# generated using pymatgen
data_Zr2Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.94763871
_cell_length_b   6.48590743
_cell_length_c   49.64921302
_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   2559.30020405
_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  0.007582  0.585470  0.309286  1
  Zr  Zr2  1  0.007582  0.074454  0.327402  1
  Zr  Zr3  1  0.507582  0.482933  0.356088  1
  Zr  Zr4  1  0.507582  0.173413  0.287892  1
  Zr  Zr5  1  0.007582  0.389275  0.400600  1
  Zr  Zr6  1  0.007582  0.888373  0.418337  1
  Zr  Zr7  1  0.507582  0.291882  0.446255  1
  Zr  Zr8  1  0.507582  0.979888  0.373441  1
  Zr  Zr9  1  0.007582  0.195317  0.491783  1
  Zr  Zr10  1  0.007582  0.693695  0.509960  1
  Zr  Zr11  1  0.507582  0.098242  0.537335  1
  Zr  Zr12  1  0.507582  0.789902  0.464348  1
  Zr  Zr13  1  0.007582  0.003163  0.583025  1
  Zr  Zr14  1  0.007582  0.501822  0.600571  1
  Zr  Zr15  1  0.507582  0.909030  0.629040  1
  Zr  Zr16  1  0.507582  0.597182  0.555344  1
  Zr  Zr17  1  0.007582  0.820884  0.671883  1
  Zr  Zr18  1  0.007582  0.323570  0.688934  1
  Zr  Zr19  1  0.507582  0.726199  0.714253  1
  Zr  Zr20  1  0.507582  0.405865  0.645868  1
  Ni  Ni21  1  0.007582  0.941349  0.270039  1
  Ni  Ni22  1  0.346356  0.503897  0.309074  1
  Ni  Ni23  1  0.341796  0.150379  0.330785  1
  Ni  Ni24  1  0.673367  0.150379  0.330785  1
  Ni  Ni25  1  0.668807  0.503897  0.309074  1
  Ni  Ni26  1  0.758779  0.781954  0.340197  1
  Ni  Ni27  1  0.256384  0.781954  0.340197  1
  Ni  Ni28  1  0.507582  0.832340  0.318425  1
  Ni  Ni29  1  0.845556  0.410132  0.352325  1
  Ni  Ni30  1  0.844177  0.247581  0.287480  1
  Ni  Ni31  1  0.170986  0.247581  0.287480  1
  Ni  Ni32  1  0.169607  0.410132  0.352325  1
  Ni  Ni33  1  0.256644  0.879381  0.293304  1
  Ni  Ni34  1  0.758519  0.879381  0.293304  1
  Ni  Ni35  1  0.007582  0.734123  0.364054  1
  Ni  Ni36  1  0.342185  0.310932  0.398751  1
  Ni  Ni37  1  0.343421  0.961967  0.421077  1
  Ni  Ni38  1  0.671742  0.961967  0.421077  1
  Ni  Ni39  1  0.672978  0.310932  0.398751  1
  Ni  Ni40  1  0.759087  0.590070  0.432360  1
  Ni  Ni41  1  0.256077  0.590070  0.432360  1
  Ni  Ni42  1  0.507582  0.636348  0.410080  1
  Ni  Ni43  1  0.843938  0.216252  0.443947  1
  Ni  Ni44  1  0.843374  0.059242  0.375216  1
  Ni  Ni45  1  0.171789  0.059242  0.375216  1
  Ni  Ni46  1  0.171225  0.216252  0.443947  1
  Ni  Ni47  1  0.258210  0.685722  0.386565  1
  Ni  Ni48  1  0.756953  0.685722  0.386565  1
  Ni  Ni49  1  0.007582  0.541350  0.455353  1
  Ni  Ni50  1  0.343448  0.119326  0.489452  1
  Ni  Ni51  1  0.343454  0.769496  0.512147  1
  Ni  Ni52  1  0.671709  0.769496  0.512147  1
  Ni  Ni53  1  0.671715  0.119326  0.489452  1
  Ni  Ni54  1  0.757501  0.396003  0.523590  1
  Ni  Ni55  1  0.257662  0.396003  0.523590  1
  Ni  Ni56  1  0.507582  0.444283  0.500788  1
  Ni  Ni57  1  0.843604  0.022758  0.535130  1
  Ni  Ni58  1  0.843932  0.866415  0.466490  1
  Ni  Ni59  1  0.171231  0.866415  0.466490  1
  Ni  Ni60  1  0.171559  0.022758  0.535130  1
  Ni  Ni61  1  0.257640  0.493037  0.478011  1
  Ni  Ni62  1  0.757523  0.493037  0.478011  1
  Ni  Ni63  1  0.007582  0.348341  0.546381  1
  Ni  Ni64  1  0.343994  0.926672  0.580898  1
  Ni  Ni65  1  0.343609  0.578057  0.602936  1
  Ni  Ni66  1  0.671554  0.578057  0.602936  1
  Ni  Ni67  1  0.671169  0.926672  0.580898  1
  Ni  Ni68  1  0.756490  0.204625  0.615064  1
  Ni  Ni69  1  0.258673  0.204625  0.615064  1
  Ni  Ni70  1  0.507582  0.252127  0.591663  1
  Ni  Ni71  1  0.841961  0.834352  0.625778  1
  Ni  Ni72  1  0.843111  0.673641  0.557714  1
  Ni  Ni73  1  0.172052  0.673641  0.557714  1
  Ni  Ni74  1  0.173202  0.834352  0.625778  1
  Ni  Ni75  1  0.257260  0.299077  0.569158  1
  Ni  Ni76  1  0.757903  0.299077  0.569158  1
  Ni  Ni77  1  0.007582  0.159354  0.637416  1
  Ni  Ni78  1  0.340058  0.742618  0.671506  1
  Ni  Ni79  1  0.346197  0.388788  0.693034  1
  Ni  Ni80  1  0.668966  0.388788  0.693034  1
  Ni  Ni81  1  0.675105  0.742618  0.671506  1
  Ni  Ni82  1  0.787632  0.015008  0.708568  1
  Ni  Ni83  1  0.227531  0.015008  0.708568  1
  Ni  Ni84  1  0.507582  0.057976  0.686268  1
  Ni  Ni85  1  0.846554  0.645495  0.713944  1
  Ni  Ni86  1  0.841163  0.485662  0.648244  1
  Ni  Ni87  1  0.174000  0.485662  0.648244  1
  Ni  Ni88  1  0.168609  0.645495  0.713944  1
  Ni  Ni89  1  0.261550  0.110994  0.661552  1
  Ni  Ni90  1  0.753613  0.110994  0.661552  1
