# generated using pymatgen
data_Zr2Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.93145218
_cell_length_b   12.57049172
_cell_length_c   51.31780937
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ni7
_chemical_formula_sum   'Zr40 Ni140'
_cell_volume   5116.5012608
_cell_formula_units_Z   20
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  0.008617  0.236820  0.299134  1
  Zr  Zr2  1  0.008617  0.757989  0.340993  1
  Zr  Zr3  1  0.008617  0.509571  0.293000  1
  Zr  Zr4  1  0.008617  0.018644  0.335465  1
  Zr  Zr5  1  0.508617  0.257178  0.340957  1
  Zr  Zr6  1  0.508617  0.736503  0.300626  1
  Zr  Zr7  1  0.508617  0.521521  0.334987  1
  Zr  Zr8  1  0.508617  0.011532  0.294145  1
  Zr  Zr9  1  0.008617  0.274854  0.386592  1
  Zr  Zr10  1  0.008617  0.792341  0.431996  1
  Zr  Zr11  1  0.008617  0.539983  0.380329  1
  Zr  Zr12  1  0.008617  0.058215  0.425663  1
  Zr  Zr13  1  0.508617  0.292304  0.432193  1
  Zr  Zr14  1  0.508617  0.774700  0.386821  1
  Zr  Zr15  1  0.508617  0.558099  0.425863  1
  Zr  Zr16  1  0.508617  0.040360  0.380219  1
  Zr  Zr17  1  0.008617  0.310675  0.477719  1
  Zr  Zr18  1  0.008617  0.828956  0.523291  1
  Zr  Zr19  1  0.008617  0.576519  0.471215  1
  Zr  Zr20  1  0.008617  0.094800  0.516787  1
  Zr  Zr21  1  0.508617  0.329042  0.523342  1
  Zr  Zr22  1  0.508617  0.810710  0.477602  1
  Zr  Zr23  1  0.508617  0.594764  0.516904  1
  Zr  Zr24  1  0.508617  0.076432  0.471164  1
  Zr  Zr25  1  0.008617  0.347260  0.568843  1
  Zr  Zr26  1  0.008617  0.865491  0.614177  1
  Zr  Zr27  1  0.008617  0.613133  0.562509  1
  Zr  Zr28  1  0.008617  0.130621  0.607914  1
  Zr  Zr29  1  0.508617  0.365115  0.614286  1
  Zr  Zr30  1  0.508617  0.847376  0.568643  1
  Zr  Zr31  1  0.508617  0.630775  0.607684  1
  Zr  Zr32  1  0.508617  0.113171  0.562313  1
  Zr  Zr33  1  0.008617  0.386830  0.659040  1
  Zr  Zr34  1  0.008617  0.895903  0.701506  1
  Zr  Zr35  1  0.008617  0.647486  0.653513  1
  Zr  Zr36  1  0.008617  0.168655  0.695371  1
  Zr  Zr37  1  0.508617  0.393943  0.700361  1
  Zr  Zr38  1  0.508617  0.883953  0.659519  1
  Zr  Zr39  1  0.508617  0.668971  0.693880  1
  Zr  Zr40  1  0.508617  0.148296  0.653549  1
  Ni  Ni41  1  0.008617  0.390292  0.336656  1
  Ni  Ni42  1  0.008617  0.871950  0.289460  1
  Ni  Ni43  1  0.346374  0.204308  0.297065  1
  Ni  Ni44  1  0.343221  0.717701  0.343173  1
  Ni  Ni45  1  0.345343  0.542814  0.289035  1
  Ni  Ni46  1  0.341345  0.063139  0.333897  1
  Ni  Ni47  1  0.671892  0.542814  0.289035  1
  Ni  Ni48  1  0.675890  0.063139  0.333897  1
  Ni  Ni49  1  0.670861  0.204308  0.297065  1
  Ni  Ni50  1  0.674014  0.717701  0.343173  1
  Ni  Ni51  1  0.748267  0.380811  0.313879  1
  Ni  Ni52  1  0.760040  0.897449  0.359696  1
  Ni  Ni53  1  0.268967  0.380811  0.313879  1
  Ni  Ni54  1  0.257195  0.897449  0.359696  1
  Ni  Ni55  1  0.508617  0.372403  0.286228  1
  Ni  Ni56  1  0.508617  0.890848  0.337652  1
  Ni  Ni57  1  0.842893  0.217287  0.342652  1
  Ni  Ni58  1  0.845589  0.699296  0.298990  1
  Ni  Ni59  1  0.840372  0.562554  0.334059  1
  Ni  Ni60  1  0.846771  0.046741  0.290692  1
  Ni  Ni61  1  0.176863  0.562554  0.334059  1
  Ni  Ni62  1  0.170464  0.046741  0.290692  1
  Ni  Ni63  1  0.174342  0.217287  0.342652  1
  Ni  Ni64  1  0.171646  0.699296  0.298990  1
  Ni  Ni65  1  0.200577  0.363698  0.268541  1
  Ni  Ni66  1  0.259907  0.879895  0.312596  1
  Ni  Ni67  1  0.816658  0.363698  0.268541  1
  Ni  Ni68  1  0.757328  0.879895  0.312596  1
  Ni  Ni69  1  0.008617  0.425421  0.428911  1
  Ni  Ni70  1  0.008617  0.906777  0.383894  1
  Ni  Ni71  1  0.344365  0.234720  0.387965  1
  Ni  Ni72  1  0.344545  0.752634  0.433470  1
  Ni  Ni73  1  0.345079  0.579367  0.379181  1
  Ni  Ni74  1  0.344472  0.098099  0.424162  1
  Ni  Ni75  1  0.672156  0.579367  0.379181  1
  Ni  Ni76  1  0.672763  0.098099  0.424162  1
  Ni  Ni77  1  0.672870  0.234720  0.387965  1
  Ni  Ni78  1  0.672690  0.752634  0.433470  1
  Ni  Ni79  1  0.758646  0.416182  0.406134  1
  Ni  Ni80  1  0.759248  0.934387  0.451545  1
  Ni  Ni81  1  0.258589  0.416182  0.406134  1
  Ni  Ni82  1  0.257987  0.934387  0.451545  1
  Ni  Ni83  1  0.508617  0.406762  0.383567  1
  Ni  Ni84  1  0.508617  0.925548  0.428987  1
  Ni  Ni85  1  0.844756  0.252688  0.433452  1
  Ni  Ni86  1  0.844387  0.734555  0.387909  1
  Ni  Ni87  1  0.844408  0.598106  0.424197  1
  Ni  Ni88  1  0.844559  0.079675  0.379025  1
  Ni  Ni89  1  0.172827  0.598106  0.424197  1
  Ni  Ni90  1  0.172676  0.079675  0.379025  1
  Ni  Ni91  1  0.172479  0.252688  0.433452  1
  Ni  Ni92  1  0.172848  0.734555  0.387909  1
  Ni  Ni93  1  0.257353  0.397522  0.360295  1
  Ni  Ni94  1  0.260255  0.916191  0.405834  1
  Ni  Ni95  1  0.759882  0.397522  0.360295  1
  Ni  Ni96  1  0.756980  0.916191  0.405834  1
  Ni  Ni97  1  0.008617  0.461870  0.520040  1
  Ni  Ni98  1  0.008617  0.943605  0.474466  1
  Ni  Ni99  1  0.344530  0.270931  0.479145  1
  Ni  Ni100  1  0.344529  0.789214  0.524593  1
  Ni  Ni101  1  0.344529  0.616261  0.469913  1
  Ni  Ni102  1  0.344530  0.134544  0.515360  1
  Ni  Ni103  1  0.672706  0.616261  0.469913  1
  Ni  Ni104  1  0.672705  0.134544  0.515360  1
  Ni  Ni105  1  0.672705  0.270931  0.479145  1
  Ni  Ni106  1  0.672706  0.789214  0.524593  1
  Ni  Ni107  1  0.758598  0.452764  0.497331  1
  Ni  Ni108  1  0.758682  0.971059  0.542764  1
  Ni  Ni109  1  0.258637  0.452764  0.497331  1
  Ni  Ni110  1  0.258553  0.971059  0.542764  1
  Ni  Ni111  1  0.508617  0.443526  0.474569  1
  Ni  Ni112  1  0.508617  0.961948  0.519937  1
  Ni  Ni113  1  0.844545  0.289193  0.524739  1
  Ni  Ni114  1  0.844741  0.770966  0.479056  1
  Ni  Ni115  1  0.844741  0.634509  0.515450  1
  Ni  Ni116  1  0.844545  0.116281  0.469767  1
  Ni  Ni117  1  0.172494  0.634509  0.515450  1
  Ni  Ni118  1  0.172690  0.116281  0.469767  1
  Ni  Ni119  1  0.172690  0.289193  0.524739  1
  Ni  Ni120  1  0.172494  0.770966  0.479056  1
  Ni  Ni121  1  0.258553  0.434416  0.451742  1
  Ni  Ni122  1  0.258637  0.952710  0.497175  1
  Ni  Ni123  1  0.758682  0.434416  0.451742  1
  Ni  Ni124  1  0.758598  0.952710  0.497175  1
  Ni  Ni125  1  0.008617  0.498698  0.610611  1
  Ni  Ni126  1  0.008617  0.980053  0.565595  1
  Ni  Ni127  1  0.344472  0.307376  0.570343  1
  Ni  Ni128  1  0.345079  0.826107  0.615325  1
  Ni  Ni129  1  0.344545  0.652840  0.561036  1
  Ni  Ni130  1  0.344365  0.170755  0.606541  1
  Ni  Ni131  1  0.672690  0.652840  0.561036  1
  Ni  Ni132  1  0.672870  0.170755  0.606541  1
  Ni  Ni133  1  0.672763  0.307376  0.570343  1
  Ni  Ni134  1  0.672156  0.826107  0.615325  1
  Ni  Ni135  1  0.756980  0.489283  0.588671  1
  Ni  Ni136  1  0.759882  0.007953  0.634210  1
  Ni  Ni137  1  0.260255  0.489283  0.588671  1
  Ni  Ni138  1  0.257353  0.007953  0.634210  1
  Ni  Ni139  1  0.508617  0.479927  0.565518  1
  Ni  Ni140  1  0.508617  -0.001287  0.610938  1
  Ni  Ni141  1  0.844559  0.325800  0.615481  1
  Ni  Ni142  1  0.844408  0.807369  0.570308  1
  Ni  Ni143  1  0.844387  0.670920  0.606596  1
  Ni  Ni144  1  0.844756  0.152787  0.561053  1
  Ni  Ni145  1  0.172848  0.670920  0.606596  1
  Ni  Ni146  1  0.172479  0.152787  0.561053  1
  Ni  Ni147  1  0.172676  0.325800  0.615481  1
  Ni  Ni148  1  0.172827  0.807369  0.570308  1
  Ni  Ni149  1  0.257987  0.471087  0.542961  1
  Ni  Ni150  1  0.258589  0.989292  0.588372  1
  Ni  Ni151  1  0.759248  0.471087  0.542961  1
  Ni  Ni152  1  0.758646  0.989292  0.588372  1
  Ni  Ni153  1  0.008617  0.533524  0.705046  1
  Ni  Ni154  1  0.008617  0.015183  0.657850  1
  Ni  Ni155  1  0.341345  0.342336  0.660609  1
  Ni  Ni156  1  0.345343  0.862660  0.705470  1
  Ni  Ni157  1  0.343221  0.687773  0.651333  1
  Ni  Ni158  1  0.346374  0.201167  0.697441  1
  Ni  Ni159  1  0.674014  0.687773  0.651333  1
  Ni  Ni160  1  0.670861  0.201167  0.697441  1
  Ni  Ni161  1  0.675890  0.342336  0.660609  1
  Ni  Ni162  1  0.671892  0.862660  0.705470  1
  Ni  Ni163  1  0.757328  0.525579  0.681910  1
  Ni  Ni164  1  0.816658  0.041777  0.725964  1
  Ni  Ni165  1  0.259907  0.525579  0.681910  1
  Ni  Ni166  1  0.200577  0.041777  0.725964  1
  Ni  Ni167  1  0.508617  0.514626  0.656853  1
  Ni  Ni168  1  0.508617  0.033071  0.708277  1
  Ni  Ni169  1  0.846771  0.358734  0.703813  1
  Ni  Ni170  1  0.840372  0.842921  0.660447  1
  Ni  Ni171  1  0.845589  0.706178  0.695515  1
  Ni  Ni172  1  0.842893  0.188187  0.651853  1
  Ni  Ni173  1  0.171646  0.706178  0.695515  1
  Ni  Ni174  1  0.174342  0.188187  0.651853  1
  Ni  Ni175  1  0.170464  0.358734  0.703813  1
  Ni  Ni176  1  0.176863  0.842921  0.660447  1
  Ni  Ni177  1  0.257195  0.508026  0.634810  1
  Ni  Ni178  1  0.268967  0.024663  0.680626  1
  Ni  Ni179  1  0.760040  0.508026  0.634810  1
  Ni  Ni180  1  0.748267  0.024663  0.680626  1
