# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.77083275
_cell_length_b   9.41603663
_cell_length_c   45.91724429
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   65.04016046
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni180
_cell_volume   4221.92747222
_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  0.241197  0.058355  0.286308  1
  Ni  Ni2  1  0.625217  0.085706  0.276903  1
  Ni  Ni3  1  0.853750  0.040909  0.296080  1
  Ni  Ni4  1  0.241197  0.558355  0.286308  1
  Ni  Ni5  1  0.625217  0.585706  0.276903  1
  Ni  Ni6  1  0.853750  0.540909  0.296080  1
  Ni  Ni7  1  0.295479  0.284750  0.297716  1
  Ni  Ni8  1  0.678352  0.309961  0.288112  1
  Ni  Ni9  1  0.067578  0.329882  0.278355  1
  Ni  Ni10  1  0.295479  0.784750  0.297716  1
  Ni  Ni11  1  0.678352  0.809961  0.288112  1
  Ni  Ni12  1  0.067578  0.829882  0.278355  1
  Ni  Ni13  1  0.080096  0.003267  0.316548  1
  Ni  Ni14  1  0.466565  0.019312  0.306535  1
  Ni  Ni15  1  0.692778  0.982829  0.326703  1
  Ni  Ni16  1  0.080096  0.503267  0.316548  1
  Ni  Ni17  1  0.466565  0.519312  0.306535  1
  Ni  Ni18  1  0.692778  0.482829  0.326703  1
  Ni  Ni19  1  0.129613  0.229593  0.328191  1
  Ni  Ni20  1  0.515750  0.249313  0.318577  1
  Ni  Ni21  1  0.904562  0.267805  0.307498  1
  Ni  Ni22  1  0.129613  0.729593  0.328191  1
  Ni  Ni23  1  0.515750  0.749313  0.318577  1
  Ni  Ni24  1  0.904562  0.767805  0.307498  1
  Ni  Ni25  1  0.918262  0.942526  0.346246  1
  Ni  Ni26  1  0.304631  0.962464  0.336748  1
  Ni  Ni27  1  0.530875  0.922958  0.356723  1
  Ni  Ni28  1  0.918262  0.442526  0.346246  1
  Ni  Ni29  1  0.304631  0.462464  0.336748  1
  Ni  Ni30  1  0.530875  0.422958  0.356723  1
  Ni  Ni31  1  0.966119  0.170008  0.358144  1
  Ni  Ni32  1  0.353527  0.188968  0.348285  1
  Ni  Ni33  1  0.741217  0.209343  0.337985  1
  Ni  Ni34  1  0.966119  0.670008  0.358144  1
  Ni  Ni35  1  0.353527  0.688968  0.348285  1
  Ni  Ni36  1  0.741217  0.709343  0.337985  1
  Ni  Ni37  1  0.756000  0.882629  0.376841  1
  Ni  Ni38  1  0.142779  0.903048  0.366765  1
  Ni  Ni39  1  0.368365  0.862760  0.386981  1
  Ni  Ni40  1  0.756000  0.382629  0.376841  1
  Ni  Ni41  1  0.142779  0.403048  0.366765  1
  Ni  Ni42  1  0.368365  0.362760  0.386981  1
  Ni  Ni43  1  0.804573  0.109491  0.388492  1
  Ni  Ni44  1  0.191391  0.129694  0.378554  1
  Ni  Ni45  1  0.578991  0.149666  0.368516  1
  Ni  Ni46  1  0.804573  0.609491  0.388492  1
  Ni  Ni47  1  0.191391  0.629694  0.378554  1
  Ni  Ni48  1  0.578991  0.649666  0.368516  1
  Ni  Ni49  1  0.593678  0.822948  0.407250  1
  Ni  Ni50  1  0.980805  0.842990  0.397027  1
  Ni  Ni51  1  0.206021  0.803115  0.417328  1
  Ni  Ni52  1  0.593678  0.322948  0.407250  1
  Ni  Ni53  1  0.980805  0.342990  0.397027  1
  Ni  Ni54  1  0.206021  0.303115  0.417328  1
  Ni  Ni55  1  0.642388  0.049780  0.418961  1
  Ni  Ni56  1  0.029491  0.069888  0.408827  1
  Ni  Ni57  1  0.416907  0.089594  0.398787  1
  Ni  Ni58  1  0.642388  0.549780  0.418961  1
  Ni  Ni59  1  0.029491  0.569888  0.408827  1
  Ni  Ni60  1  0.416907  0.589594  0.398787  1
  Ni  Ni61  1  0.431394  0.763148  0.437569  1
  Ni  Ni62  1  0.818763  0.783031  0.427434  1
  Ni  Ni63  1  0.043926  0.743256  0.447665  1
  Ni  Ni64  1  0.431394  0.263148  0.437569  1
  Ni  Ni65  1  0.818763  0.283031  0.427434  1
  Ni  Ni66  1  0.043926  0.243256  0.447665  1
  Ni  Ni67  1  0.480166  0.989996  0.449336  1
  Ni  Ni68  1  0.867531  0.009938  0.439162  1
  Ni  Ni69  1  0.254843  0.029849  0.429096  1
  Ni  Ni70  1  0.480166  0.489996  0.449336  1
  Ni  Ni71  1  0.867531  0.509938  0.439162  1
  Ni  Ni72  1  0.254843  0.529849  0.429096  1
  Ni  Ni73  1  0.269199  0.703368  0.467915  1
  Ni  Ni74  1  0.656628  0.723252  0.457821  1
  Ni  Ni75  1  0.881828  0.683401  0.478036  1
  Ni  Ni76  1  0.269199  0.203368  0.467915  1
  Ni  Ni77  1  0.656628  0.223252  0.457821  1
  Ni  Ni78  1  0.881828  0.183401  0.478036  1
  Ni  Ni79  1  0.318012  0.930189  0.479675  1
  Ni  Ni80  1  0.705424  0.950122  0.469549  1
  Ni  Ni81  1  0.092725  0.970100  0.459427  1
  Ni  Ni82  1  0.318012  0.430189  0.479675  1
  Ni  Ni83  1  0.705424  0.450122  0.469549  1
  Ni  Ni84  1  0.092725  0.470100  0.459427  1
  Ni  Ni85  1  0.107057  0.643553  0.498265  1
  Ni  Ni86  1  0.494470  0.663472  0.488166  1
  Ni  Ni87  1  0.719711  0.623592  0.508409  1
  Ni  Ni88  1  0.107057  0.143553  0.498265  1
  Ni  Ni89  1  0.494470  0.163472  0.488166  1
  Ni  Ni90  1  0.719711  0.123592  0.508409  1
  Ni  Ni91  1  0.155860  0.870400  0.510018  1
  Ni  Ni92  1  0.543274  0.890319  0.499919  1
  Ni  Ni93  1  0.930619  0.910281  0.489775  1
  Ni  Ni94  1  0.155860  0.370400  0.510018  1
  Ni  Ni95  1  0.543274  0.390319  0.499919  1
  Ni  Ni96  1  0.930619  0.410281  0.489775  1
  Ni  Ni97  1  0.944907  0.583751  0.528636  1
  Ni  Ni98  1  0.332318  0.603684  0.518509  1
  Ni  Ni99  1  0.557606  0.563773  0.538757  1
  Ni  Ni100  1  0.944907  0.083751  0.528636  1
  Ni  Ni101  1  0.332318  0.103684  0.518509  1
  Ni  Ni102  1  0.557606  0.063773  0.538757  1
  Ni  Ni103  1  0.993703  0.810621  0.540363  1
  Ni  Ni104  1  0.381132  0.830505  0.530269  1
  Ni  Ni105  1  0.768502  0.850472  0.520149  1
  Ni  Ni106  1  0.993703  0.310621  0.540363  1
  Ni  Ni107  1  0.381132  0.330505  0.530269  1
  Ni  Ni108  1  0.768502  0.350472  0.520149  1
  Ni  Ni109  1  0.782799  0.523934  0.559023  1
  Ni  Ni110  1  0.170164  0.543877  0.548849  1
  Ni  Ni111  1  0.395488  0.504024  0.569089  1
  Ni  Ni112  1  0.782799  0.023934  0.559023  1
  Ni  Ni113  1  0.170164  0.043877  0.548849  1
  Ni  Ni114  1  0.395488  0.004024  0.569089  1
  Ni  Ni115  1  0.831568  0.750842  0.570750  1
  Ni  Ni116  1  0.218937  0.770725  0.560615  1
  Ni  Ni117  1  0.606405  0.790616  0.550519  1
  Ni  Ni118  1  0.831568  0.250842  0.570750  1
  Ni  Ni119  1  0.218937  0.270725  0.560615  1
  Ni  Ni120  1  0.606405  0.290616  0.550519  1
  Ni  Ni121  1  0.620840  0.463985  0.589357  1
  Ni  Ni122  1  0.007943  0.484093  0.579223  1
  Ni  Ni123  1  0.233424  0.444279  0.599397  1
  Ni  Ni124  1  0.620840  0.963985  0.589357  1
  Ni  Ni125  1  0.007943  0.984093  0.579223  1
  Ni  Ni126  1  0.233424  0.944279  0.599397  1
  Ni  Ni127  1  0.669526  0.690883  0.601157  1
  Ni  Ni128  1  0.056653  0.710924  0.590934  1
  Ni  Ni129  1  0.444310  0.730758  0.580856  1
  Ni  Ni130  1  0.669526  0.190883  0.601157  1
  Ni  Ni131  1  0.056653  0.210924  0.590934  1
  Ni  Ni132  1  0.444310  0.230758  0.580856  1
  Ni  Ni133  1  0.458940  0.404179  0.619630  1
  Ni  Ni134  1  0.845758  0.424382  0.609693  1
  Ni  Ni135  1  0.071339  0.384206  0.629668  1
  Ni  Ni136  1  0.458940  0.904179  0.619630  1
  Ni  Ni137  1  0.845758  0.924382  0.609693  1
  Ni  Ni138  1  0.071339  0.884206  0.629668  1
  Ni  Ni139  1  0.507552  0.630825  0.631419  1
  Ni  Ni140  1  0.894331  0.651243  0.621344  1
  Ni  Ni141  1  0.281966  0.671113  0.611203  1
  Ni  Ni142  1  0.507552  0.130825  0.631419  1
  Ni  Ni143  1  0.894331  0.151243  0.621344  1
  Ni  Ni144  1  0.281966  0.171113  0.611203  1
  Ni  Ni145  1  0.296804  0.344905  0.649900  1
  Ni  Ni146  1  0.684211  0.363865  0.640040  1
  Ni  Ni147  1  0.909114  0.324529  0.660199  1
  Ni  Ni148  1  0.296804  0.844905  0.649900  1
  Ni  Ni149  1  0.684211  0.863865  0.640040  1
  Ni  Ni150  1  0.909114  0.824529  0.660199  1
  Ni  Ni151  1  0.345700  0.571409  0.661437  1
  Ni  Ni152  1  0.732069  0.591346  0.651939  1
  Ni  Ni153  1  0.119455  0.610915  0.641462  1
  Ni  Ni154  1  0.345700  0.071409  0.661437  1
  Ni  Ni155  1  0.732069  0.091346  0.651939  1
  Ni  Ni156  1  0.119455  0.110915  0.641462  1
  Ni  Ni157  1  0.134580  0.284559  0.679608  1
  Ni  Ni158  1  0.520718  0.304280  0.669993  1
  Ni  Ni159  1  0.745769  0.266068  0.690686  1
  Ni  Ni160  1  0.134580  0.784559  0.679608  1
  Ni  Ni161  1  0.520718  0.804280  0.669993  1
  Ni  Ni162  1  0.745769  0.766068  0.690686  1
  Ni  Ni163  1  0.183766  0.514560  0.691649  1
  Ni  Ni164  1  0.570235  0.530606  0.681636  1
  Ni  Ni165  1  0.957553  0.551043  0.671481  1
  Ni  Ni166  1  0.183766  0.014560  0.691649  1
  Ni  Ni167  1  0.570235  0.030606  0.681636  1
  Ni  Ni168  1  0.957553  0.051043  0.671481  1
  Ni  Ni169  1  0.971979  0.223912  0.710073  1
  Ni  Ni170  1  0.354852  0.249123  0.700469  1
  Ni  Ni171  1  0.582753  0.203991  0.719829  1
  Ni  Ni172  1  0.971979  0.723912  0.710073  1
  Ni  Ni173  1  0.354852  0.749123  0.700469  1
  Ni  Ni174  1  0.582753  0.703991  0.719829  1
  Ni  Ni175  1  0.025113  0.448167  0.721282  1
  Ni  Ni176  1  0.409134  0.475518  0.711876  1
  Ni  Ni177  1  0.796581  0.492963  0.702104  1
  Ni  Ni178  1  0.025113  0.948167  0.721282  1
  Ni  Ni179  1  0.409134  0.975518  0.711876  1
  Ni  Ni180  1  0.796581  0.992963  0.702104  1
