# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53222842
_cell_length_b   12.50306572
_cell_length_c   47.98389723
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.13976767
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni162
_cell_volume   3916.25050806
_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  0.550314  0.178808  0.316435  1
  Ni  Ni2  1  0.531871  0.856551  0.298741  1
  Ni  Ni3  1  0.504003  0.537845  0.283463  1
  Ni  Ni4  1  0.883647  0.845475  0.316435  1
  Ni  Ni5  1  0.865204  0.523217  0.298741  1
  Ni  Ni6  1  0.216980  0.512142  0.316435  1
  Ni  Ni7  1  0.837336  0.204511  0.283463  1
  Ni  Ni8  1  0.198538  0.189884  0.298741  1
  Ni  Ni9  1  0.170670  0.871178  0.283463  1
  Ni  Ni10  1  0.634519  0.359322  0.296435  1
  Ni  Ni11  1  0.607232  0.040724  0.280956  1
  Ni  Ni12  1  0.657970  0.680093  0.313688  1
  Ni  Ni13  1  0.967852  0.025989  0.296435  1
  Ni  Ni14  1  0.940565  0.707391  0.280956  1
  Ni  Ni15  1  0.301186  0.692656  0.296435  1
  Ni  Ni16  1  0.991303  0.346760  0.313688  1
  Ni  Ni17  1  0.273899  0.374057  0.280956  1
  Ni  Ni18  1  0.324636  0.013427  0.313688  1
  Ni  Ni19  1  0.620076  0.140952  0.366168  1
  Ni  Ni20  1  0.596319  0.820354  0.349542  1
  Ni  Ni21  1  0.575198  0.498688  0.332992  1
  Ni  Ni22  1  0.953409  0.807618  0.366168  1
  Ni  Ni23  1  0.929653  0.487021  0.349542  1
  Ni  Ni24  1  0.286743  0.474285  0.366168  1
  Ni  Ni25  1  0.908531  0.165355  0.332992  1
  Ni  Ni26  1  0.262986  0.153688  0.349542  1
  Ni  Ni27  1  0.241864  0.832022  0.332992  1
  Ni  Ni28  1  0.704069  0.321983  0.346820  1
  Ni  Ni29  1  0.681859  1.000987  0.330309  1
  Ni  Ni30  1  0.726436  0.643128  0.363498  1
  Ni  Ni31  1  0.037403  0.988649  0.346820  1
  Ni  Ni32  1  0.015192  0.667653  0.330309  1
  Ni  Ni33  1  0.370736  0.655316  0.346820  1
  Ni  Ni34  1  0.059769  0.309795  0.363498  1
  Ni  Ni35  1  0.348525  0.334320  0.330309  1
  Ni  Ni36  1  0.393103  0.976462  0.363498  1
  Ni  Ni37  1  0.689099  0.103485  0.416206  1
  Ni  Ni38  1  0.666198  0.782638  0.399536  1
  Ni  Ni39  1  0.643145  0.461720  0.382896  1
  Ni  Ni40  1  0.022432  0.770152  0.416206  1
  Ni  Ni41  1  0.999531  0.449305  0.399536  1
  Ni  Ni42  1  0.355766  0.436818  0.416206  1
  Ni  Ni43  1  0.976478  0.128387  0.382896  1
  Ni  Ni44  1  0.332864  0.115972  0.399536  1
  Ni  Ni45  1  0.309811  0.795053  0.382896  1
  Ni  Ni46  1  0.772221  0.284597  0.396859  1
  Ni  Ni47  1  0.749417  0.963775  0.380195  1
  Ni  Ni48  1  0.795096  0.605482  0.413528  1
  Ni  Ni49  1  0.105554  0.951264  0.396859  1
  Ni  Ni50  1  0.082750  0.630442  0.380195  1
  Ni  Ni51  1  0.438888  0.617930  0.396859  1
  Ni  Ni52  1  0.128430  0.272148  0.413528  1
  Ni  Ni53  1  0.416083  0.297109  0.380195  1
  Ni  Ni54  1  0.461763  0.938815  0.413528  1
  Ni  Ni55  1  0.757995  0.066056  0.466234  1
  Ni  Ni56  1  0.735059  0.745192  0.449558  1
  Ni  Ni57  1  0.712113  0.424331  0.432889  1
  Ni  Ni58  1  0.091328  0.732723  0.466234  1
  Ni  Ni59  1  0.068392  0.411859  0.449558  1
  Ni  Ni60  1  0.424662  0.399390  0.466234  1
  Ni  Ni61  1  0.045447  0.090998  0.432889  1
  Ni  Ni62  1  0.401725  0.078526  0.449558  1
  Ni  Ni63  1  0.378780  0.757664  0.432889  1
  Ni  Ni64  1  0.840949  0.247185  0.446886  1
  Ni  Ni65  1  0.818010  0.926346  0.430215  1
  Ni  Ni66  1  0.863874  0.568050  0.463562  1
  Ni  Ni67  1  0.174282  0.913852  0.446886  1
  Ni  Ni68  1  0.151343  0.593013  0.430215  1
  Ni  Ni69  1  0.507615  0.580519  0.446886  1
  Ni  Ni70  1  0.197207  0.234716  0.463562  1
  Ni  Ni71  1  0.484676  0.259680  0.430215  1
  Ni  Ni72  1  0.530541  0.901383  0.463562  1
  Ni  Ni73  1  0.826823  0.028625  0.516259  1
  Ni  Ni74  1  0.803882  0.707769  0.499584  1
  Ni  Ni75  1  0.780946  0.386909  0.482909  1
  Ni  Ni76  1  0.160157  0.695292  0.516259  1
  Ni  Ni77  1  0.137216  0.374436  0.499584  1
  Ni  Ni78  1  0.493490  0.361958  0.516259  1
  Ni  Ni79  1  0.114279  0.053575  0.482909  1
  Ni  Ni80  1  0.470549  0.041102  0.499584  1
  Ni  Ni81  1  0.447612  0.720242  0.482909  1
  Ni  Ni82  1  0.909753  0.209763  0.496914  1
  Ni  Ni83  1  0.886812  0.888907  0.480239  1
  Ni  Ni84  1  0.932690  0.530623  0.513589  1
  Ni  Ni85  1  0.243087  0.876430  0.496914  1
  Ni  Ni86  1  0.220146  0.555574  0.480239  1
  Ni  Ni87  1  0.576420  0.543097  0.496914  1
  Ni  Ni88  1  0.266023  0.197290  0.513589  1
  Ni  Ni89  1  0.553479  0.222241  0.480239  1
  Ni  Ni90  1  0.599357  0.863957  0.513589  1
  Ni  Ni91  1  0.895626  0.991186  0.566284  1
  Ni  Ni92  1  0.872687  0.670347  0.549612  1
  Ni  Ni93  1  0.849762  0.349483  0.532936  1
  Ni  Ni94  1  0.228959  0.657853  0.566284  1
  Ni  Ni95  1  0.206020  0.337013  0.549612  1
  Ni  Ni96  1  0.562293  0.324519  0.566284  1
  Ni  Ni97  1  0.183095  0.016149  0.532936  1
  Ni  Ni98  1  0.539354  0.003680  0.549612  1
  Ni  Ni99  1  0.516428  0.682816  0.532936  1
  Ni  Ni100  1  0.978577  0.172340  0.546940  1
  Ni  Ni101  1  0.955641  0.851476  0.530265  1
  Ni  Ni102  1  1.001522  0.493201  0.563610  1
  Ni  Ni103  1  0.311910  0.839007  0.546940  1
  Ni  Ni104  1  0.288974  0.518143  0.530265  1
  Ni  Ni105  1  0.645244  0.505673  0.546940  1
  Ni  Ni106  1  0.334856  0.159868  0.563610  1
  Ni  Ni107  1  0.622307  0.184809  0.530265  1
  Ni  Ni108  1  0.668189  0.826535  0.563610  1
  Ni  Ni109  1  0.964219  0.953757  0.616304  1
  Ni  Ni110  1  0.941415  0.632935  0.599639  1
  Ni  Ni111  1  0.918540  0.312051  0.582970  1
  Ni  Ni112  1  0.297552  0.620424  0.616304  1
  Ni  Ni113  1  0.274748  0.299602  0.599639  1
  Ni  Ni114  1  0.630886  0.287090  0.616304  1
  Ni  Ni115  1  0.251873  0.978717  0.582970  1
  Ni  Ni116  1  0.608081  0.966268  0.599639  1
  Ni  Ni117  1  0.585206  0.645384  0.582970  1
  Ni  Ni118  1  0.047438  0.134894  0.596962  1
  Ni  Ni119  1  0.024537  0.814047  0.580292  1
  Ni  Ni120  1  0.070491  0.455812  0.613603  1
  Ni  Ni121  1  0.380771  0.801561  0.596962  1
  Ni  Ni122  1  0.357870  0.480714  0.580292  1
  Ni  Ni123  1  0.714105  0.468227  0.596962  1
  Ni  Ni124  1  0.403825  0.122479  0.613603  1
  Ni  Ni125  1  0.691203  0.147381  0.580292  1
  Ni  Ni126  1  0.737158  0.789145  0.613603  1
  Ni  Ni127  1  0.031777  0.916546  0.666189  1
  Ni  Ni128  1  0.009566  0.595550  0.649678  1
  Ni  Ni129  1  0.987200  0.274404  0.633000  1
  Ni  Ni130  1  0.365110  0.583212  0.666189  1
  Ni  Ni131  1  0.342900  0.262216  0.649678  1
  Ni  Ni132  1  0.698444  0.249879  0.666189  1
  Ni  Ni133  1  0.320533  0.941070  0.633000  1
  Ni  Ni134  1  0.676233  0.928883  0.649678  1
  Ni  Ni135  1  0.653867  0.607737  0.633000  1
  Ni  Ni136  1  0.117316  0.097178  0.646956  1
  Ni  Ni137  1  0.093560  0.776580  0.630330  1
  Ni  Ni138  1  0.138438  0.418844  0.663506  1
  Ni  Ni139  1  0.450650  0.763844  0.646956  1
  Ni  Ni140  1  0.426893  0.443247  0.630330  1
  Ni  Ni141  1  0.783983  0.430511  0.646956  1
  Ni  Ni142  1  0.471772  0.085511  0.663506  1
  Ni  Ni143  1  0.760226  0.109914  0.630330  1
  Ni  Ni144  1  0.805105  0.752177  0.663506  1
  Ni  Ni145  1  0.106404  0.876808  0.715542  1
  Ni  Ni146  1  0.079117  0.558210  0.700063  1
  Ni  Ni147  1  0.055666  0.237439  0.682810  1
  Ni  Ni148  1  0.439737  0.543475  0.715542  1
  Ni  Ni149  1  0.412450  0.224877  0.700063  1
  Ni  Ni150  1  0.773070  0.210142  0.715542  1
  Ni  Ni151  1  0.388999  0.904106  0.682810  1
  Ni  Ni152  1  0.745783  0.891543  0.700063  1
  Ni  Ni153  1  0.722333  0.570772  0.682810  1
  Ni  Ni154  1  0.181765  0.060982  0.697757  1
  Ni  Ni155  1  0.163322  0.738724  0.680063  1
  Ni  Ni156  1  0.209633  0.379688  0.713035  1
  Ni  Ni157  1  0.515098  0.727648  0.697757  1
  Ni  Ni158  1  0.496655  0.405391  0.680063  1
  Ni  Ni159  1  0.848432  0.394315  0.697757  1
  Ni  Ni160  1  0.542966  0.046354  0.713035  1
  Ni  Ni161  1  0.829989  0.072057  0.680063  1
  Ni  Ni162  1  0.876299  0.713021  0.713035  1
