ni48  1  0.030815  0.138942  0.375176  1
  Ni  Ni49  1  0.603694  0.619429  0.401648  1
  Ni  Ni50  1  0.103694  0.619429  0.401648  1
  Ni  Ni51  1  0.023028  0.959287  0.392921  1
  Ni  Ni52  1  0.443866  0.298923  0.384280  1
  Ni  Ni53  1  0.523028  0.959287  0.392921  1
  Ni  Ni54  1  0.943866  0.298923  0.384280  1
  Ni  Ni55  1  0.691757  0.459287  0.392920  1
  Ni  Ni56  1  0.191757  0.459287  0.392920  1
  Ni  Ni57  1  0.110553  0.798922  0.384282  1
  Ni  Ni58  1  0.271231  0.119429  0.401649  1
  Ni  Ni59  1  0.610553  0.798922  0.384282  1
  Ni  Ni60  1  0.771231  0.119429  0.401649  1
  Ni  Ni61  1  0.343966  0.600095  0.427970  1
  Ni  Ni62  1  0.843966  0.600095  0.427970  1
  Ni  Ni63  1  0.763420  0.939865  0.419252  1
  Ni  Ni64  1  0.183820  0.279540  0.410513  1
  Ni  Ni65  1  0.263420  0.939865  0.419252  1
  Ni  Ni66  1  0.683820  0.279540  0.410513  1
  Ni  Ni67  1  0.431940  0.439864  0.419251  1
  Ni  Ni68  1  0.931940  0.439864  0.419251  1
  Ni  Ni69  1  0.851215  0.779539  0.410515  1
  Ni  Ni70  1  0.011624  0.100095  0.427971  1
  Ni  Ni71  1  0.351215  0.779539  0.410515  1
  Ni  Ni72  1  0.511624  0.100095  0.427971  1
  Ni  Ni73  1  0.084211  0.580685  0.454341  1
  Ni  Ni74  1  0.584211  0.580685  0.454341  1
  Ni  Ni75  1  0.503772  0.920478  0.445582  1
  Ni  Ni76  1  0.924002  0.260218  0.436858  1
  Ni  Ni77  1  1.003772  0.920478  0.445582  1
  Ni  Ni78  1  0.424002  0.260218  0.436858  1
  Ni  Ni79  1  0.172199  0.420478  0.445582  1
  Ni  Ni80  1  0.672199  0.420478  0.445582  1
  Ni  Ni81  1  0.591709  0.760217  0.436859  1
  Ni  Ni82  1  0.751966  0.080685  0.454341  1
  Ni  Ni83  1  0.091709  0.760217  0.436859  1
  Ni  Ni84  1  0.251966  0.080685  0.454341  1
  Ni  Ni85  1  0.824493  0.561320  0.480678  1
  Ni  Ni86  1  0.324493  0.561320  0.480678  1
  Ni  Ni87  1  0.244131  0.901101  0.471925  1
  Ni  Ni88  1  0.664260  0.240854  0.463168  1
  Ni  Ni89  1  0.744131  0.901101  0.471925  1
  Ni  Ni90  1  0.164260  0.240854  0.463168  1
  Ni  Ni91  1  0.912460  0.401100  0.471925  1
  Ni  Ni92  1  0.412460  0.401100  0.471925  1
  Ni  Ni93  1  0.332084  0.740854  0.463169  1
  Ni  Ni94  1  0.492317  0.061320  0.480679  1
  Ni  Ni95  1  0.832084  0.740854  0.463169  1
  Ni  Ni96  1  0.992317  0.061320  0.480679  1
  Ni  Ni97  1  0.564793  0.541948  0.507017  1
  Ni  Ni98  1  0.064793  0.541948  0.507017  1
  Ni  Ni99  1  0.984450  0.881719  0.498261  1
  Ni  Ni100  1  0.404565  0.221491  0.489505  1
  Ni  Ni101  1  0.484450  0.881719  0.498261  1
  Ni  Ni102  1  0.904565  0.221491  0.489505  1
  Ni  Ni103  1  0.652757  0.381719  0.498261  1
  Ni  Ni104  1  0.152757  0.381719  0.498261  1
  Ni  Ni105  1  0.072414  0.721490  0.489506  1
  Ni  Ni106  1  0.232642  0.041948  0.507018  1
  Ni  Ni107  1  0.572414  0.721490  0.489506  1
  Ni  Ni108  1  0.732642  0.041948  0.507018  1
  Ni  Ni109  1  0.305123  0.522585  0.533354  1
  Ni  Ni110  1  0.805123  0.522585  0.533354  1
  Ni  Ni111  1  0.724747  0.862338  0.524597  1
  Ni  Ni112  1  0.144890  0.202118  0.515844  1
  Ni  Ni113  1  0.224747  0.862338  0.524597  1
  Ni  Ni114  1  0.644890  0.202118  0.515844  1
  Ni  Ni115  1  0.393076  0.362338  0.524597  1
  Ni  Ni116  1  0.893076  0.362338  0.524597  1
  Ni  Ni117  1  0.812714  0.702118  0.515845  1
  Ni  Ni118  1  0.972947  0.022584  0.533355  1
  Ni  Ni119  1  0.312714  0.702118  0.515845  1
  Ni  Ni120  1  0.472947  0.022584  0.533355  1
  Ni  Ni121  1  0.045498  0.503221  0.559664  1
  Ni  Ni122  1  0.545498  0.503221  0.559664  1
  Ni  Ni123  1  0.465008  0.842960  0.550940  1
  Ni  Ni124  1  0.885241  0.182753  0.542181  1
  Ni  Ni125  1  0.965008  0.842960  0.550940  1
  Ni  Ni126  1  0.385241  0.182753  0.542181  1
  Ni  Ni127  1  0.133435  0.342960  0.550940  1
  Ni  Ni128  1  0.633435  0.342960  0.550940  1
  Ni  Ni129  1  0.552996  0.682753  0.542182  1
  Ni  Ni130  1  0.713205  0.003221  0.559665  1
  Ni  Ni131  1  0.052996  0.682753  0.542182  1
  Ni  Ni132  1  0.213205  0.003221  0.559665  1
  Ni  Ni133  1  0.785992  0.483899  0.586008  1
  Ni  Ni134  1  0.285992  0.483899  0.586008  1
  Ni  Ni135  1  0.205267  0.823574  0.577271  1
  Ni  Ni136  1  0.625583  0.163343  0.568552  1
  Ni  Ni137  1  0.705267  0.823574  0.577271  1
  Ni  Ni138  1  0.125583  0.163343  0.568552  1
  Ni  Ni139  1  0.873787  0.323574  0.577271  1
  Ni  Ni140  1  0.373787  0.323574  0.577271  1
  Ni  Ni141  1  0.293241  0.663343  0.568552  1
  Ni  Ni142  1  0.453387  0.983898  0.586010  1
  Ni  Ni143  1  0.793241  0.663343  0.568552  1
  Ni  Ni144  1  0.953387  0.983898  0.586010  1
  Ni  Ni145  1  0.526654  0.464516  0.612240  1
  Ni  Ni146  1  0.026654  0.464516  0.612240  1
  Ni  Ni147  1  0.945450  0.804152  0.603602  1
  Ni  Ni148  1  0.365976  0.144010  0.594873  1
  Ni  Ni149  1  0.445450  0.804152  0.603602  1
  Ni  Ni150  1  0.865976  0.144010  0.594873  1
  Ni  Ni151  1  0.614179  0.304151  0.603602  1
  Ni  Ni152  1  0.114179  0.304151  0.603602  1
  Ni  Ni153  1  0.033513  0.644010  0.594874  1
  Ni  Ni154  1  0.193341  0.964515  0.612242  1
  Ni  Ni155  1  0.533513  0.644010  0.594874  1
  Ni  Ni156  1  0.693341  0.964515  0.612242  1
  Ni  Ni157  1  0.267597  0.445016  0.638610  1
  Ni  Ni158  1  0.767597  0.445016  0.638610  1
  Ni  Ni159  1  0.685738  0.784694  0.629953  1
  Ni  Ni160  1  0.106392  0.124496  0.621347  1
  Ni  Ni161  1  0.185738  0.784694  0.629953  1
  Ni  Ni162  1  0.606392  0.124496  0.621347  1
  Ni  Ni163  1  0.354431  0.284694  0.629953  1
  Ni  Ni164  1  0.854431  0.284694  0.629953  1
  Ni  Ni165  1  0.773581  0.624497  0.621347  1
  Ni  Ni166  1  0.932897  0.945015  0.638612  1
  Ni  Ni167  1  0.273581  0.624497  0.621347  1
  Ni  Ni168  1  0.432897  0.945015  0.638612  1
  Ni  Ni169  1  0.008922  0.426287  0.664530  1
  Ni  Ni170  1  0.508922  0.426287  0.664530  1
  Ni  Ni171  1  0.426480  0.765790  0.656185  1
  Ni  Ni172  1  0.847156  0.105238  0.647536  1
  Ni  Ni173  1  0.926480  0.765790  0.656185  1
  Ni  Ni174  1  0.347156  0.105238  0.647536  1
  Ni  Ni175  1  0.094782  0.265790  0.656184  1
  Ni  Ni176  1  0.594782  0.265790  0.656184  1
  Ni  Ni177  1  0.513554  0.605237  0.647536  1
  Ni  Ni178  1  0.672843  0.926286  0.664532  1
  Ni  Ni179  1  0.013554  0.605237  0.647536  1
  Ni  Ni180  1  0.172843  0.926286  0.664532  1
  Ni  Ni181  1  0.749965  0.407293  0.691337  1
  Ni  Ni182  1  0.249965  0.407293  0.691337  1
  Ni  Ni183  1  0.166140  0.745895  0.682459  1
  Ni  Ni184  1  0.586907  0.085358  0.674125  1
  Ni  Ni185  1  0.666140  0.745895  0.682459  1
  Ni  Ni186  1  0.086907  0.085358  0.674125  1
  Ni  Ni187  1  0.835224  0.245896  0.682459  1
  Ni  Ni188  1  0.335224  0.245896  0.682459  1
  Ni  Ni189  1  0.253920  0.585354  0.674126  1
  Ni  Ni190  1  0.412814  0.907292  0.691341  1
  Ni  Ni191  1  0.753920  0.585354  0.674126  1
  Ni  Ni192  1  0.912814  0.907292  0.691341  1
  Ni  Ni193  1  0.490043  0.385776  0.716466  1
  Ni  Ni194  1  0.990043  0.385776  0.716466  1
  Ni  Ni195  1  0.902641  0.725679  0.708769  1
  Ni  Ni196  1  0.326225  0.067360  0.700665  1
  Ni  Ni197  1  0.402641  0.725679  0.708769  1
  Ni  Ni198  1  0.826225  0.067360  0.700665  1
  Ni  Ni199  1  0.578498  0.225695  0.708768  1
  Ni  Ni200  1  0.078498  0.225695  0.708768  1
  Ni  Ni201  1  0.996611  0.567369  0.700667  1
  Ni  Ni202  1  0.151209  0.885755  0.716468  1
  Ni  Ni203  1  0.496611  0.567369  0.700667  1
  Ni  Ni204  1  0.651209  0.885755  0.716468  1
