# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.54271352
_cell_length_b   12.43469394
_cell_length_c   48.07789791
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.15411935
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni162
_cell_volume   3908.69215717
_cell_formula_units_Z   162
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  0.550607  0.175725  0.316100  1
  Ni  Ni2  1  0.532732  0.852880  0.297869  1
  Ni  Ni3  1  0.503730  0.536561  0.282294  1
  Ni  Ni4  1  0.883941  0.842391  0.316100  1
  Ni  Ni5  1  0.866066  0.519547  0.297869  1
  Ni  Ni6  1  0.217274  0.509058  0.316100  1
  Ni  Ni7  1  0.837064  0.203227  0.282294  1
  Ni  Ni8  1  0.199399  0.186214  0.297869  1
  Ni  Ni9  1  0.170397  0.869894  0.282294  1
  Ni  Ni10  1  0.631938  0.356462  0.295864  1
  Ni  Ni11  1  0.602576  0.038291  0.279741  1
  Ni  Ni12  1  0.656828  0.677061  0.313493  1
  Ni  Ni13  1  0.965272  0.023129  0.295864  1
  Ni  Ni14  1  0.935910  0.704958  0.279741  1
  Ni  Ni15  1  0.298605  0.689795  0.295864  1
  Ni  Ni16  1  0.990162  0.343728  0.313493  1
  Ni  Ni17  1  0.269243  0.371624  0.279741  1
  Ni  Ni18  1  0.323495  0.010395  0.313493  1
  Ni  Ni19  1  0.619390  0.137479  0.365782  1
  Ni  Ni20  1  0.595725  0.817204  0.349182  1
  Ni  Ni21  1  0.574602  0.495796  0.332606  1
  Ni  Ni22  1  0.952723  0.804146  0.365782  1
  Ni  Ni23  1  0.929058  0.483870  0.349182  1
  Ni  Ni24  1  0.286057  0.470813  0.365782  1
  Ni  Ni25  1  0.907935  0.162462  0.332606  1
  Ni  Ni26  1  0.262391  0.150537  0.349182  1
  Ni  Ni27  1  0.241268  0.829129  0.332606  1
  Ni  Ni28  1  0.703059  0.318969  0.346539  1
  Ni  Ni29  1  0.680822  0.997827  0.329880  1
  Ni  Ni30  1  0.725930  0.639759  0.363127  1
  Ni  Ni31  1  0.036393  0.985636  0.346539  1
  Ni  Ni32  1  0.014156  0.664494  0.329880  1
  Ni  Ni33  1  0.369726  0.652302  0.346539  1
  Ni  Ni34  1  0.059264  0.306426  0.363127  1
  Ni  Ni35  1  0.347489  0.331161  0.329880  1
  Ni  Ni36  1  0.392597  0.973093  0.363127  1
  Ni  Ni37  1  0.688234  0.099421  0.415780  1
  Ni  Ni38  1  0.665354  0.778799  0.399122  1
  Ni  Ni39  1  0.642287  0.458172  0.382512  1
  Ni  Ni40  1  0.021567  0.766088  0.415780  1
  Ni  Ni41  1  0.998688  0.445466  0.399122  1
  Ni  Ni42  1  0.354900  0.432754  0.415780  1
  Ni  Ni43  1  0.975621  0.124839  0.382512  1
  Ni  Ni44  1  0.332021  0.112132  0.399122  1
  Ni  Ni45  1  0.308954  0.791506  0.382512  1
  Ni  Ni46  1  0.771711  0.280823  0.396435  1
  Ni  Ni47  1  0.748817  0.960194  0.379780  1
  Ni  Ni48  1  0.794648  0.601491  0.413080  1
  Ni  Ni49  1  0.105045  0.947489  0.396435  1
  Ni  Ni50  1  0.082150  0.626860  0.379780  1
  Ni  Ni51  1  0.438378  0.614156  0.396435  1
  Ni  Ni52  1  0.127982  0.268158  0.413080  1
  Ni  Ni53  1  0.415484  0.293527  0.379780  1
  Ni  Ni54  1  0.461315  0.934824  0.413080  1
  Ni  Ni55  1  0.757148  0.061347  0.465750  1
  Ni  Ni56  1  0.734197  0.740704  0.449094  1
  Ni  Ni57  1  0.711254  0.420063  0.432445  1
  Ni  Ni58  1  0.090481  0.728014  0.465750  1
  Ni  Ni59  1  0.067531  0.407371  0.449094  1
  Ni  Ni60  1  0.423814  0.394681  0.465750  1
  Ni  Ni61  1  0.044588  0.086730  0.432445  1
  Ni  Ni62  1  0.400864  0.074038  0.449094  1
  Ni  Ni63  1  0.377921  0.753396  0.432445  1
  Ni  Ni64  1  0.840525  0.242758  0.446393  1
  Ni  Ni65  1  0.817569  0.922129  0.429740  1
  Ni  Ni66  1  0.863472  0.563408  0.463048  1
  Ni  Ni67  1  0.173859  0.909424  0.446393  1
  Ni  Ni68  1  0.150902  0.588795  0.429740  1
  Ni  Ni69  1  0.507192  0.576091  0.446393  1
  Ni  Ni70  1  0.196805  0.230074  0.463048  1
  Ni  Ni71  1  0.484235  0.255462  0.429740  1
  Ni  Ni72  1  0.530138  0.896741  0.463048  1
  Ni  Ni73  1  0.826014  0.023268  0.515716  1
  Ni  Ni74  1  0.803060  0.702629  0.499061  1
  Ni  Ni75  1  0.780109  0.381985  0.482406  1
  Ni  Ni76  1  0.159347  0.689935  0.515716  1
  Ni  Ni77  1  0.136393  0.369296  0.499061  1
  Ni  Ni78  1  0.492680  0.356602  0.515716  1
  Ni  Ni79  1  0.113442  0.048652  0.482406  1
  Ni  Ni80  1  0.469727  0.035962  0.499061  1
  Ni  Ni81  1  0.446775  0.715319  0.482406  1
  Ni  Ni82  1  0.909377  0.204687  0.496358  1
  Ni  Ni83  1  0.886424  0.884047  0.479703  1
  Ni  Ni84  1  0.932329  0.525330  0.513013  1
  Ni  Ni85  1  0.242711  0.871353  0.496358  1
  Ni  Ni86  1  0.219757  0.550714  0.479703  1
  Ni  Ni87  1  0.576044  0.538020  0.496358  1
  Ni  Ni88  1  0.265662  0.191997  0.513013  1
  Ni  Ni89  1  0.553090  0.217381  0.479703  1
  Ni  Ni90  1  0.598995  0.858664  0.513013  1
  Ni  Ni91  1  0.894869  0.985187  0.565680  1
  Ni  Ni92  1  0.871912  0.664558  0.549026  1
  Ni  Ni93  1  0.848966  0.343908  0.532371  1
  Ni  Ni94  1  0.228202  0.651854  0.565680  1
  Ni  Ni95  1  0.205245  0.331225  0.549026  1
  Ni  Ni96  1  0.561535  0.318520  0.565680  1
  Ni  Ni97  1  0.182299  0.010575  0.532371  1
  Ni  Ni98  1  0.538579  0.997891  0.549026  1
  Ni  Ni99  1  0.515632  0.677241  0.532371  1
  Ni  Ni100  1  0.978240  0.166611  0.546325  1
  Ni  Ni101  1  0.955290  0.845968  0.529669  1
  Ni  Ni102  1  1.001183  0.487253  0.562975  1
  Ni  Ni103  1  0.311573  0.833278  0.546325  1
  Ni  Ni104  1  0.288623  0.512635  0.529669  1
  Ni  Ni105  1  0.644907  0.499945  0.546325  1
  Ni  Ni106  1  0.334516  0.153919  0.562975  1
  Ni  Ni107  1  0.621956  0.179302  0.529669  1
  Ni  Ni108  1  0.667850  0.820586  0.562975  1
  Ni  Ni109  1  0.963620  0.947122  0.615639  1
  Ni  Ni110  1  0.940726  0.626493  0.598984  1
  Ni  Ni111  1  0.917789  0.305825  0.582339  1
  Ni  Ni112  1  0.296954  0.613789  0.615639  1
  Ni  Ni113  1  0.274059  0.293160  0.598984  1
  Ni  Ni114  1  0.630287  0.280455  0.615639  1
  Ni  Ni115  1  0.251123  0.972491  0.582339  1
  Ni  Ni116  1  0.607393  0.959826  0.598984  1
  Ni  Ni117  1  0.584456  0.639158  0.582339  1
  Ni  Ni118  1  0.047083  0.128517  0.596297  1
  Ni  Ni119  1  0.024204  0.807895  0.579640  1
  Ni  Ni120  1  0.070150  0.449143  0.612908  1
  Ni  Ni121  1  0.380416  0.795183  0.596297  1
  Ni  Ni122  1  0.357537  0.474561  0.579640  1
  Ni  Ni123  1  0.713750  0.461850  0.596297  1
  Ni  Ni124  1  0.403483  0.115810  0.612908  1
  Ni  Ni125  1  0.690870  0.141228  0.579640  1
  Ni  Ni126  1  0.736817  0.782477  0.612908  1
  Ni  Ni127  1  0.031615  0.909488  0.665539  1
  Ni  Ni128  1  0.009378  0.588347  0.648880  1
  Ni  Ni129  1  0.986507  0.267556  0.632292  1
  Ni  Ni130  1  0.364948  0.576155  0.665539  1
  Ni  Ni131  1  0.342711  0.255013  0.648880  1
  Ni  Ni132  1  0.698282  0.242822  0.665539  1
  Ni  Ni133  1  0.319840  0.934223  0.632292  1
  Ni  Ni134  1  0.676045  0.921680  0.648880  1
  Ni  Ni135  1  0.653174  0.600890  0.632292  1
  Ni  Ni136  1  0.116713  0.090112  0.646237  1
  Ni  Ni137  1  0.093047  0.769836  0.629638  1
  Ni  Ni138  1  0.137836  0.411520  0.662813  1
  Ni  Ni139  1  0.450046  0.756779  0.646237  1
  Ni  Ni140  1  0.426381  0.436503  0.629638  1
  Ni  Ni141  1  0.783379  0.423445  0.646237  1
  Ni  Ni142  1  0.471169  0.078187  0.662813  1
  Ni  Ni143  1  0.759714  0.103170  0.629638  1
  Ni  Ni144  1  0.804502  0.744853  0.662813  1
  Ni  Ni145  1  0.109861  0.869025  0.715678  1
  Ni  Ni146  1  0.080499  0.550854  0.699555  1
  Ni  Ni147  1  0.055609  0.230254  0.681926  1
  Ni  Ni148  1  0.443194  0.535692  0.715678  1
  Ni  Ni149  1  0.413832  0.217520  0.699555  1
  Ni  Ni150  1  0.776528  0.202358  0.715678  1
  Ni  Ni151  1  0.388942  0.896921  0.681926  1
  Ni  Ni152  1  0.747166  0.884187  0.699555  1
  Ni  Ni153  1  0.722276  0.563588  0.681926  1
  Ni  Ni154  1  0.179705  0.054435  0.697551  1
  Ni  Ni155  1  0.161830  0.731591  0.679320  1
  Ni  Ni156  1  0.208707  0.370755  0.713125  1
  Ni  Ni157  1  0.513038  0.721102  0.697551  1
  Ni  Ni158  1  0.495164  0.398258  0.679320  1
  Ni  Ni159  1  0.846372  0.387769  0.697551  1
  Ni  Ni160  1  0.542040  0.037422  0.713125  1
  Ni  Ni161  1  0.828497  0.064924  0.679320  1
  Ni  Ni162  1  0.875374  0.704088  0.713125  1
