# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.96329098
_cell_length_b   11.08405389
_cell_length_c   48.53669402
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni108
_cell_volume   2602.55765782
_cell_formula_units_Z   108
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  0.109248  0.714723  0.275599  1
  Ni  Ni2  1  0.264772  0.029103  0.290575  1
  Ni  Ni3  1  0.420889  0.344173  0.307254  1
  Ni  Ni4  1  0.427070  0.845234  0.307121  1
  Ni  Ni5  1  0.581696  0.160061  0.324529  1
  Ni  Ni6  1  0.268151  0.529517  0.290610  1
  Ni  Ni7  1  0.920889  0.844173  0.307254  1
  Ni  Ni8  1  0.609248  0.214723  0.275599  1
  Ni  Ni9  1  0.764772  0.529103  0.290575  1
  Ni  Ni10  1  0.081696  0.660061  0.324529  1
  Ni  Ni11  1  0.768151  0.029517  0.290610  1
  Ni  Ni12  1  0.927070  0.345234  0.307121  1
  Ni  Ni13  1  0.581962  0.660809  0.323603  1
  Ni  Ni14  1  0.740102  0.976836  0.340871  1
  Ni  Ni15  1  0.898008  0.292407  0.357326  1
  Ni  Ni16  1  0.897649  0.792418  0.357376  1
  Ni  Ni17  1  0.055931  0.108205  0.373877  1
  Ni  Ni18  1  0.739527  0.475957  0.340635  1
  Ni  Ni19  1  0.398008  0.792407  0.357326  1
  Ni  Ni20  1  0.081962  0.160809  0.323603  1
  Ni  Ni21  1  0.240102  0.476836  0.340871  1
  Ni  Ni22  1  0.555931  0.608205  0.373877  1
  Ni  Ni23  1  0.239527  0.975957  0.340635  1
  Ni  Ni24  1  0.397649  0.292418  0.357376  1
  Ni  Ni25  1  0.055366  0.607937  0.374165  1
  Ni  Ni26  1  0.213395  0.923732  0.390704  1
  Ni  Ni27  1  0.371196  0.239431  0.407401  1
  Ni  Ni28  1  0.371388  0.739425  0.407381  1
  Ni  Ni29  1  0.529095  0.055123  0.424116  1
  Ni  Ni30  1  0.213532  0.423749  0.390759  1
  Ni  Ni31  1  0.871196  0.739431  0.407401  1
  Ni  Ni32  1  0.555366  0.107937  0.374165  1
  Ni  Ni33  1  0.713395  0.423732  0.390704  1
  Ni  Ni34  1  0.029095  0.555123  0.424116  1
  Ni  Ni35  1  0.713532  0.923749  0.390759  1
  Ni  Ni36  1  0.871388  0.239425  0.407381  1
  Ni  Ni37  1  0.529189  0.555200  0.424034  1
  Ni  Ni38  1  0.686987  0.870850  0.440765  1
  Ni  Ni39  1  0.844836  0.186557  0.457432  1
  Ni  Ni40  1  0.844773  0.686553  0.457437  1
  Ni  Ni41  1  0.002648  0.002265  0.474105  1
  Ni  Ni42  1  0.686946  0.370841  0.440748  1
  Ni  Ni43  1  0.344836  0.686557  0.457432  1
  Ni  Ni44  1  0.029189  0.055200  0.424034  1
  Ni  Ni45  1  0.186987  0.370850  0.440765  1
  Ni  Ni46  1  0.502648  0.502265  0.474105  1
  Ni  Ni47  1  0.186946  0.870841  0.440748  1
  Ni  Ni48  1  0.344773  0.186553  0.457437  1
  Ni  Ni49  1  0.002628  0.502249  0.474123  1
  Ni  Ni50  1  0.160458  0.817959  0.490793  1
  Ni  Ni51  1  0.318292  0.133661  0.507472  1
  Ni  Ni52  1  0.318321  0.633665  0.507475  1
  Ni  Ni53  1  0.476151  0.949374  0.524145  1
  Ni  Ni54  1  0.160487  0.317962  0.490796  1
  Ni  Ni55  1  0.818292  0.633661  0.507472  1
  Ni  Ni56  1  0.502628  0.002249  0.474123  1
  Ni  Ni57  1  0.660458  0.317959  0.490793  1
  Ni  Ni58  1  0.976151  0.449374  0.524145  1
  Ni  Ni59  1  0.660487  0.817962  0.490796  1
  Ni  Ni60  1  0.818321  0.133665  0.507475  1
  Ni  Ni61  1  0.476131  0.449358  0.524162  1
  Ni  Ni62  1  0.634006  0.765071  0.540830  1
  Ni  Ni63  1  0.791833  0.080783  0.557520  1
  Ni  Ni64  1  0.791792  0.580774  0.557503  1
  Ni  Ni65  1  0.949590  0.896424  0.574234  1
  Ni  Ni66  1  0.633943  0.265067  0.540835  1
  Ni  Ni67  1  0.291833  0.580783  0.557520  1
  Ni  Ni68  1  0.976131  0.949358  0.524162  1
  Ni  Ni69  1  0.134006  0.265071  0.540830  1
  Ni  Ni70  1  0.449590  0.396424  0.574234  1
  Ni  Ni71  1  0.133943  0.765067  0.540835  1
  Ni  Ni72  1  0.291792  0.080774  0.557503  1
  Ni  Ni73  1  0.949684  0.396500  0.574151  1
  Ni  Ni74  1  0.107391  0.712199  0.590886  1
  Ni  Ni75  1  0.265247  0.027874  0.607509  1
  Ni  Ni76  1  0.265384  0.527892  0.607564  1
  Ni  Ni77  1  0.423413  0.843687  0.624103  1
  Ni  Ni78  1  0.107583  0.212193  0.590866  1
  Ni  Ni79  1  0.765247  0.527874  0.607509  1
  Ni  Ni80  1  0.449684  0.896500  0.574151  1
  Ni  Ni81  1  0.607391  0.212199  0.590886  1
  Ni  Ni82  1  0.923413  0.343687  0.624103  1
  Ni  Ni83  1  0.607583  0.712193  0.590866  1
  Ni  Ni84  1  0.765384  0.027892  0.607564  1
  Ni  Ni85  1  0.422848  0.343419  0.624391  1
  Ni  Ni86  1  0.581130  0.659205  0.640892  1
  Ni  Ni87  1  0.739251  0.975667  0.657633  1
  Ni  Ni88  1  0.738677  0.474787  0.657396  1
  Ni  Ni89  1  0.896817  0.790814  0.674664  1
  Ni  Ni90  1  0.580771  0.159217  0.640941  1
  Ni  Ni91  1  0.239251  0.475667  0.657633  1
  Ni  Ni92  1  0.922848  0.843419  0.624391  1
  Ni  Ni93  1  0.081130  0.159205  0.640892  1
  Ni  Ni94  1  0.396817  0.290814  0.674664  1
  Ni  Ni95  1  0.080771  0.659217  0.640941  1
  Ni  Ni96  1  0.238677  0.974787  0.657396  1
  Ni  Ni97  1  0.897083  0.291562  0.673738  1
  Ni  Ni98  1  0.051709  0.606389  0.691146  1
  Ni  Ni99  1  0.210628  0.922106  0.707657  1
  Ni  Ni100  1  0.214007  0.422520  0.707692  1
  Ni  Ni101  1  0.369531  0.736900  0.722669  1
  Ni  Ni102  1  0.057890  0.107451  0.691014  1
  Ni  Ni103  1  0.710628  0.422106  0.707657  1
  Ni  Ni104  1  0.397083  0.791562  0.673738  1
  Ni  Ni105  1  0.551709  0.106389  0.691146  1
  Ni  Ni106  1  0.869531  0.236900  0.722669  1
  Ni  Ni107  1  0.557890  0.607451  0.691014  1
  Ni  Ni108  1  0.714007  0.922520  0.707692  1
