# generated using pymatgen
data_Zr2Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.58382883
_cell_length_b   7.19519162
_cell_length_c   50.13751408
_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   'Zr20 Ni70'
_cell_volume   2735.85882517
_cell_formula_units_Z   10
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  1.036066  0.441524  0.358818  1
  Zr  Zr2  1  1.036066  0.700403  0.310381  1
  Zr  Zr3  1  0.536066  0.286169  0.319300  1
  Zr  Zr4  1  0.536066  0.849965  0.349772  1
  Zr  Zr5  1  1.036066  0.751353  0.440928  1
  Zr  Zr6  1  1.036066  -0.000805  0.391067  1
  Zr  Zr7  1  0.536066  0.591488  0.400487  1
  Zr  Zr8  1  0.536066  0.151504  0.431491  1
  Zr  Zr9  1  1.036066  0.055115  0.523691  1
  Zr  Zr10  1  1.036066  0.293400  0.475000  1
  Zr  Zr11  1  0.536066  0.909203  0.481610  1
  Zr  Zr12  1  0.536066  0.437939  0.517143  1
  Zr  Zr13  1  1.036066  0.346139  0.607129  1
  Zr  Zr14  1  1.036066  0.587119  0.558420  1
  Zr  Zr15  1  0.536066  0.199674  0.565882  1
  Zr  Zr16  1  0.536066  0.741560  0.598168  1
  Zr  Zr17  1  1.036066  0.642004  0.688216  1
  Zr  Zr18  1  1.036066  0.886340  0.640510  1
  Zr  Zr19  1  0.536066  0.500879  0.646956  1
  Zr  Zr20  1  0.536066  0.030117  0.680618  1
  Ni  Ni21  1  1.036066  0.055496  0.325379  1
  Ni  Ni22  1  0.365730  0.491463  0.355008  1
  Ni  Ni23  1  0.372362  0.639993  0.312820  1
  Ni  Ni24  1  0.204137  0.799558  0.353067  1
  Ni  Ni25  1  0.200661  0.343679  0.312812  1
  Ni  Ni26  1  0.324762  -0.015324  0.310511  1
  Ni  Ni27  1  0.268940  0.141058  0.352884  1
  Ni  Ni28  1  0.536066  0.862795  0.282284  1
  Ni  Ni29  1  0.871470  0.343679  0.312812  1
  Ni  Ni30  1  0.867994  0.799558  0.353067  1
  Ni  Ni31  1  0.699769  0.639993  0.312820  1
  Ni  Ni32  1  0.706401  0.491463  0.355008  1
  Ni  Ni33  1  0.803191  0.141058  0.352884  1
  Ni  Ni34  1  0.747369  -0.015324  0.310511  1
  Ni  Ni35  1  1.036066  0.395164  0.424222  1
  Ni  Ni36  1  0.368610  0.792761  0.438014  1
  Ni  Ni37  1  0.365751  0.950397  0.395320  1
  Ni  Ni38  1  0.205673  0.104035  0.437474  1
  Ni  Ni39  1  0.204141  0.642553  0.396768  1
  Ni  Ni40  1  0.265143  0.297628  0.396057  1
  Ni  Ni41  1  0.327626  0.450883  0.437991  1
  Ni  Ni42  1  0.536066  0.221256  0.374733  1
  Ni  Ni43  1  0.867990  0.642553  0.396768  1
  Ni  Ni44  1  0.866458  0.104035  0.437474  1
  Ni  Ni45  1  0.706380  0.950397  0.395320  1
  Ni  Ni46  1  0.703521  0.792761  0.438014  1
  Ni  Ni47  1  0.744505  0.450883  0.437991  1
  Ni  Ni48  1  0.806988  0.297628  0.396057  1
  Ni  Ni49  1  1.036066  0.707463  0.510533  1
  Ni  Ni50  1  0.367806  0.089996  0.520725  1
  Ni  Ni51  1  0.367294  0.257723  0.478833  1
  Ni  Ni52  1  0.205025  0.408238  0.520251  1
  Ni  Ni53  1  0.203353  0.940191  0.479528  1
  Ni  Ni54  1  0.232747  0.598261  0.478394  1
  Ni  Ni55  1  0.340772  0.744476  0.518679  1
  Ni  Ni56  1  0.536066  0.557596  0.468644  1
  Ni  Ni57  1  0.868778  0.940191  0.479528  1
  Ni  Ni58  1  0.867106  0.408238  0.520251  1
  Ni  Ni59  1  0.704837  0.257723  0.478833  1
  Ni  Ni60  1  0.704325  0.089996  0.520725  1
  Ni  Ni61  1  0.731359  0.744476  0.518679  1
  Ni  Ni62  1  0.839384  0.598261  0.478394  1
  Ni  Ni63  1  1.036066  -0.002081  0.591489  1
  Ni  Ni64  1  0.366291  0.387647  0.603610  1
  Ni  Ni65  1  0.366672  0.555657  0.561359  1
  Ni  Ni66  1  0.205725  0.701913  0.602606  1
  Ni  Ni67  1  0.204721  0.238493  0.562166  1
  Ni  Ni68  1  0.234862  0.892008  0.559856  1
  Ni  Ni69  1  0.332700  0.043704  0.601998  1
  Ni  Ni70  1  0.536066  0.854777  0.550396  1
  Ni  Ni71  1  0.867410  0.238493  0.562166  1
  Ni  Ni72  1  0.866406  0.701913  0.602606  1
  Ni  Ni73  1  0.705459  0.555657  0.561359  1
  Ni  Ni74  1  0.705840  0.387647  0.603610  1
  Ni  Ni75  1  0.739431  0.043704  0.601998  1
  Ni  Ni76  1  0.837269  0.892008  0.559856  1
  Ni  Ni77  1  1.036066  0.291775  0.677087  1
  Ni  Ni78  1  0.369931  0.693936  0.685236  1
  Ni  Ni79  1  0.365605  0.852532  0.643555  1
  Ni  Ni80  1  0.201170  -0.001491  0.685740  1
  Ni  Ni81  1  0.204316  0.534053  0.645897  1
  Ni  Ni82  1  0.239483  0.194227  0.645024  1
  Ni  Ni83  1  0.350579  0.349056  0.687101  1
  Ni  Ni84  1  0.536066  0.149291  0.633421  1
  Ni  Ni85  1  0.867815  0.534053  0.645897  1
  Ni  Ni86  1  0.870961  -0.001491  0.685740  1
  Ni  Ni87  1  0.706526  0.852532  0.643555  1
  Ni  Ni88  1  0.702200  0.693936  0.685236  1
  Ni  Ni89  1  0.721552  0.349056  0.687101  1
  Ni  Ni90  1  0.832648  0.194227  0.645024  1
