# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.53275162
_cell_length_b   9.42455249
_cell_length_c   46.59274259
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   66.01627635
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni180
_cell_volume   4225.77068509
_cell_formula_units_Z   180
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  0.056608  0.310490  0.306514  1
  Ni  Ni2  1  0.446251  0.335974  0.298430  1
  Ni  Ni3  1  0.828827  0.365833  0.290946  1
  Ni  Ni4  1  0.056608  0.810490  0.306514  1
  Ni  Ni5  1  0.446251  0.835974  0.298430  1
  Ni  Ni6  1  0.828827  0.865833  0.290946  1
  Ni  Ni7  1  0.271227  0.098096  0.292782  1
  Ni  Ni8  1  0.655374  0.123806  0.284388  1
  Ni  Ni9  1  0.878112  0.086391  0.299793  1
  Ni  Ni10  1  0.271227  0.598096  0.292782  1
  Ni  Ni11  1  0.655374  0.623806  0.284388  1
  Ni  Ni12  1  0.878112  0.586391  0.299793  1
  Ni  Ni13  1  0.897192  0.252513  0.335178  1
  Ni  Ni14  1  0.282246  0.278125  0.324716  1
  Ni  Ni15  1  0.669019  0.301550  0.316038  1
  Ni  Ni16  1  0.897192  0.752513  0.335178  1
  Ni  Ni17  1  0.282246  0.778125  0.324716  1
  Ni  Ni18  1  0.669019  0.801550  0.316038  1
  Ni  Ni19  1  0.106808  0.038581  0.316829  1
  Ni  Ni20  1  0.493952  0.061553  0.308333  1
  Ni  Ni21  1  0.719750  0.025083  0.328484  1
  Ni  Ni22  1  0.106808  0.538581  0.316829  1
  Ni  Ni23  1  0.493952  0.561553  0.308333  1
  Ni  Ni24  1  0.719750  0.525083  0.328484  1
  Ni  Ni25  1  0.732568  0.200151  0.364299  1
  Ni  Ni26  1  0.122856  0.213549  0.353160  1
  Ni  Ni27  1  0.508167  0.235656  0.344018  1
  Ni  Ni28  1  0.732568  0.700151  0.364299  1
  Ni  Ni29  1  0.122856  0.713549  0.353160  1
  Ni  Ni30  1  0.508167  0.735656  0.344018  1
  Ni  Ni31  1  0.946782  0.978630  0.345352  1
  Ni  Ni32  1  0.333431  1.001661  0.337077  1
  Ni  Ni33  1  0.555825  0.964787  0.355999  1
  Ni  Ni34  1  0.946782  0.478630  0.345352  1
  Ni  Ni35  1  0.333431  0.501661  0.337077  1
  Ni  Ni36  1  0.555825  0.464787  0.355999  1
  Ni  Ni37  1  0.568416  0.144085  0.393801  1
  Ni  Ni38  1  0.957646  0.159424  0.383717  1
  Ni  Ni39  1  0.343703  0.181593  0.373799  1
  Ni  Ni40  1  0.568416  0.644085  0.393801  1
  Ni  Ni41  1  0.957646  0.659424  0.383717  1
  Ni  Ni42  1  0.343703  0.681593  0.373799  1
  Ni  Ni43  1  0.781487  0.926677  0.375973  1
  Ni  Ni44  1  0.168520  0.944868  0.365122  1
  Ni  Ni45  1  0.392418  0.908598  0.385523  1
  Ni  Ni46  1  0.781487  0.426677  0.375973  1
  Ni  Ni47  1  0.168520  0.444868  0.365122  1
  Ni  Ni48  1  0.392418  0.408598  0.385523  1
  Ni  Ni49  1  0.403448  0.091637  0.423648  1
  Ni  Ni50  1  0.792477  0.108463  0.413861  1
  Ni  Ni51  1  0.180597  0.125846  0.403576  1
  Ni  Ni52  1  0.403448  0.591637  0.423648  1
  Ni  Ni53  1  0.792477  0.608463  0.413861  1
  Ni  Ni54  1  0.180597  0.625846  0.403576  1
  Ni  Ni55  1  0.615737  0.873776  0.405592  1
  Ni  Ni56  1  0.005620  0.888855  0.395087  1
  Ni  Ni57  1  0.227273  0.856146  0.415286  1
  Ni  Ni58  1  0.615737  0.373776  0.405592  1
  Ni  Ni59  1  0.005620  0.388855  0.395087  1
  Ni  Ni60  1  0.227273  0.356146  0.415286  1
  Ni  Ni61  1  0.238868  0.038517  0.453359  1
  Ni  Ni62  1  0.627242  0.056132  0.443534  1
  Ni  Ni63  1  0.015821  0.073183  0.433484  1
  Ni  Ni64  1  0.238868  0.538517  0.453359  1
  Ni  Ni65  1  0.627242  0.556132  0.443534  1
  Ni  Ni66  1  0.015821  0.573183  0.433484  1
  Ni  Ni67  1  0.450589  0.820858  0.435212  1
  Ni  Ni68  1  0.839572  0.837796  0.425313  1
  Ni  Ni69  1  0.062657  0.802881  0.445050  1
  Ni  Ni70  1  0.450589  0.320858  0.435212  1
  Ni  Ni71  1  0.839572  0.337796  0.425313  1
  Ni  Ni72  1  0.062657  0.302881  0.445050  1
  Ni  Ni73  1  0.074289  0.985244  0.483119  1
  Ni  Ni74  1  0.462365  1.003113  0.473225  1
  Ni  Ni75  1  0.850930  0.020467  0.463344  1
  Ni  Ni76  1  0.074289  0.485244  0.483119  1
  Ni  Ni77  1  0.462365  0.503113  0.473225  1
  Ni  Ni78  1  0.850930  0.520467  0.463344  1
  Ni  Ni79  1  0.285839  0.767864  0.464955  1
  Ni  Ni80  1  0.674208  0.785442  0.455081  1
  Ni  Ni81  1  0.897800  0.749865  0.474866  1
  Ni  Ni82  1  0.285839  0.267864  0.464955  1
  Ni  Ni83  1  0.674208  0.285442  0.455081  1
  Ni  Ni84  1  0.897800  0.249865  0.474866  1
  Ni  Ni85  1  0.909526  0.932198  0.512893  1
  Ni  Ni86  1  0.297629  0.950030  0.502978  1
  Ni  Ni87  1  0.685976  0.967643  0.493066  1
  Ni  Ni88  1  0.909526  0.432198  0.512893  1
  Ni  Ni89  1  0.297629  0.450030  0.502978  1
  Ni  Ni90  1  0.685976  0.467643  0.493066  1
  Ni  Ni91  1  0.121169  0.714659  0.494707  1
  Ni  Ni92  1  0.509272  0.732492  0.484792  1
  Ni  Ni93  1  0.732822  0.697046  0.504619  1
  Ni  Ni94  1  0.121169  0.214659  0.494707  1
  Ni  Ni95  1  0.509272  0.232492  0.484792  1
  Ni  Ni96  1  0.732822  0.197046  0.504619  1
  Ni  Ni97  1  0.744590  0.879248  0.542604  1
  Ni  Ni98  1  0.132959  0.896826  0.532730  1
  Ni  Ni99  1  0.520998  0.914825  0.522819  1
  Ni  Ni100  1  0.744590  0.379248  0.542604  1
  Ni  Ni101  1  0.132959  0.396826  0.532730  1
  Ni  Ni102  1  0.520998  0.414825  0.522819  1
  Ni  Ni103  1  0.956433  0.661577  0.524460  1
  Ni  Ni104  1  0.344509  0.679446  0.514566  1
  Ni  Ni105  1  0.567868  0.644223  0.534341  1
  Ni  Ni106  1  0.956433  0.161577  0.524460  1
  Ni  Ni107  1  0.344509  0.179446  0.514566  1
  Ni  Ni108  1  0.567868  0.144223  0.534341  1
  Ni  Ni109  1  0.579226  0.826894  0.572372  1
  Ni  Ni110  1  0.968209  0.843832  0.562473  1
  Ni  Ni111  1  0.356141  0.861809  0.552635  1
  Ni  Ni112  1  0.579226  0.326894  0.572372  1
  Ni  Ni113  1  0.968209  0.343832  0.562473  1
  Ni  Ni114  1  0.356141  0.361809  0.552635  1
  Ni  Ni115  1  0.791556  0.608557  0.554151  1
  Ni  Ni116  1  0.179930  0.626173  0.544326  1
  Ni  Ni117  1  0.402977  0.591507  0.564201  1
  Ni  Ni118  1  0.791556  0.108557  0.554151  1
  Ni  Ni119  1  0.179930  0.126173  0.544326  1
  Ni  Ni120  1  0.402977  0.091507  0.564201  1
  Ni  Ni121  1  0.413178  0.775835  0.602598  1
  Ni  Ni122  1  0.803061  0.790913  0.592094  1
  Ni  Ni123  1  0.191524  0.808544  0.582399  1
  Ni  Ni124  1  0.413178  0.275835  0.602598  1
  Ni  Ni125  1  0.803061  0.290913  0.592094  1
  Ni  Ni126  1  0.191524  0.308544  0.582399  1
  Ni  Ni127  1  0.626320  0.556227  0.583824  1
  Ni  Ni128  1  0.015350  0.573053  0.574037  1
  Ni  Ni129  1  0.238201  0.538844  0.594109  1
  Ni  Ni130  1  0.626320  0.056227  0.583824  1
  Ni  Ni131  1  0.015350  0.073053  0.574037  1
  Ni  Ni132  1  0.238201  0.038844  0.594109  1
  Ni  Ni133  1  0.250278  0.719822  0.632563  1
  Ni  Ni134  1  0.637310  0.738013  0.621712  1
  Ni  Ni135  1  0.026380  0.756092  0.612162  1
  Ni  Ni136  1  0.250278  0.219822  0.632563  1
  Ni  Ni137  1  0.637310  0.238013  0.621712  1
  Ni  Ni138  1  0.026380  0.256092  0.612162  1
  Ni  Ni139  1  0.461152  0.505266  0.613968  1
  Ni  Ni140  1  0.850381  0.520605  0.603884  1
  Ni  Ni141  1  0.075095  0.483097  0.623886  1
  Ni  Ni142  1  0.461152  1.005266  0.613968  1
  Ni  Ni143  1  0.850381  0.020605  0.603884  1
  Ni  Ni144  1  0.075095  0.983097  0.623886  1
  Ni  Ni145  1  0.085367  0.663029  0.660608  1
  Ni  Ni146  1  0.472016  0.686060  0.652333  1
  Ni  Ni147  1  0.862973  0.699903  0.641686  1
  Ni  Ni148  1  0.085367  0.163029  0.660608  1
  Ni  Ni149  1  0.472016  0.186060  0.652333  1
  Ni  Ni150  1  0.862973  0.199903  0.641686  1
  Ni  Ni151  1  0.295942  0.451140  0.644525  1
  Ni  Ni152  1  0.686230  0.464539  0.633386  1
  Ni  Ni153  1  0.910631  0.429033  0.653667  1
  Ni  Ni154  1  0.295942  0.951140  0.644525  1
  Ni  Ni155  1  0.686230  0.964539  0.633386  1
  Ni  Ni156  1  0.910631  0.929033  0.653667  1
  Ni  Ni157  1  0.924846  0.603137  0.689352  1
  Ni  Ni158  1  0.311990  0.626108  0.680856  1
  Ni  Ni159  1  0.699048  0.639607  0.669201  1
  Ni  Ni160  1  0.924846  0.103137  0.689352  1
  Ni  Ni161  1  0.311990  0.126108  0.680856  1
  Ni  Ni162  1  0.699048  0.139607  0.669201  1
  Ni  Ni163  1  0.136552  0.386565  0.672969  1
  Ni  Ni164  1  0.521606  0.412177  0.662507  1
  Ni  Ni165  1  0.749779  0.363139  0.681647  1
  Ni  Ni166  1  0.136552  0.886565  0.672969  1
  Ni  Ni167  1  0.521606  0.912177  0.662507  1
  Ni  Ni168  1  0.749779  0.863139  0.681647  1
  Ni  Ni169  1  0.763424  0.540884  0.713297  1
  Ni  Ni170  1  0.147571  0.566593  0.704903  1
  Ni  Ni171  1  0.540686  0.578299  0.697892  1
  Ni  Ni172  1  0.763424  0.040884  0.713297  1
  Ni  Ni173  1  0.147571  0.066593  0.704903  1
  Ni  Ni174  1  0.540686  0.078299  0.697892  1
  Ni  Ni175  1  0.972546  0.328716  0.699255  1
  Ni  Ni176  1  0.362190  0.354200  0.691171  1
  Ni  Ni177  1  0.589971  0.298857  0.706739  1
  Ni  Ni178  1  0.972546  0.828716  0.699255  1
  Ni  Ni179  1  0.362190  0.854200  0.691171  1
  Ni  Ni180  1  0.589971  0.798857  0.706739  1
