# generated using pymatgen
data_Zr9Ni11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.86665643
_cell_length_b   9.86149168
_cell_length_c   52.19478129
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr9Ni11
_chemical_formula_sum   'Zr72 Ni88'
_cell_volume   5078.54962528
_cell_formula_units_Z   8
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
  Zr  Zr1  1  0.004145  1.003675  0.276875  1
  Zr  Zr2  1  0.062057  0.247894  0.320702  1
  Zr  Zr3  1  0.281671  0.587370  0.261309  1
  Zr  Zr4  1  0.726504  0.419922  0.261284  1
  Zr  Zr5  1  0.946212  0.759494  0.320681  1
  Zr  Zr6  1  0.937164  0.673544  0.258971  1
  Zr  Zr7  1  0.798729  0.400389  0.321005  1
  Zr  Zr8  1  0.209554  0.606967  0.321056  1
  Zr  Zr9  1  0.071071  0.333772  0.258982  1
  Zr  Zr10  1  0.504135  0.503698  0.336261  1
  Zr  Zr11  1  0.587786  0.726047  0.261293  1
  Zr  Zr12  1  0.759943  0.061575  0.320682  1
  Zr  Zr13  1  0.248340  0.945748  0.320696  1
  Zr  Zr14  1  0.420391  0.281217  0.261307  1
  Zr  Zr15  1  0.400805  0.209224  0.321036  1
  Zr  Zr16  1  0.334185  0.936708  0.258983  1
  Zr  Zr17  1  0.674028  0.070586  0.258970  1
  Zr  Zr18  1  0.607372  0.798258  0.321006  1
  Zr  Zr19  1  0.004235  1.003576  0.386213  1
  Zr  Zr20  1  0.065205  0.250465  0.448342  1
  Zr  Zr21  1  0.269177  0.592148  0.384380  1
  Zr  Zr22  1  0.739019  0.415251  0.384248  1
  Zr  Zr23  1  0.943602  0.756405  0.448253  1
  Zr  Zr24  1  0.936788  0.667432  0.384572  1
  Zr  Zr25  1  0.804622  0.402205  0.448080  1
  Zr  Zr26  1  0.205725  0.605819  0.448371  1
  Zr  Zr27  1  0.071491  0.339834  0.384600  1
  Zr  Zr28  1  0.504345  0.503766  0.440798  1
  Zr  Zr29  1  0.592551  0.738747  0.384284  1
  Zr  Zr30  1  0.756619  0.064678  0.448203  1
  Zr  Zr31  1  0.250521  0.943152  0.448338  1
  Zr  Zr32  1  0.415688  0.268840  0.384341  1
  Zr  Zr33  1  0.402409  0.204308  0.448243  1
  Zr  Zr34  1  0.340247  0.936406  0.384602  1
  Zr  Zr35  1  0.667837  0.071083  0.384567  1
  Zr  Zr36  1  0.606101  0.802979  0.448176  1
  Zr  Zr37  1  0.004158  1.003838  0.501334  1
  Zr  Zr38  1  0.058866  0.237665  0.574500  1
  Zr  Zr39  1  0.280145  0.588936  0.511622  1
  Zr  Zr40  1  0.728472  0.419302  0.510886  1
  Zr  Zr41  1  0.949163  0.770261  0.574070  1
  Zr  Zr42  1  0.937174  0.669691  0.511183  1
  Zr  Zr43  1  0.801545  0.396704  0.573888  1
  Zr  Zr44  1  0.212594  0.610570  0.575262  1
  Zr  Zr45  1  0.071354  0.338144  0.511375  1
  Zr  Zr46  1  0.508215  0.503468  0.558481  1
  Zr  Zr47  1  0.588837  0.729079  0.511196  1
  Zr  Zr48  1  0.769906  0.058904  0.573798  1
  Zr  Zr49  1  0.236855  0.949207  0.574438  1
  Zr  Zr50  1  0.419154  0.279961  0.511306  1
  Zr  Zr51  1  0.395447  0.211060  0.574560  1
  Zr  Zr52  1  0.337257  0.937208  0.511345  1
  Zr  Zr53  1  0.669448  0.071577  0.510999  1
  Zr  Zr54  1  0.609934  0.799532  0.574426  1
  Zr  Zr55  1  1.003910  1.002140  0.636575  1
  Zr  Zr56  1  0.082699  0.261509  0.704264  1
  Zr  Zr57  1  0.277195  0.590331  0.636859  1
  Zr  Zr58  1  0.718166  0.421679  0.633836  1
  Zr  Zr59  1  0.932434  0.766752  0.703682  1
  Zr  Zr60  1  0.932855  0.671727  0.636615  1
  Zr  Zr61  1  0.814936  0.403360  0.693230  1
  Zr  Zr62  1  0.209636  0.593895  0.700507  1
  Zr  Zr63  1  0.066608  0.339315  0.638028  1
  Zr  Zr64  1  0.508320  0.506596  0.684087  1
  Zr  Zr65  1  0.585245  0.725698  0.635253  1
  Zr  Zr66  1  0.747740  0.077837  0.704784  1
  Zr  Zr67  1  0.246270  0.933972  0.702988  1
  Zr  Zr68  1  0.416308  0.286604  0.635303  1
  Zr  Zr69  1  0.417628  0.193302  0.696910  1
  Zr  Zr70  1  0.336712  0.938742  0.637402  1
  Zr  Zr71  1  0.666632  0.073381  0.636313  1
  Zr  Zr72  1  0.607978  0.797410  0.696441  1
  Ni  Ni73  1  0.004173  1.003703  0.335239  1
  Ni  Ni74  1  0.004186  0.503713  0.294235  1
  Ni  Ni75  1  0.004098  0.503653  0.346017  1
  Ni  Ni76  1  0.250268  0.386361  0.347500  1
  Ni  Ni77  1  0.148004  0.783452  0.282972  1
  Ni  Ni78  1  0.860227  0.223810  0.282955  1
  Ni  Ni79  1  0.757990  0.621152  0.347445  1
  Ni  Ni80  1  0.745357  0.612347  0.296910  1
  Ni  Ni81  1  0.873583  0.204347  0.359544  1
  Ni  Ni82  1  0.134697  0.802902  0.359560  1
  Ni  Ni83  1  0.262842  0.395037  0.296937  1
  Ni  Ni84  1  0.504112  0.503628  0.288060  1
  Ni  Ni85  1  0.504027  1.003663  0.346006  1
  Ni  Ni86  1  0.504074  1.003774  0.294229  1
  Ni  Ni87  1  0.783946  0.859751  0.282945  1
  Ni  Ni88  1  0.621498  0.249769  0.347456  1
  Ni  Ni89  1  0.386707  0.757496  0.347491  1
  Ni  Ni90  1  0.224297  0.147577  0.282975  1
  Ni  Ni91  1  0.204953  0.134243  0.359559  1
  Ni  Ni92  1  0.395403  0.744849  0.296937  1
  Ni  Ni93  1  0.612816  0.262408  0.296921  1
  Ni  Ni94  1  0.803439  0.873208  0.359542  1
  Ni  Ni95  1  1.003431  1.003656  0.439657  1
  Ni  Ni96  1  0.005366  0.504171  0.422148  1
  Ni  Ni97  1  0.005186  0.503651  0.473949  1
  Ni  Ni98  1  0.268445  0.395108  0.472860  1
  Ni  Ni99  1  0.136686  0.799831  0.410334  1
  Ni  Ni100  1  0.871734  0.207070  0.410286  1
  Ni  Ni101  1  0.739418  0.612823  0.472673  1
  Ni  Ni102  1  0.747732  0.618063  0.421515  1
  Ni  Ni103  1  0.863083  0.220881  0.485403  1
  Ni  Ni104  1  0.145340  0.786338  0.485661  1
  Ni  Ni105  1  0.260565  0.389408  0.421646  1
  Ni  Ni106  1  0.504184  0.503795  0.389489  1
  Ni  Ni107  1  0.503431  1.002910  0.473921  1
  Ni  Ni108  1  0.503727  1.003626  0.422140  1
  Ni  Ni109  1  0.800580  0.871224  0.410291  1
  Ni  Ni110  1  0.612893  0.269352  0.472640  1
  Ni  Ni111  1  0.395091  0.740184  0.472846  1
  Ni  Ni112  1  0.207735  0.136288  0.410323  1
  Ni  Ni113  1  0.221355  0.145443  0.485630  1
  Ni  Ni114  1  0.389839  0.747714  0.421619  1
  Ni  Ni115  1  0.618632  0.260582  0.421534  1
  Ni  Ni116  1  0.787276  0.862824  0.485437  1
  Ni  Ni117  1  0.004687  1.003731  0.548154  1
  Ni  Ni118  1  0.007595  0.506335  0.550241  1
  Ni  Ni119  1  1.000662  0.505551  0.599819  1
  Ni  Ni120  1  0.250902  0.392004  0.598584  1
  Ni  Ni121  1  0.137943  0.796147  0.534791  1
  Ni  Ni122  1  0.871026  0.209815  0.534359  1
  Ni  Ni123  1  0.745141  0.615142  0.597392  1
  Ni  Ni124  1  0.763184  0.622065  0.548504  1
  Ni  Ni125  1  0.863208  0.214459  0.612974  1
  Ni  Ni126  1  0.141226  0.793858  0.613822  1
  Ni  Ni127  1  0.247293  0.387193  0.549013  1
  Ni  Ni128  1  0.503237  0.504838  0.486366  1
  Ni  Ni129  1  0.501149  0.006623  0.598966  1
  Ni  Ni130  1  0.502859  0.004810  0.549806  1
  Ni  Ni131  1  0.797296  0.871010  0.534417  1
  Ni  Ni132  1  0.612961  0.261354  0.597255  1
  Ni  Ni133  1  0.390001  0.754552  0.598506  1
  Ni  Ni134  1  0.210490  0.138272  0.534722  1
  Ni  Ni135  1  0.212290  0.143738  0.613742  1
  Ni  Ni136  1  0.386551  0.761933  0.549005  1
  Ni  Ni137  1  0.621707  0.245862  0.548451  1
  Ni  Ni138  1  0.791489  0.865742  0.613118  1
  Ni  Ni139  1  1.002047  0.010722  0.686641  1
  Ni  Ni140  1  0.018793  0.525258  0.674525  1
  Ni  Ni141  1  0.981077  0.522601  0.724831  1
  Ni  Ni142  1  0.338928  0.398715  0.722338  1
  Ni  Ni143  1  0.126210  0.797186  0.664487  1
  Ni  Ni144  1  0.875029  0.196397  0.663004  1
  Ni  Ni145  1  0.714666  0.584614  0.721607  1
  Ni  Ni146  1  0.764641  0.628425  0.672951  1
  Ni  Ni147  1  0.843251  0.307254  0.736975  1
  Ni  Ni148  1  0.156107  0.730477  0.738514  1
  Ni  Ni149  1  0.257801  0.381591  0.673943  1
  Ni  Ni150  1  0.490055  0.508390  0.605515  1
  Ni  Ni151  1  0.493713  0.977063  0.724869  1
  Ni  Ni152  1  0.509781  0.994933  0.674247  1
  Ni  Ni153  1  0.798584  0.886513  0.663462  1
  Ni  Ni154  1  0.600704  0.325959  0.721136  1
  Ni  Ni155  1  0.413497  0.717165  0.723000  1
  Ni  Ni156  1  0.203117  0.133971  0.663896  1
  Ni  Ni157  1  0.296839  0.153321  0.737891  1
  Ni  Ni158  1  0.379400  0.757069  0.674209  1
  Ni  Ni159  1  0.627120  0.251979  0.672467  1
  Ni  Ni160  1  0.711395  0.837423  0.738217  1
