# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.85306680
_cell_length_b   10.91731077
_cell_length_c   46.23591145
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   126.05828480
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni216
_cell_volume   5244.91171314
_cell_formula_units_Z   216
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  0.975034  0.896176  0.301148  1
  Ni  Ni2  1  0.641701  0.896176  0.301148  1
  Ni  Ni3  1  0.576390  0.425851  0.289674  1
  Ni  Ni4  1  0.308367  0.896176  0.301148  1
  Ni  Ni5  1  0.243056  0.425851  0.289674  1
  Ni  Ni6  1  0.909723  0.425851  0.289674  1
  Ni  Ni7  1  0.386324  0.160872  0.295562  1
  Ni  Ni8  1  0.052990  0.160872  0.295562  1
  Ni  Ni9  1  0.989582  0.693299  0.283739  1
  Ni  Ni10  1  0.719657  0.160872  0.295562  1
  Ni  Ni11  1  0.656249  0.693299  0.283739  1
  Ni  Ni12  1  0.322916  0.693299  0.283739  1
  Ni  Ni13  1  0.783072  0.841158  0.325714  1
  Ni  Ni14  1  0.449739  0.841158  0.325714  1
  Ni  Ni15  1  0.380390  0.368298  0.313407  1
  Ni  Ni16  1  0.116406  0.841158  0.325714  1
  Ni  Ni17  1  0.047057  0.368298  0.313407  1
  Ni  Ni18  1  0.713723  0.368298  0.313407  1
  Ni  Ni19  1  0.191909  0.103927  0.319199  1
  Ni  Ni20  1  0.858575  0.103927  0.319199  1
  Ni  Ni21  1  0.791694  0.631333  0.307404  1
  Ni  Ni22  1  0.525242  0.103927  0.319199  1
  Ni  Ni23  1  0.458361  0.631333  0.307404  1
  Ni  Ni24  1  0.125028  0.631333  0.307404  1
  Ni  Ni25  1  0.586745  0.780731  0.349742  1
  Ni  Ni26  1  0.253412  0.780731  0.349742  1
  Ni  Ni27  1  0.184482  0.310051  0.338037  1
  Ni  Ni28  1  0.920079  0.780731  0.349742  1
  Ni  Ni29  1  0.851149  0.310051  0.338037  1
  Ni  Ni30  1  0.517815  0.310051  0.338037  1
  Ni  Ni31  1  0.996849  0.045514  0.344026  1
  Ni  Ni32  1  0.663515  0.045514  0.344026  1
  Ni  Ni33  1  0.595876  0.575200  0.331979  1
  Ni  Ni34  1  0.330182  0.045514  0.344026  1
  Ni  Ni35  1  0.262542  0.575200  0.331979  1
  Ni  Ni36  1  0.929209  0.575200  0.331979  1
  Ni  Ni37  1  0.390852  0.722229  0.374227  1
  Ni  Ni38  1  0.057519  0.722229  0.374227  1
  Ni  Ni39  1  0.988380  0.250966  0.361921  1
  Ni  Ni40  1  0.724185  0.722229  0.374227  1
  Ni  Ni41  1  0.655046  0.250966  0.361921  1
  Ni  Ni42  1  0.321713  0.250966  0.361921  1
  Ni  Ni43  1  0.800630  0.986913  0.368105  1
  Ni  Ni44  1  0.467297  0.986913  0.368105  1
  Ni  Ni45  1  0.398982  0.515856  0.355909  1
  Ni  Ni46  1  0.133964  0.986913  0.368105  1
  Ni  Ni47  1  0.065649  0.515856  0.355909  1
  Ni  Ni48  1  0.732315  0.515856  0.355909  1
  Ni  Ni49  1  0.194287  0.662805  0.398629  1
  Ni  Ni50  1  0.860954  0.662805  0.398629  1
  Ni  Ni51  1  0.792321  0.192304  0.386521  1
  Ni  Ni52  1  0.527620  0.662805  0.398629  1
  Ni  Ni53  1  0.458987  0.192304  0.386521  1
  Ni  Ni54  1  0.125654  0.192304  0.386521  1
  Ni  Ni55  1  0.604586  0.927419  0.392530  1
  Ni  Ni56  1  0.271253  0.927419  0.392530  1
  Ni  Ni57  1  0.202792  0.457071  0.380421  1
  Ni  Ni58  1  0.937919  0.927419  0.392530  1
  Ni  Ni59  1  0.869458  0.457071  0.380421  1
  Ni  Ni60  1  0.536125  0.457071  0.380421  1
  Ni  Ni61  1  0.998109  0.603857  0.423104  1
  Ni  Ni62  1  0.664775  0.603857  0.423104  1
  Ni  Ni63  1  0.596101  0.133241  0.410865  1
  Ni  Ni64  1  0.331442  0.603857  0.423104  1
  Ni  Ni65  1  0.262767  0.133241  0.410865  1
  Ni  Ni66  1  0.929434  0.133241  0.410865  1
  Ni  Ni67  1  0.408622  0.868577  0.416987  1
  Ni  Ni68  1  0.075288  0.868577  0.416987  1
  Ni  Ni69  1  0.006699  0.397930  0.404753  1
  Ni  Ni70  1  0.741955  0.868577  0.416987  1
  Ni  Ni71  1  0.673365  0.397930  0.404753  1
  Ni  Ni72  1  0.340032  0.397930  0.404753  1
  Ni  Ni73  1  0.801868  0.544805  0.447532  1
  Ni  Ni74  1  0.468534  0.544805  0.447532  1
  Ni  Ni75  1  0.399882  0.074241  0.435328  1
  Ni  Ni76  1  0.135201  0.544805  0.447532  1
  Ni  Ni77  1  0.066549  0.074241  0.435328  1
  Ni  Ni78  1  0.733216  0.074241  0.435328  1
  Ni  Ni79  1  0.212503  0.809537  0.441422  1
  Ni  Ni80  1  0.879170  0.809537  0.441422  1
  Ni  Ni81  1  0.810599  0.339050  0.429244  1
  Ni  Ni82  1  0.545836  0.809537  0.441422  1
  Ni  Ni83  1  0.477266  0.339050  0.429244  1
  Ni  Ni84  1  0.143932  0.339050  0.429244  1
  Ni  Ni85  1  0.605720  0.485843  0.471991  1
  Ni  Ni86  1  0.272386  0.485843  0.471991  1
  Ni  Ni87  1  0.203754  0.015299  0.459766  1
  Ni  Ni88  1  0.939053  0.485843  0.471991  1
  Ni  Ni89  1  0.870420  0.015299  0.459766  1
  Ni  Ni90  1  0.537087  0.015299  0.459766  1
  Ni  Ni91  1  0.016367  0.750575  0.465875  1
  Ni  Ni92  1  0.683034  0.750575  0.465875  1
  Ni  Ni93  1  0.614424  0.280028  0.453652  1
  Ni  Ni94  1  0.349701  0.750575  0.465875  1
  Ni  Ni95  1  0.281091  0.280028  0.453652  1
  Ni  Ni96  1  0.947757  0.280028  0.453652  1
  Ni  Ni97  1  0.409548  0.426843  0.496427  1
  Ni  Ni98  1  0.076215  0.426843  0.496427  1
  Ni  Ni99  1  0.007595  0.956308  0.484209  1
  Ni  Ni100  1  0.742881  0.426843  0.496427  1
  Ni  Ni101  1  0.674262  0.956308  0.484209  1
  Ni  Ni102  1  0.340929  0.956308  0.484209  1
  Ni  Ni103  1  0.820218  0.691585  0.490316  1
  Ni  Ni104  1  0.486885  0.691585  0.490316  1
  Ni  Ni105  1  0.418277  0.221058  0.478104  1
  Ni  Ni106  1  0.153551  0.691585  0.490316  1
  Ni  Ni107  1  0.084944  0.221058  0.478104  1
  Ni  Ni108  1  0.751611  0.221058  0.478104  1
  Ni  Ni109  1  0.213392  0.367872  0.520869  1
  Ni  Ni110  1  0.880059  0.367872  0.520869  1
  Ni  Ni111  1  0.811451  0.897345  0.508657  1
  Ni  Ni112  1  0.546725  0.367872  0.520869  1
  Ni  Ni113  1  0.478118  0.897345  0.508657  1
  Ni  Ni114  1  0.144785  0.897345  0.508657  1
  Ni  Ni115  1  0.624074  0.632622  0.514764  1
  Ni  Ni116  1  0.290741  0.632622  0.514764  1
  Ni  Ni117  1  0.222121  0.162087  0.502546  1
  Ni  Ni118  1  0.957407  0.632622  0.514764  1
  Ni  Ni119  1  0.888788  0.162087  0.502546  1
  Ni  Ni120  1  0.555455  0.162087  0.502546  1
  Ni  Ni121  1  0.017245  0.308903  0.545321  1
  Ni  Ni122  1  0.683912  0.308903  0.545321  1
  Ni  Ni123  1  0.615302  0.838355  0.533098  1
  Ni  Ni124  1  0.350579  0.308903  0.545321  1
  Ni  Ni125  1  0.281968  0.838355  0.533098  1
  Ni  Ni126  1  0.948635  0.838355  0.533098  1
  Ni  Ni127  1  0.427916  0.573632  0.539207  1
  Ni  Ni128  1  0.094582  0.573632  0.539207  1
  Ni  Ni129  1  0.025949  0.103088  0.526983  1
  Ni  Ni130  1  0.761249  0.573632  0.539207  1
  Ni  Ni131  1  0.692616  0.103088  0.526983  1
  Ni  Ni132  1  0.359283  0.103088  0.526983  1
  Ni  Ni133  1  0.821070  0.249881  0.569729  1
  Ni  Ni134  1  0.487737  0.249881  0.569729  1
  Ni  Ni135  1  0.419166  0.779393  0.557551  1
  Ni  Ni136  1  0.154404  0.249881  0.569729  1
  Ni  Ni137  1  0.085833  0.779393  0.557551  1
  Ni  Ni138  1  0.752499  0.779393  0.557551  1
  Ni  Ni139  1  0.231787  0.514689  0.563645  1
  Ni  Ni140  1  0.898454  0.514689  0.563645  1
  Ni  Ni141  1  0.829802  0.044125  0.551441  1
  Ni  Ni142  1  0.565120  0.514689  0.563645  1
  Ni  Ni143  1  0.496468  0.044125  0.551441  1
  Ni  Ni144  1  0.163135  0.044125  0.551441  1
  Ni  Ni145  1  0.624971  0.191001  0.594220  1
  Ni  Ni146  1  0.291637  0.191001  0.594220  1
  Ni  Ni147  1  0.223047  0.720354  0.581986  1
  Ni  Ni148  1  0.958304  0.191001  0.594220  1
  Ni  Ni149  1  0.889714  0.720354  0.581986  1
  Ni  Ni150  1  0.556381  0.720354  0.581986  1
  Ni  Ni151  1  0.035568  0.455689  0.588108  1
  Ni  Ni152  1  0.702235  0.455689  0.588108  1
  Ni  Ni153  1  0.633561  0.985073  0.575869  1
  Ni  Ni154  1  0.368902  0.455689  0.588108  1
  Ni  Ni155  1  0.300227  0.985073  0.575869  1
  Ni  Ni156  1  0.966894  0.985073  0.575869  1
  Ni  Ni157  1  0.428878  0.131860  0.618553  1
  Ni  Ni158  1  0.095544  0.131860  0.618553  1
  Ni  Ni159  1  0.027083  0.661511  0.606443  1
  Ni  Ni160  1  0.762211  0.131860  0.618553  1
  Ni  Ni161  1  0.693750  0.661511  0.606443  1
  Ni  Ni162  1  0.360416  0.661511  0.606443  1
  Ni  Ni163  1  0.839349  0.396626  0.612453  1
  Ni  Ni164  1  0.506015  0.396626  0.612453  1
  Ni  Ni165  1  0.437382  0.926126  0.600345  1
  Ni  Ni166  1  0.172682  0.396626  0.612453  1
  Ni  Ni167  1  0.104049  0.926126  0.600345  1
  Ni  Ni168  1  0.770716  0.926126  0.600345  1
  Ni  Ni169  1  0.232687  0.073075  0.643064  1
  Ni  Ni170  1  0.899354  0.073075  0.643064  1
  Ni  Ni171  1  0.831039  0.602018  0.630869  1
  Ni  Ni172  1  0.566021  0.073075  0.643064  1
  Ni  Ni173  1  0.497706  0.602018  0.630869  1
  Ni  Ni174  1  0.164372  0.602018  0.630869  1
  Ni  Ni175  1  0.643289  0.337965  0.637053  1
  Ni  Ni176  1  0.309956  0.337965  0.637053  1
  Ni  Ni177  1  0.240817  0.866701  0.624747  1
  Ni  Ni178  1  0.976623  0.337965  0.637053  1
  Ni  Ni179  1  0.907484  0.866701  0.624747  1
  Ni  Ni180  1  0.574151  0.866701  0.624747  1
  Ni  Ni181  1  0.035794  0.013731  0.666995  1
  Ni  Ni182  1  0.702460  0.013731  0.666995  1
  Ni  Ni183  1  0.634821  0.543417  0.654947  1
  Ni  Ni184  1  0.369127  0.013731  0.666995  1
  Ni  Ni185  1  0.301487  0.543417  0.654947  1
  Ni  Ni186  1  0.968154  0.543417  0.654947  1
  Ni  Ni187  1  0.447187  0.278880  0.660936  1
  Ni  Ni188  1  0.113854  0.278880  0.660936  1
  Ni  Ni189  1  0.044924  0.808200  0.649232  1
  Ni  Ni190  1  0.780520  0.278880  0.660936  1
  Ni  Ni191  1  0.711591  0.808200  0.649232  1
  Ni  Ni192  1  0.378257  0.808200  0.649232  1
  Ni  Ni193  1  0.839975  0.957597  0.691569  1
  Ni  Ni194  1  0.506642  0.957597  0.691569  1
  Ni  Ni195  1  0.439760  0.485003  0.679774  1
  Ni  Ni196  1  0.173308  0.957597  0.691569  1
  Ni  Ni197  1  0.106427  0.485003  0.679774  1
  Ni  Ni198  1  0.773094  0.485003  0.679774  1
  Ni  Ni199  1  0.251279  0.220633  0.685566  1
  Ni  Ni200  1  0.917946  0.220633  0.685566  1
  Ni  Ni201  1  0.848597  0.747772  0.673259  1
  Ni  Ni202  1  0.584612  0.220633  0.685566  1
  Ni  Ni203  1  0.515264  0.747772  0.673259  1
  Ni  Ni204  1  0.181930  0.747772  0.673259  1
  Ni  Ni205  1  0.642087  0.895631  0.715234  1
  Ni  Ni206  1  0.308754  0.895631  0.715234  1
  Ni  Ni207  1  0.245346  0.428059  0.703411  1
  Ni  Ni208  1  0.975420  0.895631  0.715234  1
  Ni  Ni209  1  0.912012  0.428059  0.703411  1
  Ni  Ni210  1  0.578679  0.428059  0.703411  1
  Ni  Ni211  1  0.055280  0.163080  0.709299  1
  Ni  Ni212  1  0.721946  0.163080  0.709299  1
  Ni  Ni213  1  0.656635  0.692754  0.697826  1
  Ni  Ni214  1  0.388613  0.163080  0.709299  1
  Ni  Ni215  1  0.323302  0.692754  0.697826  1
  Ni  Ni216  1  0.989968  0.692754  0.697826  1
