# generated using pymatgen
data_Zr2Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.57599581
_cell_length_b   12.93691928
_cell_length_c   51.25512485
_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   5023.51715667
_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  1.036620  0.234372  0.353109  1
  Zr  Zr2  1  1.036620  0.720791  0.304165  1
  Zr  Zr3  1  1.036620  0.431359  0.316675  1
  Zr  Zr4  1  1.036620  0.934690  0.274726  1
  Zr  Zr5  1  0.536620  0.220791  0.304165  1
  Zr  Zr6  1  0.536620  0.734372  0.353109  1
  Zr  Zr7  1  0.536620  0.434690  0.274726  1
  Zr  Zr8  1  0.536620  0.931359  0.316675  1
  Zr  Zr9  1  1.036620  0.295532  0.440945  1
  Zr  Zr10  1  1.036620  0.768468  0.396642  1
  Zr  Zr11  1  1.036620  0.492319  0.406756  1
  Zr  Zr12  1  1.036620  0.966384  0.361663  1
  Zr  Zr13  1  0.536620  0.268468  0.396642  1
  Zr  Zr14  1  0.536620  0.795532  0.440945  1
  Zr  Zr15  1  0.536620  0.466384  0.361663  1
  Zr  Zr16  1  0.536620  -0.007681  0.406756  1
  Zr  Zr17  1  1.036620  0.360125  0.532149  1
  Zr  Zr18  1  1.036620  0.831933  0.486333  1
  Zr  Zr19  1  1.036620  0.544919  0.497650  1
  Zr  Zr20  1  1.036620  0.022707  0.451001  1
  Zr  Zr21  1  0.536620  0.331933  0.486333  1
  Zr  Zr22  1  0.536620  0.860125  0.532149  1
  Zr  Zr23  1  0.536620  0.522707  0.451001  1
  Zr  Zr24  1  0.536620  0.044919  0.497650  1
  Zr  Zr25  1  1.036620  0.414909  0.622873  1
  Zr  Zr26  1  1.036620  0.888151  0.577428  1
  Zr  Zr27  1  1.036620  0.601300  0.587984  1
  Zr  Zr28  1  1.036620  0.072613  0.542920  1
  Zr  Zr29  1  0.536620  0.388151  0.577428  1
  Zr  Zr30  1  0.536620  0.914909  0.622873  1
  Zr  Zr31  1  0.536620  0.572613  0.542920  1
  Zr  Zr32  1  0.536620  0.101300  0.587984  1
  Zr  Zr33  1  1.036620  0.458899  0.710162  1
  Zr  Zr34  1  1.036620  0.947638  0.666200  1
  Zr  Zr35  1  1.036620  0.653556  0.677932  1
  Zr  Zr36  1  1.036620  0.135447  0.631856  1
  Zr  Zr37  1  0.536620  0.447638  0.666200  1
  Zr  Zr38  1  0.536620  0.958899  0.710162  1
  Zr  Zr39  1  0.536620  0.635447  0.631856  1
  Zr  Zr40  1  0.536620  0.153556  0.677932  1
  Ni  Ni41  1  1.036620  0.083168  0.301505  1
  Ni  Ni42  1  1.036620  0.515719  0.254374  1
  Ni  Ni43  1  0.368565  0.271486  0.349380  1
  Ni  Ni44  1  0.369678  0.742254  0.305844  1
  Ni  Ni45  1  0.370508  0.408175  0.317207  1
  Ni  Ni46  1  0.366531  0.871973  0.273410  1
  Ni  Ni47  1  0.206708  0.371973  0.273410  1
  Ni  Ni48  1  0.202732  0.908175  0.317207  1
  Ni  Ni49  1  0.203561  0.242254  0.305844  1
  Ni  Ni50  1  0.204675  0.771486  0.349380  1
  Ni  Ni51  1  0.339006  0.059044  0.287565  1
  Ni  Ni52  1  0.321920  0.584760  0.332279  1
  Ni  Ni53  1  0.251320  0.084760  0.332279  1
  Ni  Ni54  1  0.234234  0.559044  0.287565  1
  Ni  Ni55  1  0.536620  0.015719  0.254374  1
  Ni  Ni56  1  0.536620  0.583168  0.301505  1
  Ni  Ni57  1  0.869678  0.242254  0.305844  1
  Ni  Ni58  1  0.868565  0.771486  0.349380  1
  Ni  Ni59  1  0.866531  0.371973  0.273410  1
  Ni  Ni60  1  0.870508  0.908175  0.317207  1
  Ni  Ni61  1  0.702732  0.408175  0.317207  1
  Ni  Ni62  1  0.706708  0.871973  0.273410  1
  Ni  Ni63  1  0.704675  0.271486  0.349380  1
  Ni  Ni64  1  0.703561  0.742254  0.305844  1
  Ni  Ni65  1  0.821920  0.084760  0.332279  1
  Ni  Ni66  1  0.839006  0.559044  0.287565  1
  Ni  Ni67  1  0.734234  0.059044  0.287565  1
  Ni  Ni68  1  0.751320  0.584760  0.332279  1
  Ni  Ni69  1  1.036620  0.129716  0.402163  1
  Ni  Ni70  1  1.036620  0.603774  0.347608  1
  Ni  Ni71  1  0.368340  0.326683  0.440471  1
  Ni  Ni72  1  0.366160  0.797874  0.395098  1
  Ni  Ni73  1  0.366196  0.462741  0.408187  1
  Ni  Ni74  1  0.369555  0.934006  0.362610  1
  Ni  Ni75  1  0.203685  0.434006  0.362610  1
  Ni  Ni76  1  0.207044  0.962741  0.408187  1
  Ni  Ni77  1  0.207079  0.297874  0.395098  1
  Ni  Ni78  1  0.204900  0.826683  0.440471  1
  Ni  Ni79  1  0.308356  0.115390  0.378291  1
  Ni  Ni80  1  0.262360  0.645177  0.424765  1
  Ni  Ni81  1  0.310879  0.145177  0.424765  1
  Ni  Ni82  1  0.264883  0.615390  0.378291  1
  Ni  Ni83  1  0.536620  0.103774  0.347608  1
  Ni  Ni84  1  0.536620  0.629716  0.402163  1
  Ni  Ni85  1  0.866160  0.297874  0.395098  1
  Ni  Ni86  1  0.868340  0.826683  0.440471  1
  Ni  Ni87  1  0.869555  0.434006  0.362610  1
  Ni  Ni88  1  0.866196  0.962741  0.408187  1
  Ni  Ni89  1  0.707044  0.462741  0.408187  1
  Ni  Ni90  1  0.703685  0.934006  0.362610  1
  Ni  Ni91  1  0.704900  0.326683  0.440471  1
  Ni  Ni92  1  0.707079  0.797874  0.395098  1
  Ni  Ni93  1  0.762360  0.145177  0.424765  1
  Ni  Ni94  1  0.808356  0.615390  0.378291  1
  Ni  Ni95  1  0.764883  0.115390  0.378291  1
  Ni  Ni96  1  0.810879  0.645177  0.424765  1
  Ni  Ni97  1  1.036620  0.192937  0.503468  1
  Ni  Ni98  1  1.036620  0.662481  0.455817  1
  Ni  Ni99  1  0.368808  0.382894  0.530719  1
  Ni  Ni100  1  0.369502  0.853581  0.485648  1
  Ni  Ni101  1  0.368117  0.521910  0.499310  1
  Ni  Ni102  1  0.367833  -0.008645  0.454244  1
  Ni  Ni103  1  0.205407  0.491355  0.454244  1
  Ni  Ni104  1  0.205123  0.021910  0.499310  1
  Ni  Ni105  1  0.203737  0.353581  0.485648  1
  Ni  Ni106  1  0.204431  0.882894  0.530719  1
  Ni  Ni107  1  0.242658  0.174258  0.470082  1
  Ni  Ni108  1  0.232910  0.702673  0.514071  1
  Ni  Ni109  1  0.340329  0.202673  0.514071  1
  Ni  Ni110  1  0.330582  0.674258  0.470082  1
  Ni  Ni111  1  0.536620  0.162481  0.455817  1
  Ni  Ni112  1  0.536620  0.692937  0.503468  1
  Ni  Ni113  1  0.869502  0.353581  0.485648  1
  Ni  Ni114  1  0.868808  0.882894  0.530719  1
  Ni  Ni115  1  0.867833  0.491355  0.454244  1
  Ni  Ni116  1  0.868117  0.021910  0.499310  1
  Ni  Ni117  1  0.705123  0.521910  0.499310  1
  Ni  Ni118  1  0.705407  -0.008645  0.454244  1
  Ni  Ni119  1  0.704431  0.382894  0.530719  1
  Ni  Ni120  1  0.703737  0.853581  0.485648  1
  Ni  Ni121  1  0.732910  0.202673  0.514071  1
  Ni  Ni122  1  0.742658  0.674258  0.470082  1
  Ni  Ni123  1  0.830582  0.174258  0.470082  1
  Ni  Ni124  1  0.840329  0.702673  0.514071  1
  Ni  Ni125  1  1.036620  0.252207  0.592070  1
  Ni  Ni126  1  1.036620  0.721989  0.548551  1
  Ni  Ni127  1  0.367678  0.440194  0.621020  1
  Ni  Ni128  1  0.367597  0.911932  0.576048  1
  Ni  Ni129  1  0.366992  0.580656  0.589334  1
  Ni  Ni130  1  0.367549  0.051432  0.544541  1
  Ni  Ni131  1  0.205691  0.551432  0.544541  1
  Ni  Ni132  1  0.206248  0.080656  0.589334  1
  Ni  Ni133  1  0.205643  0.411932  0.576048  1
  Ni  Ni134  1  0.205562  0.940194  0.621020  1
  Ni  Ni135  1  0.236089  0.231299  0.558536  1
  Ni  Ni136  1  0.236670  0.759586  0.604110  1
  Ni  Ni137  1  0.336569  0.259586  0.604110  1
  Ni  Ni138  1  0.337150  0.731299  0.558536  1
  Ni  Ni139  1  0.536620  0.221989  0.548551  1
  Ni  Ni140  1  0.536620  0.752207  0.592070  1
  Ni  Ni141  1  0.867597  0.411932  0.576048  1
  Ni  Ni142  1  0.867678  0.940194  0.621020  1
  Ni  Ni143  1  0.867549  0.551432  0.544541  1
  Ni  Ni144  1  0.866992  0.080656  0.589334  1
  Ni  Ni145  1  0.706248  0.580656  0.589334  1
  Ni  Ni146  1  0.705691  0.051432  0.544541  1
  Ni  Ni147  1  0.705562  0.440194  0.621020  1
  Ni  Ni148  1  0.705643  0.911932  0.576048  1
  Ni  Ni149  1  0.736670  0.259586  0.604110  1
  Ni  Ni150  1  0.736089  0.731299  0.558536  1
  Ni  Ni151  1  0.837150  0.231299  0.558536  1
  Ni  Ni152  1  0.836569  0.759586  0.604110  1
  Ni  Ni153  1  1.036620  0.300094  0.684126  1
  Ni  Ni154  1  1.036620  0.775758  0.638496  1
  Ni  Ni155  1  0.370798  0.501264  0.709773  1
  Ni  Ni156  1  0.367742  0.967698  0.666817  1
  Ni  Ni157  1  0.368865  0.637859  0.679375  1
  Ni  Ni158  1  0.366361  0.107648  0.634634  1
  Ni  Ni159  1  0.206879  0.607648  0.634634  1
  Ni  Ni160  1  0.204374  0.137859  0.679375  1
  Ni  Ni161  1  0.205498  0.467698  0.666817  1
  Ni  Ni162  1  0.202441  0.001264  0.709773  1
  Ni  Ni163  1  0.240870  0.290020  0.650497  1
  Ni  Ni164  1  0.222213  0.819070  0.696422  1
  Ni  Ni165  1  0.351027  0.319070  0.696422  1
  Ni  Ni166  1  0.332369  0.790020  0.650497  1
  Ni  Ni167  1  0.536620  0.275758  0.638496  1
  Ni  Ni168  1  0.536620  0.800094  0.684126  1
  Ni  Ni169  1  0.867742  0.467698  0.666817  1
  Ni  Ni170  1  0.870798  0.001264  0.709773  1
  Ni  Ni171  1  0.866361  0.607648  0.634634  1
  Ni  Ni172  1  0.868865  0.137859  0.679375  1
  Ni  Ni173  1  0.704374  0.637859  0.679375  1
  Ni  Ni174  1  0.706879  0.107648  0.634634  1
  Ni  Ni175  1  0.702441  0.501264  0.709773  1
  Ni  Ni176  1  0.705498  0.967698  0.666817  1
  Ni  Ni177  1  0.722213  0.319070  0.696422  1
  Ni  Ni178  1  0.740870  0.790020  0.650497  1
  Ni  Ni179  1  0.832369  0.290020  0.650497  1
  Ni  Ni180  1  0.851027  0.819070  0.696422  1
