# generated using pymatgen
data_Zr2Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.18975671
_cell_length_b   8.72439062
_cell_length_c   49.05744424
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   69.68539791
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ni7
_chemical_formula_sum   'Zr28 Ni98'
_cell_volume   3688.53992125
_cell_formula_units_Z   14
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  0.388640  0.756294  0.295382  1
  Zr  Zr2  1  0.356193  0.117855  0.310104  1
  Zr  Zr3  1  0.888640  0.756294  0.295382  1
  Zr  Zr4  1  0.856193  0.117855  0.310104  1
  Zr  Zr5  1  0.240213  0.444422  0.352869  1
  Zr  Zr6  1  0.202753  0.808175  0.372390  1
  Zr  Zr7  1  0.740213  0.444422  0.352869  1
  Zr  Zr8  1  0.702753  0.808175  0.372390  1
  Zr  Zr9  1  0.090696  0.137961  0.416395  1
  Zr  Zr10  1  0.047434  0.498999  0.433752  1
  Zr  Zr11  1  0.590696  0.137961  0.416395  1
  Zr  Zr12  1  0.547434  0.498999  0.433752  1
  Zr  Zr13  1  0.939084  0.818190  0.479954  1
  Zr  Zr14  1  0.886288  0.181230  0.496339  1
  Zr  Zr15  1  0.439084  0.818190  0.479954  1
  Zr  Zr16  1  0.386288  0.181230  0.496339  1
  Zr  Zr17  1  0.779455  0.499222  0.542763  1
  Zr  Zr18  1  0.733877  0.860486  0.559714  1
  Zr  Zr19  1  0.279455  0.499222  0.542763  1
  Zr  Zr20  1  0.233877  0.860486  0.559714  1
  Zr  Zr21  1  0.620056  0.189589  0.603989  1
  Zr  Zr22  1  0.587819  0.550307  0.623393  1
  Zr  Zr23  1  0.120056  0.189589  0.603989  1
  Zr  Zr24  1  0.087819  0.550307  0.623393  1
  Zr  Zr25  1  0.471866  0.879181  0.665393  1
  Zr  Zr26  1  0.443378  0.245428  0.684051  1
  Zr  Zr27  1  0.971866  0.879181  0.665393  1
  Zr  Zr28  1  0.943378  0.245428  0.684051  1
  Ni  Ni29  1  0.364796  0.449775  0.296153  1
  Ni  Ni30  1  0.658830  0.692086  0.319499  1
  Ni  Ni31  1  0.650451  0.969306  0.324906  1
  Ni  Ni32  1  0.596033  0.166539  0.284057  1
  Ni  Ni33  1  0.597161  0.885847  0.279717  1
  Ni  Ni34  1  0.618427  0.449309  0.296366  1
  Ni  Ni35  1  0.541593  0.290227  0.328990  1
  Ni  Ni36  1  0.864796  0.449775  0.296153  1
  Ni  Ni37  1  0.158830  0.692086  0.319499  1
  Ni  Ni38  1  0.150451  0.969306  0.324906  1
  Ni  Ni39  1  0.096033  0.166539  0.284057  1
  Ni  Ni40  1  0.097161  0.885847  0.279717  1
  Ni  Ni41  1  0.118427  0.449309  0.296366  1
  Ni  Ni42  1  0.041593  0.290227  0.328990  1
  Ni  Ni43  1  0.219819  0.135166  0.361641  1
  Ni  Ni44  1  0.507273  0.388117  0.379803  1
  Ni  Ni45  1  0.499355  0.663025  0.386283  1
  Ni  Ni46  1  0.433976  0.867132  0.345361  1
  Ni  Ni47  1  0.444515  0.588171  0.338738  1
  Ni  Ni48  1  0.474335  0.127949  0.362548  1
  Ni  Ni49  1  0.388967  0.975205  0.393880  1
  Ni  Ni50  1  0.719819  0.135166  0.361641  1
  Ni  Ni51  1  0.007273  0.388117  0.379803  1
  Ni  Ni52  1  0.999355  0.663025  0.386283  1
  Ni  Ni53  1  0.933976  0.867132  0.345361  1
  Ni  Ni54  1  0.944515  0.588171  0.338738  1
  Ni  Ni55  1  0.974335  0.127949  0.362548  1
  Ni  Ni56  1  0.888967  0.975205  0.393880  1
  Ni  Ni57  1  0.073664  0.822750  0.424678  1
  Ni  Ni58  1  0.358236  0.074853  0.443426  1
  Ni  Ni59  1  0.339809  0.351945  0.448608  1
  Ni  Ni60  1  0.282700  0.559126  0.407281  1
  Ni  Ni61  1  0.293996  0.284331  0.401215  1
  Ni  Ni62  1  0.327052  0.813020  0.426494  1
  Ni  Ni63  1  0.238955  0.659363  0.456931  1
  Ni  Ni64  1  0.573664  0.822750  0.424678  1
  Ni  Ni65  1  0.858236  0.074853  0.443426  1
  Ni  Ni66  1  0.839809  0.351945  0.448608  1
  Ni  Ni67  1  0.782700  0.559126  0.407281  1
  Ni  Ni68  1  0.793996  0.284331  0.401215  1
  Ni  Ni69  1  0.827052  0.813020  0.426494  1
  Ni  Ni70  1  0.738955  0.659363  0.456931  1
  Ni  Ni71  1  0.913113  0.499095  0.488272  1
  Ni  Ni72  1  0.204595  0.753849  0.506801  1
  Ni  Ni73  1  0.181337  0.032430  0.511724  1
  Ni  Ni74  1  0.121368  0.245045  0.469563  1
  Ni  Ni75  1  0.143395  0.967100  0.464558  1
  Ni  Ni76  1  0.162920  0.499519  0.488191  1
  Ni  Ni77  1  0.088037  0.339131  0.519575  1
  Ni  Ni78  1  0.413113  0.499095  0.488272  1
  Ni  Ni79  1  0.704595  0.753849  0.506801  1
  Ni  Ni80  1  0.681337  0.032430  0.511724  1
  Ni  Ni81  1  0.621368  0.245045  0.469563  1
  Ni  Ni82  1  0.643395  0.967100  0.464558  1
  Ni  Ni83  1  0.662920  0.499519  0.488191  1
  Ni  Ni84  1  0.588037  0.339131  0.519575  1
  Ni  Ni85  1  0.750896  0.175181  0.551992  1
  Ni  Ni86  1  0.044095  0.438737  0.569206  1
  Ni  Ni87  1  0.031048  0.713763  0.575103  1
  Ni  Ni88  1  0.966144  0.924527  0.532768  1
  Ni  Ni89  1  0.986755  0.646595  0.527769  1
  Ni  Ni90  1  0.997112  0.186198  0.549836  1
  Ni  Ni91  1  0.935824  0.023367  0.582392  1
  Ni  Ni92  1  0.250896  0.175181  0.551992  1
  Ni  Ni93  1  0.544095  0.438737  0.569206  1
  Ni  Ni94  1  0.531048  0.713763  0.575103  1
  Ni  Ni95  1  0.466144  0.924527  0.532768  1
  Ni  Ni96  1  0.486755  0.646595  0.527769  1
  Ni  Ni97  1  0.497112  0.186198  0.549836  1
  Ni  Ni98  1  0.435824  0.023367  0.582392  1
  Ni  Ni99  1  0.604059  0.862406  0.614295  1
  Ni  Ni100  1  0.887964  0.131902  0.631362  1
  Ni  Ni101  1  0.885392  0.407045  0.638462  1
  Ni  Ni102  1  0.819139  0.608568  0.596595  1
  Ni  Ni103  1  0.826221  0.334382  0.590296  1
  Ni  Ni104  1  0.849167  0.871514  0.613357  1
  Ni  Ni105  1  0.784082  0.709694  0.646663  1
  Ni  Ni106  1  0.104059  0.862406  0.614295  1
  Ni  Ni107  1  0.387964  0.131902  0.631362  1
  Ni  Ni108  1  0.385392  0.407045  0.638462  1
  Ni  Ni109  1  0.319139  0.608568  0.596595  1
  Ni  Ni110  1  0.326221  0.334382  0.590296  1
  Ni  Ni111  1  0.349167  0.871514  0.613357  1
  Ni  Ni112  1  0.284082  0.709694  0.646663  1
  Ni  Ni113  1  0.462887  0.556811  0.679779  1
  Ni  Ni114  1  0.729754  0.827862  0.692122  1
  Ni  Ni115  1  0.742941  0.093190  0.695854  1
  Ni  Ni116  1  0.671570  0.305875  0.659183  1
  Ni  Ni117  1  0.671462  0.029956  0.651056  1
  Ni  Ni118  1  0.711417  0.551709  0.679740  1
  Ni  Ni119  1  0.650342  0.368947  0.711949  1
  Ni  Ni120  1  0.962887  0.556811  0.679779  1
  Ni  Ni121  1  0.229754  0.827862  0.692122  1
  Ni  Ni122  1  0.242941  0.093190  0.695854  1
  Ni  Ni123  1  0.171570  0.305875  0.659183  1
  Ni  Ni124  1  0.171462  0.029956  0.651056  1
  Ni  Ni125  1  0.211417  0.551709  0.679740  1
  Ni  Ni126  1  0.150342  0.368947  0.711949  1
