# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.77170976
_cell_length_b   9.54504034
_cell_length_c   46.05777781
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   65.45211701
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni180
_cell_volume   4307.47447486
_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  0.153341  0.303051  0.299973  1
  Ni  Ni2  1  0.538899  0.322304  0.290255  1
  Ni  Ni3  1  0.925709  0.341343  0.280840  1
  Ni  Ni4  1  0.153341  0.803051  0.299973  1
  Ni  Ni5  1  0.538899  0.822304  0.290255  1
  Ni  Ni6  1  0.925709  0.841343  0.280840  1
  Ni  Ni7  1  0.363846  0.089292  0.282865  1
  Ni  Ni8  1  0.750864  0.107964  0.273270  1
  Ni  Ni9  1  0.977304  0.068995  0.291956  1
  Ni  Ni10  1  0.363846  0.589292  0.282865  1
  Ni  Ni11  1  0.750864  0.607964  0.273270  1
  Ni  Ni12  1  0.977304  0.568995  0.291956  1
  Ni  Ni13  1  0.991409  0.244546  0.330971  1
  Ni  Ni14  1  0.378488  0.265028  0.320696  1
  Ni  Ni15  1  0.764949  0.284573  0.310845  1
  Ni  Ni16  1  0.991409  0.744546  0.330971  1
  Ni  Ni17  1  0.378488  0.765028  0.320696  1
  Ni  Ni18  1  0.764949  0.784573  0.310845  1
  Ni  Ni19  1  0.201687  0.028997  0.311873  1
  Ni  Ni20  1  0.589278  0.047813  0.302186  1
  Ni  Ni21  1  0.813992  0.010804  0.323044  1
  Ni  Ni22  1  0.201687  0.528997  0.311873  1
  Ni  Ni23  1  0.589278  0.547813  0.302186  1
  Ni  Ni24  1  0.813992  0.510804  0.323044  1
  Ni  Ni25  1  0.827276  0.188486  0.361213  1
  Ni  Ni26  1  0.214981  0.207097  0.350849  1
  Ni  Ni27  1  0.602968  0.225919  0.340993  1
  Ni  Ni28  1  0.827276  0.688486  0.361213  1
  Ni  Ni29  1  0.214981  0.707097  0.350849  1
  Ni  Ni30  1  0.602968  0.725919  0.340993  1
  Ni  Ni31  1  0.038128  0.972801  0.342652  1
  Ni  Ni32  1  0.425960  0.991517  0.332971  1
  Ni  Ni33  1  0.650064  0.954374  0.352927  1
  Ni  Ni34  1  0.038128  0.472801  0.342652  1
  Ni  Ni35  1  0.425960  0.491517  0.332971  1
  Ni  Ni36  1  0.650064  0.454374  0.352927  1
  Ni  Ni37  1  0.664010  0.131013  0.391557  1
  Ni  Ni38  1  0.051825  0.149877  0.381437  1
  Ni  Ni39  1  0.439051  0.169654  0.371251  1
  Ni  Ni40  1  0.664010  0.631013  0.391557  1
  Ni  Ni41  1  0.051825  0.649877  0.381437  1
  Ni  Ni42  1  0.439051  0.669654  0.371251  1
  Ni  Ni43  1  0.875417  0.915757  0.373104  1
  Ni  Ni44  1  0.262328  0.935371  0.362822  1
  Ni  Ni45  1  0.487548  0.896780  0.383182  1
  Ni  Ni46  1  0.875417  0.415757  0.373104  1
  Ni  Ni47  1  0.262328  0.435371  0.362822  1
  Ni  Ni48  1  0.487548  0.396780  0.383182  1
  Ni  Ni49  1  0.500778  0.073895  0.421858  1
  Ni  Ni50  1  0.888660  0.092778  0.411788  1
  Ni  Ni51  1  0.276250  0.111948  0.401580  1
  Ni  Ni52  1  0.500778  0.573895  0.421858  1
  Ni  Ni53  1  0.888660  0.592778  0.411788  1
  Ni  Ni54  1  0.276250  0.611948  0.401580  1
  Ni  Ni55  1  0.712306  0.858698  0.403374  1
  Ni  Ni56  1  0.100119  0.877592  0.393160  1
  Ni  Ni57  1  0.324519  0.839778  0.413412  1
  Ni  Ni58  1  0.712306  0.358698  0.403374  1
  Ni  Ni59  1  0.100119  0.377592  0.393160  1
  Ni  Ni60  1  0.324519  0.339778  0.413412  1
  Ni  Ni61  1  0.337736  0.016604  0.452207  1
  Ni  Ni62  1  0.725461  0.035636  0.442120  1
  Ni  Ni63  1  0.113224  0.054602  0.431994  1
  Ni  Ni64  1  0.337736  0.516604  0.452207  1
  Ni  Ni65  1  0.725461  0.535636  0.442120  1
  Ni  Ni66  1  0.113224  0.554602  0.431994  1
  Ni  Ni67  1  0.549202  0.801591  0.433679  1
  Ni  Ni68  1  0.937026  0.820550  0.423568  1
  Ni  Ni69  1  0.161580  0.782459  0.443748  1
  Ni  Ni70  1  0.549202  0.301591  0.433679  1
  Ni  Ni71  1  0.937026  0.320550  0.423568  1
  Ni  Ni72  1  0.161580  0.282459  0.443748  1
  Ni  Ni73  1  0.174678  0.959333  0.482571  1
  Ni  Ni74  1  0.562305  0.978499  0.472450  1
  Ni  Ni75  1  0.950096  0.997459  0.462353  1
  Ni  Ni76  1  0.174678  0.459333  0.482571  1
  Ni  Ni77  1  0.562305  0.478499  0.472450  1
  Ni  Ni78  1  0.950096  0.497459  0.462353  1
  Ni  Ni79  1  0.386107  0.744429  0.463986  1
  Ni  Ni80  1  0.773860  0.763423  0.453898  1
  Ni  Ni81  1  0.998488  0.725276  0.474112  1
  Ni  Ni82  1  0.386107  0.244429  0.463986  1
  Ni  Ni83  1  0.773860  0.263423  0.453898  1
  Ni  Ni84  1  0.998488  0.225276  0.474112  1
  Ni  Ni85  1  0.011556  0.902162  0.512910  1
  Ni  Ni86  1  0.399216  0.921274  0.502800  1
  Ni  Ni87  1  0.786933  0.940321  0.492683  1
  Ni  Ni88  1  0.011556  0.402162  0.512910  1
  Ni  Ni89  1  0.399216  0.421274  0.502800  1
  Ni  Ni90  1  0.786933  0.440321  0.492683  1
  Ni  Ni91  1  0.223047  0.687184  0.494333  1
  Ni  Ni92  1  0.610707  0.706297  0.484223  1
  Ni  Ni93  1  0.835330  0.668138  0.504450  1
  Ni  Ni94  1  0.223047  0.187184  0.494333  1
  Ni  Ni95  1  0.610707  0.206297  0.484223  1
  Ni  Ni96  1  0.835330  0.168138  0.504450  1
  Ni  Ni97  1  0.848403  0.845036  0.543234  1
  Ni  Ni98  1  0.236156  0.864030  0.533147  1
  Ni  Ni99  1  0.623775  0.883183  0.523021  1
  Ni  Ni100  1  0.848403  0.345036  0.543234  1
  Ni  Ni101  1  0.236156  0.364030  0.533147  1
  Ni  Ni102  1  0.623775  0.383183  0.523021  1
  Ni  Ni103  1  0.059958  0.629960  0.524683  1
  Ni  Ni104  1  0.447585  0.649126  0.514561  1
  Ni  Ni105  1  0.672167  0.611000  0.534780  1
  Ni  Ni106  1  0.059958  0.129960  0.524683  1
  Ni  Ni107  1  0.447585  0.149126  0.514561  1
  Ni  Ni108  1  0.672167  0.111000  0.534780  1
  Ni  Ni109  1  0.685237  0.787909  0.573564  1
  Ni  Ni110  1  0.073061  0.806867  0.563454  1
  Ni  Ni111  1  0.460683  0.826000  0.553385  1
  Ni  Ni112  1  0.685237  0.287909  0.573564  1
  Ni  Ni113  1  0.073061  0.306867  0.563454  1
  Ni  Ni114  1  0.460683  0.326000  0.553385  1
  Ni  Ni115  1  0.896802  0.572823  0.555012  1
  Ni  Ni116  1  0.284527  0.591854  0.544925  1
  Ni  Ni117  1  0.509039  0.553857  0.565138  1
  Ni  Ni118  1  0.896802  0.072823  0.555012  1
  Ni  Ni119  1  0.284527  0.091854  0.544925  1
  Ni  Ni120  1  0.509039  0.053857  0.565138  1
  Ni  Ni121  1  0.522144  0.730867  0.603973  1
  Ni  Ni122  1  0.909957  0.749761  0.593759  1
  Ni  Ni123  1  0.297744  0.768681  0.583721  1
  Ni  Ni124  1  0.522144  0.230867  0.603973  1
  Ni  Ni125  1  0.909957  0.249761  0.593759  1
  Ni  Ni126  1  0.297744  0.268681  0.583721  1
  Ni  Ni127  1  0.733603  0.515681  0.585344  1
  Ni  Ni128  1  0.121485  0.534564  0.575275  1
  Ni  Ni129  1  0.346013  0.496511  0.595553  1
  Ni  Ni130  1  0.733603  0.015681  0.585344  1
  Ni  Ni131  1  0.121485  0.034564  0.575275  1
  Ni  Ni132  1  0.346013  0.996511  0.595553  1
  Ni  Ni133  1  0.359935  0.673088  0.634311  1
  Ni  Ni134  1  0.746846  0.692702  0.624028  1
  Ni  Ni135  1  0.134715  0.711679  0.613951  1
  Ni  Ni136  1  0.359935  0.173088  0.634311  1
  Ni  Ni137  1  0.746846  0.192702  0.624028  1
  Ni  Ni138  1  0.134715  0.211679  0.613951  1
  Ni  Ni139  1  0.570438  0.458582  0.615696  1
  Ni  Ni140  1  0.958253  0.477446  0.605576  1
  Ni  Ni141  1  0.183212  0.438805  0.625881  1
  Ni  Ni142  1  0.570438  0.958582  0.615696  1
  Ni  Ni143  1  0.958253  0.977446  0.605576  1
  Ni  Ni144  1  0.183212  0.938805  0.625881  1
  Ni  Ni145  1  0.196303  0.616942  0.664162  1
  Ni  Ni146  1  0.584135  0.635658  0.654481  1
  Ni  Ni147  1  0.972199  0.654085  0.644205  1
  Ni  Ni148  1  0.196303  0.116942  0.664162  1
  Ni  Ni149  1  0.584135  0.135658  0.654481  1
  Ni  Ni150  1  0.972199  0.154085  0.644205  1
  Ni  Ni151  1  0.407282  0.401362  0.646284  1
  Ni  Ni152  1  0.794987  0.419973  0.635920  1
  Ni  Ni153  1  0.019295  0.382540  0.656139  1
  Ni  Ni154  1  0.407282  0.901362  0.646284  1
  Ni  Ni155  1  0.794987  0.919973  0.635920  1
  Ni  Ni156  1  0.019295  0.882540  0.656139  1
  Ni  Ni157  1  0.032985  0.560646  0.694947  1
  Ni  Ni158  1  0.420576  0.579462  0.685259  1
  Ni  Ni159  1  0.808271  0.597655  0.674089  1
  Ni  Ni160  1  0.032985  0.060646  0.694947  1
  Ni  Ni161  1  0.420576  0.079462  0.685259  1
  Ni  Ni162  1  0.808271  0.097655  0.674089  1
  Ni  Ni163  1  0.243775  0.343431  0.676437  1
  Ni  Ni164  1  0.630854  0.363913  0.666161  1
  Ni  Ni165  1  0.857314  0.323885  0.686288  1
  Ni  Ni166  1  0.243775  0.843431  0.676437  1
  Ni  Ni167  1  0.630854  0.863913  0.666161  1
  Ni  Ni168  1  0.857314  0.823885  0.686288  1
  Ni  Ni169  1  0.871399  0.500495  0.723863  1
  Ni  Ni170  1  0.258417  0.519167  0.714268  1
  Ni  Ni171  1  0.644958  0.539464  0.705176  1
  Ni  Ni172  1  0.871399  1.000495  0.723863  1
  Ni  Ni173  1  0.258417  0.019167  0.714268  1
  Ni  Ni174  1  0.644958  0.039464  0.705176  1
  Ni  Ni175  1  0.083364  0.286155  0.706878  1
  Ni  Ni176  1  0.468922  0.305408  0.697160  1
  Ni  Ni177  1  0.696554  0.267116  0.716293  1
  Ni  Ni178  1  0.083364  0.786155  0.706878  1
  Ni  Ni179  1  0.468922  0.805408  0.697160  1
  Ni  Ni180  1  0.696554  0.767116  0.716293  1
