# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.78539728
_cell_length_b   9.51179522
_cell_length_c   46.13681676
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   65.31867670
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni180
_cell_volume   4300.71032824
_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  0.156532  0.295881  0.299395  1
  Ni  Ni2  1  0.540460  0.315469  0.289287  1
  Ni  Ni3  1  0.929072  0.332377  0.279499  1
  Ni  Ni4  1  0.156532  0.795881  0.299395  1
  Ni  Ni5  1  0.540460  0.815469  0.289287  1
  Ni  Ni6  1  0.929072  0.832377  0.279499  1
  Ni  Ni7  1  0.366191  0.084020  0.281395  1
  Ni  Ni8  1  0.752904  0.101352  0.271957  1
  Ni  Ni9  1  0.980980  0.060850  0.291202  1
  Ni  Ni10  1  0.366191  0.584020  0.281395  1
  Ni  Ni11  1  0.752904  0.601352  0.271957  1
  Ni  Ni12  1  0.980980  0.560850  0.291202  1
  Ni  Ni13  1  0.994258  0.237210  0.330433  1
  Ni  Ni14  1  0.381513  0.257027  0.320362  1
  Ni  Ni15  1  0.767930  0.276503  0.310363  1
  Ni  Ni16  1  0.994258  0.737210  0.330433  1
  Ni  Ni17  1  0.381513  0.757027  0.320362  1
  Ni  Ni18  1  0.767930  0.776503  0.310363  1
  Ni  Ni19  1  0.205383  0.021367  0.311295  1
  Ni  Ni20  1  0.592147  0.040009  0.301682  1
  Ni  Ni21  1  0.816810  0.003094  0.322409  1
  Ni  Ni22  1  0.205383  0.521367  0.311295  1
  Ni  Ni23  1  0.592147  0.540009  0.301682  1
  Ni  Ni24  1  0.816810  0.503094  0.322409  1
  Ni  Ni25  1  0.830373  0.180172  0.360676  1
  Ni  Ni26  1  0.217821  0.199322  0.350527  1
  Ni  Ni27  1  0.605799  0.218292  0.340599  1
  Ni  Ni28  1  0.830373  0.680172  0.360676  1
  Ni  Ni29  1  0.217821  0.699322  0.350527  1
  Ni  Ni30  1  0.605799  0.718292  0.340599  1
  Ni  Ni31  1  0.041005  0.965395  0.342236  1
  Ni  Ni32  1  0.428662  0.984120  0.332471  1
  Ni  Ni33  1  0.653102  0.946352  0.352421  1
  Ni  Ni34  1  0.041005  0.465395  0.342236  1
  Ni  Ni35  1  0.428662  0.484120  0.332471  1
  Ni  Ni36  1  0.653102  0.446352  0.352421  1
  Ni  Ni37  1  0.667417  0.121948  0.391034  1
  Ni  Ni38  1  0.054992  0.141331  0.380913  1
  Ni  Ni39  1  0.442321  0.161008  0.370798  1
  Ni  Ni40  1  0.667417  0.621948  0.391034  1
  Ni  Ni41  1  0.054992  0.641331  0.380913  1
  Ni  Ni42  1  0.442321  0.661008  0.370798  1
  Ni  Ni43  1  0.878431  0.907307  0.372551  1
  Ni  Ni44  1  0.265377  0.927165  0.362379  1
  Ni  Ni45  1  0.490659  0.888035  0.382669  1
  Ni  Ni46  1  0.878431  0.407307  0.372551  1
  Ni  Ni47  1  0.265377  0.427165  0.362379  1
  Ni  Ni48  1  0.490659  0.388035  0.382669  1
  Ni  Ni49  1  0.504517  0.063972  0.421304  1
  Ni  Ni50  1  0.892195  0.083262  0.411206  1
  Ni  Ni51  1  0.279719  0.102646  0.401087  1
  Ni  Ni52  1  0.504517  0.563972  0.421304  1
  Ni  Ni53  1  0.892195  0.583262  0.411206  1
  Ni  Ni54  1  0.279719  0.602646  0.401087  1
  Ni  Ni55  1  0.715622  0.849339  0.402796  1
  Ni  Ni56  1  0.103225  0.868714  0.392672  1
  Ni  Ni57  1  0.327927  0.830103  0.412873  1
  Ni  Ni58  1  0.715622  0.349339  0.402796  1
  Ni  Ni59  1  0.103225  0.368714  0.392672  1
  Ni  Ni60  1  0.327927  0.330103  0.412873  1
  Ni  Ni61  1  0.341734  0.005898  0.451601  1
  Ni  Ni62  1  0.729357  0.025215  0.441513  1
  Ni  Ni63  1  0.116955  0.044562  0.431407  1
  Ni  Ni64  1  0.341734  0.505898  0.451601  1
  Ni  Ni65  1  0.729357  0.525215  0.441513  1
  Ni  Ni66  1  0.116955  0.544562  0.431407  1
  Ni  Ni67  1  0.552801  0.791390  0.433089  1
  Ni  Ni68  1  0.940448  0.810720  0.422984  1
  Ni  Ni69  1  0.165223  0.772039  0.443163  1
  Ni  Ni70  1  0.552801  0.291390  0.433089  1
  Ni  Ni71  1  0.940448  0.310720  0.422984  1
  Ni  Ni72  1  0.165223  0.272039  0.443163  1
  Ni  Ni73  1  0.178946  0.947853  0.481902  1
  Ni  Ni74  1  0.566529  0.967218  0.471804  1
  Ni  Ni75  1  0.954154  0.986541  0.461707  1
  Ni  Ni76  1  0.178946  0.447853  0.481902  1
  Ni  Ni77  1  0.566529  0.467218  0.471804  1
  Ni  Ni78  1  0.954154  0.486541  0.461707  1
  Ni  Ni79  1  0.390000  0.733378  0.463363  1
  Ni  Ni80  1  0.777629  0.752696  0.453269  1
  Ni  Ni81  1  0.002428  0.714022  0.473462  1
  Ni  Ni82  1  0.390000  0.233378  0.463363  1
  Ni  Ni83  1  0.777629  0.252696  0.453269  1
  Ni  Ni84  1  0.002428  0.214022  0.473462  1
  Ni  Ni85  1  0.016138  0.889834  0.512194  1
  Ni  Ni86  1  0.403731  0.909183  0.502099  1
  Ni  Ni87  1  0.791337  0.928518  0.492002  1
  Ni  Ni88  1  0.016138  0.389834  0.512194  1
  Ni  Ni89  1  0.403731  0.409183  0.502099  1
  Ni  Ni90  1  0.791337  0.428518  0.492002  1
  Ni  Ni91  1  0.227217  0.675342  0.493657  1
  Ni  Ni92  1  0.614809  0.694692  0.483562  1
  Ni  Ni93  1  0.839611  0.656008  0.503755  1
  Ni  Ni94  1  0.227217  0.175342  0.493657  1
  Ni  Ni95  1  0.614809  0.194692  0.483562  1
  Ni  Ni96  1  0.839611  0.156008  0.503755  1
  Ni  Ni97  1  0.853318  0.831830  0.542487  1
  Ni  Ni98  1  0.240947  0.851147  0.532393  1
  Ni  Ni99  1  0.628519  0.870503  0.522294  1
  Ni  Ni100  1  0.853318  0.331830  0.542487  1
  Ni  Ni101  1  0.240947  0.351147  0.532393  1
  Ni  Ni102  1  0.628519  0.370503  0.522294  1
  Ni  Ni103  1  0.064418  0.617307  0.523952  1
  Ni  Ni104  1  0.452001  0.636672  0.513854  1
  Ni  Ni105  1  0.676793  0.597985  0.534049  1
  Ni  Ni106  1  0.064418  0.117307  0.523952  1
  Ni  Ni107  1  0.452001  0.136672  0.513854  1
  Ni  Ni108  1  0.676793  0.097985  0.534049  1
  Ni  Ni109  1  0.690500  0.773806  0.572773  1
  Ni  Ni110  1  0.078146  0.793136  0.562667  1
  Ni  Ni111  1  0.465724  0.812486  0.552593  1
  Ni  Ni112  1  0.690500  0.273806  0.572773  1
  Ni  Ni113  1  0.078146  0.293136  0.562667  1
  Ni  Ni114  1  0.465724  0.312486  0.552593  1
  Ni  Ni115  1  0.901590  0.559310  0.554243  1
  Ni  Ni116  1  0.289214  0.578627  0.544156  1
  Ni  Ni117  1  0.513992  0.539963  0.564349  1
  Ni  Ni118  1  0.901590  0.059310  0.554243  1
  Ni  Ni119  1  0.289214  0.078627  0.544156  1
  Ni  Ni120  1  0.513992  0.039963  0.564349  1
  Ni  Ni121  1  0.527722  0.715811  0.603084  1
  Ni  Ni122  1  0.915326  0.735186  0.592960  1
  Ni  Ni123  1  0.303020  0.754423  0.582883  1
  Ni  Ni124  1  0.527722  0.215811  0.603084  1
  Ni  Ni125  1  0.915326  0.235186  0.592960  1
  Ni  Ni126  1  0.303020  0.254423  0.582883  1
  Ni  Ni127  1  0.738752  0.501264  0.584550  1
  Ni  Ni128  1  0.126430  0.520553  0.574453  1
  Ni  Ni129  1  0.351228  0.481879  0.594669  1
  Ni  Ni130  1  0.738752  1.001264  0.584550  1
  Ni  Ni131  1  0.126430  0.020553  0.574453  1
  Ni  Ni132  1  0.351228  0.981879  0.594669  1
  Ni  Ni133  1  0.365571  0.657361  0.633377  1
  Ni  Ni134  1  0.752516  0.677219  0.623205  1
  Ni  Ni135  1  0.140288  0.696490  0.613087  1
  Ni  Ni136  1  0.365571  0.157361  0.633377  1
  Ni  Ni137  1  0.752516  0.177219  0.623205  1
  Ni  Ni138  1  0.140288  0.196490  0.613087  1
  Ni  Ni139  1  0.575955  0.443194  0.614843  1
  Ni  Ni140  1  0.963530  0.462578  0.604722  1
  Ni  Ni141  1  0.188626  0.423517  0.624958  1
  Ni  Ni142  1  0.575955  0.943194  0.614843  1
  Ni  Ni143  1  0.963530  0.962578  0.604722  1
  Ni  Ni144  1  0.188626  0.923517  0.624958  1
  Ni  Ni145  1  0.202285  0.600406  0.663285  1
  Ni  Ni146  1  0.589943  0.619131  0.653520  1
  Ni  Ni147  1  0.977845  0.638173  0.643335  1
  Ni  Ni148  1  0.202285  0.100406  0.663285  1
  Ni  Ni149  1  0.589943  0.119131  0.653520  1
  Ni  Ni150  1  0.977845  0.138173  0.643335  1
  Ni  Ni151  1  0.413126  0.385203  0.645229  1
  Ni  Ni152  1  0.800575  0.404353  0.635080  1
  Ni  Ni153  1  0.025148  0.366233  0.655158  1
  Ni  Ni154  1  0.413126  0.885203  0.645229  1
  Ni  Ni155  1  0.800575  0.904353  0.635080  1
  Ni  Ni156  1  0.025148  0.866233  0.655158  1
  Ni  Ni157  1  0.038800  0.544516  0.694074  1
  Ni  Ni158  1  0.425565  0.563159  0.684461  1
  Ni  Ni159  1  0.814138  0.581432  0.673347  1
  Ni  Ni160  1  0.038800  0.044516  0.694074  1
  Ni  Ni161  1  0.425565  0.063159  0.684461  1
  Ni  Ni162  1  0.814138  0.081432  0.673347  1
  Ni  Ni163  1  0.249434  0.327498  0.675395  1
  Ni  Ni164  1  0.636689  0.347315  0.665323  1
  Ni  Ni165  1  0.863017  0.308023  0.685394  1
  Ni  Ni166  1  0.249434  0.827498  0.675395  1
  Ni  Ni167  1  0.636689  0.847315  0.665323  1
  Ni  Ni168  1  0.863017  0.808023  0.685394  1
  Ni  Ni169  1  0.878043  0.483173  0.723799  1
  Ni  Ni170  1  0.264757  0.500506  0.714361  1
  Ni  Ni171  1  0.649967  0.523675  0.704554  1
  Ni  Ni172  1  0.878043  0.983173  0.723799  1
  Ni  Ni173  1  0.264757  1.000506  0.714361  1
  Ni  Ni174  1  0.649967  0.023675  0.704554  1
  Ni  Ni175  1  0.090487  0.269056  0.706469  1
  Ni  Ni176  1  0.474415  0.288645  0.696361  1
  Ni  Ni177  1  0.701876  0.252149  0.716257  1
  Ni  Ni178  1  0.090487  0.769056  0.706469  1
  Ni  Ni179  1  0.474415  0.788645  0.696361  1
  Ni  Ni180  1  0.701876  0.752149  0.716257  1
