# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.58698388
_cell_length_b   13.20604281
_cell_length_c   46.46327558
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   109.01253556
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni204
_cell_volume   4981.50428651
_cell_formula_units_Z   204
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  0.633957  0.691837  0.296636  1
  Ni  Ni2  1  0.133957  0.691837  0.296636  1
  Ni  Ni3  1  0.051638  0.033052  0.288331  1
  Ni  Ni4  1  0.480869  0.376186  0.280412  1
  Ni  Ni5  1  0.551638  0.033052  0.288331  1
  Ni  Ni6  1  0.980869  0.376186  0.280412  1
  Ni  Ni7  1  0.735877  0.533091  0.288332  1
  Ni  Ni8  1  0.235877  0.533091  0.288332  1
  Ni  Ni9  1  0.149648  0.876137  0.280419  1
  Ni  Ni10  1  0.312302  0.191854  0.296641  1
  Ni  Ni11  1  0.649648  0.876137  0.280419  1
  Ni  Ni12  1  0.812302  0.191854  0.296641  1
  Ni  Ni13  1  0.378487  0.674419  0.323218  1
  Ni  Ni14  1  0.878487  0.674419  0.323218  1
  Ni  Ni15  1  0.795465  0.013302  0.315016  1
  Ni  Ni16  1  0.217160  0.351423  0.305832  1
  Ni  Ni17  1  0.295465  0.013302  0.315016  1
  Ni  Ni18  1  0.717160  0.351423  0.305832  1
  Ni  Ni19  1  0.472233  0.513292  0.315018  1
  Ni  Ni20  1  0.972233  0.513292  0.315018  1
  Ni  Ni21  1  0.888617  0.851422  0.305845  1
  Ni  Ni22  1  0.050325  0.174400  0.323219  1
  Ni  Ni23  1  0.388617  0.851422  0.305845  1
  Ni  Ni24  1  0.550325  0.174400  0.323219  1
  Ni  Ni25  1  0.120469  0.653989  0.349477  1
  Ni  Ni26  1  0.620469  0.653989  0.349477  1
  Ni  Ni27  1  0.538428  0.993484  0.340660  1
  Ni  Ni28  1  0.958768  0.333789  0.332428  1
  Ni  Ni29  1  0.038428  0.993484  0.340660  1
  Ni  Ni30  1  0.458768  0.333789  0.332428  1
  Ni  Ni31  1  0.209447  0.493479  0.340659  1
  Ni  Ni32  1  0.709447  0.493479  0.340659  1
  Ni  Ni33  1  0.629395  0.833781  0.332435  1
  Ni  Ni34  1  0.787909  0.153984  0.349479  1
  Ni  Ni35  1  0.129395  0.833781  0.332435  1
  Ni  Ni36  1  0.287909  0.153984  0.349479  1
  Ni  Ni37  1  0.860678  0.634030  0.375888  1
  Ni  Ni38  1  0.360678  0.634030  0.375888  1
  Ni  Ni39  1  0.279910  0.974148  0.367339  1
  Ni  Ni40  1  0.700146  0.313942  0.358511  1
  Ni  Ni41  1  0.779910  0.974148  0.367339  1
  Ni  Ni42  1  0.200146  0.313942  0.358511  1
  Ni  Ni43  1  0.948621  0.474144  0.367339  1
  Ni  Ni44  1  0.448621  0.474144  0.367339  1
  Ni  Ni45  1  0.368171  0.813937  0.358519  1
  Ni  Ni46  1  0.527736  0.134030  0.375890  1
  Ni  Ni47  1  0.868171  0.813937  0.358519  1
  Ni  Ni48  1  0.027736  0.134030  0.375890  1
  Ni  Ni49  1  0.600925  0.614412  0.402292  1
  Ni  Ni50  1  0.100925  0.614412  0.402292  1
  Ni  Ni51  1  0.020384  0.954296  0.393526  1
  Ni  Ni52  1  0.440409  0.294008  0.384849  1
  Ni  Ni53  1  0.520384  0.954296  0.393526  1
  Ni  Ni54  1  0.940409  0.294008  0.384849  1
  Ni  Ni55  1  0.688289  0.454292  0.393526  1
  Ni  Ni56  1  0.188289  0.454292  0.393526  1
  Ni  Ni57  1  0.107974  0.794004  0.384854  1
  Ni  Ni58  1  0.267863  0.114411  0.402294  1
  Ni  Ni59  1  0.607974  0.794004  0.384854  1
  Ni  Ni60  1  0.767863  0.114411  0.402294  1
  Ni  Ni61  1  0.340939  0.594574  0.428621  1
  Ni  Ni62  1  0.840939  0.594574  0.428621  1
  Ni  Ni63  1  0.760604  0.934481  0.419902  1
  Ni  Ni64  1  0.180579  0.274371  0.411122  1
  Ni  Ni65  1  0.260604  0.934481  0.419902  1
  Ni  Ni66  1  0.680579  0.274371  0.411122  1
  Ni  Ni67  1  0.428249  0.434478  0.419903  1
  Ni  Ni68  1  0.928249  0.434478  0.419903  1
  Ni  Ni69  1  0.848163  0.774367  0.411126  1
  Ni  Ni70  1  0.008006  0.094574  0.428624  1
  Ni  Ni71  1  0.348163  0.774367  0.411126  1
  Ni  Ni72  1  0.508006  0.094574  0.428624  1
  Ni  Ni73  1  0.080994  0.574807  0.454970  1
  Ni  Ni74  1  0.580994  0.574807  0.454970  1
  Ni  Ni75  1  0.500790  0.914728  0.446203  1
  Ni  Ni76  1  0.920747  0.254615  0.437456  1
  Ni  Ni77  1  1.000790  0.914728  0.446203  1
  Ni  Ni78  1  0.420747  0.254615  0.437456  1
  Ni  Ni79  1  0.168303  0.414725  0.446204  1
  Ni  Ni80  1  0.668303  0.414725  0.446204  1
  Ni  Ni81  1  0.588234  0.754612  0.437460  1
  Ni  Ni82  1  0.748177  0.074806  0.454973  1
  Ni  Ni83  1  0.088234  0.754612  0.437460  1
  Ni  Ni84  1  0.248177  0.074806  0.454973  1
  Ni  Ni85  1  0.821052  0.555035  0.481298  1
  Ni  Ni86  1  0.321052  0.555035  0.481298  1
  Ni  Ni87  1  0.240934  0.894953  0.472539  1
  Ni  Ni88  1  0.660893  0.234859  0.463766  1
  Ni  Ni89  1  0.740934  0.894953  0.472539  1
  Ni  Ni90  1  0.160893  0.234859  0.463766  1
  Ni  Ni91  1  0.908378  0.394951  0.472540  1
  Ni  Ni92  1  0.408378  0.394951  0.472540  1
  Ni  Ni93  1  0.328327  0.734857  0.463769  1
  Ni  Ni94  1  0.488341  0.055034  0.481302  1
  Ni  Ni95  1  0.828327  0.734857  0.463769  1
  Ni  Ni96  1  0.988341  0.055034  0.481302  1
  Ni  Ni97  1  0.561130  0.535271  0.507627  1
  Ni  Ni98  1  0.061130  0.535271  0.507627  1
  Ni  Ni99  1  0.981054  0.875182  0.498862  1
  Ni  Ni100  1  0.401042  0.215093  0.490095  1
  Ni  Ni101  1  0.481054  0.875182  0.498862  1
  Ni  Ni102  1  0.901042  0.215093  0.490095  1
  Ni  Ni103  1  0.648481  0.375180  0.498863  1
  Ni  Ni104  1  0.148481  0.375180  0.498863  1
  Ni  Ni105  1  0.068405  0.715090  0.490098  1
  Ni  Ni106  1  0.228493  0.035269  0.507630  1
  Ni  Ni107  1  0.568405  0.715090  0.490098  1
  Ni  Ni108  1  0.728493  0.035269  0.507630  1
  Ni  Ni109  1  0.301208  0.515505  0.533956  1
  Ni  Ni110  1  0.801208  0.515505  0.533956  1
  Ni  Ni111  1  0.721157  0.855411  0.525185  1
  Ni  Ni112  1  0.141194  0.195328  0.516424  1
  Ni  Ni113  1  0.221157  0.855411  0.525185  1
  Ni  Ni114  1  0.641194  0.195328  0.516424  1
  Ni  Ni115  1  0.388601  0.355409  0.525186  1
  Ni  Ni116  1  0.888601  0.355409  0.525186  1
  Ni  Ni117  1  0.808483  0.695326  0.516427  1
  Ni  Ni118  1  0.968642  0.015502  0.533959  1
  Ni  Ni119  1  0.308483  0.695326  0.516427  1
  Ni  Ni120  1  0.468642  0.015502  0.533959  1
  Ni  Ni121  1  0.041301  0.495750  0.560265  1
  Ni  Ni122  1  0.541301  0.495750  0.560265  1
  Ni  Ni123  1  0.461232  0.835636  0.551522  1
  Ni  Ni124  1  0.881358  0.175556  0.542753  1
  Ni  Ni125  1  0.961232  0.835636  0.551522  1
  Ni  Ni126  1  0.381358  0.175556  0.542753  1
  Ni  Ni127  1  0.128745  0.335634  0.551523  1
  Ni  Ni128  1  0.628745  0.335634  0.551523  1
  Ni  Ni129  1  0.548541  0.675555  0.542755  1
  Ni  Ni130  1  0.708788  0.995747  0.560269  1
  Ni  Ni131  1  0.048541  0.675555  0.542755  1
  Ni  Ni132  1  0.208788  0.995747  0.560269  1
  Ni  Ni133  1  0.781372  0.475995  0.586599  1
  Ni  Ni134  1  0.281372  0.475995  0.586599  1
  Ni  Ni135  1  0.201286  0.815883  0.577822  1
  Ni  Ni136  1  0.621529  0.155788  0.569101  1
  Ni  Ni137  1  0.701286  0.815883  0.577822  1
  Ni  Ni138  1  0.121529  0.155788  0.569101  1
  Ni  Ni139  1  0.868931  0.315881  0.577823  1
  Ni  Ni140  1  0.368931  0.315881  0.577823  1
  Ni  Ni141  1  0.288596  0.655788  0.569104  1
  Ni  Ni142  1  0.448956  0.975991  0.586604  1
  Ni  Ni143  1  0.788596  0.655788  0.569104  1
  Ni  Ni144  1  0.948956  0.975991  0.586604  1
  Ni  Ni145  1  0.521561  0.456358  0.612871  1
  Ni  Ni146  1  0.021561  0.456358  0.612871  1
  Ni  Ni147  1  0.941246  0.796069  0.604199  1
  Ni  Ni148  1  0.361672  0.135950  0.595431  1
  Ni  Ni149  1  0.441246  0.796069  0.604199  1
  Ni  Ni150  1  0.861672  0.135950  0.595431  1
  Ni  Ni151  1  0.609151  0.296066  0.604199  1
  Ni  Ni152  1  0.109151  0.296066  0.604199  1
  Ni  Ni153  1  0.028610  0.635950  0.595433  1
  Ni  Ni154  1  0.189126  0.956354  0.612877  1
  Ni  Ni155  1  0.528610  0.635950  0.595433  1
  Ni  Ni156  1  0.689126  0.956354  0.612877  1
  Ni  Ni157  1  0.261364  0.436425  0.639206  1
  Ni  Ni158  1  0.761364  0.436425  0.639206  1
  Ni  Ni159  1  0.680914  0.776218  0.630386  1
  Ni  Ni160  1  0.101799  0.116331  0.621835  1
  Ni  Ni161  1  0.180914  0.776218  0.630386  1
  Ni  Ni162  1  0.601799  0.116331  0.621835  1
  Ni  Ni163  1  0.349624  0.276213  0.630387  1
  Ni  Ni164  1  0.849624  0.276213  0.630387  1
  Ni  Ni165  1  0.768856  0.616332  0.621837  1
  Ni  Ni166  1  0.929388  0.936420  0.639214  1
  Ni  Ni167  1  0.268856  0.616332  0.621837  1
  Ni  Ni168  1  0.429388  0.936420  0.639214  1
  Ni  Ni169  1  1.000140  0.416581  0.665290  1
  Ni  Ni170  1  0.500140  0.416581  0.665290  1
  Ni  Ni171  1  0.420088  0.756882  0.657066  1
  Ni  Ni172  1  0.841626  0.096378  0.648246  1
  Ni  Ni173  1  0.920088  0.756882  0.657066  1
  Ni  Ni174  1  0.341626  0.096378  0.648246  1
  Ni  Ni175  1  0.091106  0.256877  0.657065  1
  Ni  Ni176  1  0.591106  0.256877  0.657065  1
  Ni  Ni177  1  0.509066  0.596373  0.648248  1
  Ni  Ni178  1  0.670767  0.916572  0.665297  1
  Ni  Ni179  1  0.009066  0.596373  0.648248  1
  Ni  Ni180  1  0.170767  0.916572  0.665297  1
  Ni  Ni181  1  0.740918  0.398939  0.691880  1
  Ni  Ni182  1  0.240918  0.398939  0.691880  1
  Ni  Ni183  1  0.157302  0.737070  0.682707  1
  Ni  Ni184  1  0.579209  0.075962  0.674507  1
  Ni  Ni185  1  0.657302  0.737070  0.682707  1
  Ni  Ni186  1  0.079209  0.075962  0.674507  1
  Ni  Ni187  1  0.834070  0.237060  0.682709  1
  Ni  Ni188  1  0.334070  0.237060  0.682709  1
  Ni  Ni189  1  0.251048  0.575942  0.674508  1
  Ni  Ni190  1  0.412375  0.898939  0.691893  1
  Ni  Ni191  1  0.751048  0.575942  0.674508  1
  Ni  Ni192  1  0.912375  0.898939  0.691893  1
  Ni  Ni193  1  0.479887  0.374225  0.717306  1
  Ni  Ni194  1  0.979887  0.374225  0.717306  1
  Ni  Ni195  1  0.893658  0.717271  0.709393  1
  Ni  Ni196  1  0.317233  0.058508  0.701084  1
  Ni  Ni197  1  0.393658  0.717271  0.709393  1
  Ni  Ni198  1  0.817233  0.058508  0.701084  1
  Ni  Ni199  1  0.577896  0.217309  0.709394  1
  Ni  Ni200  1  0.077896  0.217309  0.709394  1
  Ni  Ni201  1  0.995578  0.558525  0.701089  1
  Ni  Ni202  1  0.148665  0.874175  0.717313  1
  Ni  Ni203  1  0.495578  0.558525  0.701089  1
  Ni  Ni204  1  0.648665  0.874175  0.717313  1
