# generated using pymatgen
data_ZrNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.80526001
_cell_length_b   5.26931185
_cell_length_c   47.49191196
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrNi
_chemical_formula_sum   'Zr32 Ni32'
_cell_volume   2453.76332102
_cell_formula_units_Z   32
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  0.640853  0.327433  0.293615  1
  Zr  Zr2  1  0.861741  0.827433  0.293615  1
  Zr  Zr3  1  0.138256  0.113077  0.320390  1
  Zr  Zr4  1  0.364337  0.613077  0.320390  1
  Zr  Zr5  1  0.638454  0.874958  0.346587  1
  Zr  Zr6  1  0.864139  0.374958  0.346587  1
  Zr  Zr7  1  0.138478  0.640184  0.373566  1
  Zr  Zr8  1  0.364115  0.140184  0.373566  1
  Zr  Zr9  1  0.639131  0.409271  0.402240  1
  Zr  Zr10  1  0.863462  0.909271  0.402240  1
  Zr  Zr11  1  0.139622  0.180019  0.430109  1
  Zr  Zr12  1  0.362971  0.680019  0.430109  1
  Zr  Zr13  1  0.639240  0.949024  0.458100  1
  Zr  Zr14  1  0.863353  0.449024  0.458100  1
  Zr  Zr15  1  0.139022  0.718038  0.485783  1
  Zr  Zr16  1  0.363571  0.218038  0.485783  1
  Zr  Zr17  1  0.639022  0.486721  0.513651  1
  Zr  Zr18  1  0.863571  0.986721  0.513651  1
  Zr  Zr19  1  0.139240  0.255735  0.541333  1
  Zr  Zr20  1  0.363353  0.755735  0.541333  1
  Zr  Zr21  1  0.639622  0.024741  0.569325  1
  Zr  Zr22  1  0.862971  0.524741  0.569325  1
  Zr  Zr23  1  0.139131  0.795489  0.597194  1
  Zr  Zr24  1  0.363462  0.295489  0.597194  1
  Zr  Zr25  1  0.638478  0.564576  0.625868  1
  Zr  Zr26  1  0.864115  0.064576  0.625868  1
  Zr  Zr27  1  0.138454  0.329801  0.652847  1
  Zr  Zr28  1  0.364139  0.829801  0.652847  1
  Zr  Zr29  1  0.638256  0.091682  0.679044  1
  Zr  Zr30  1  0.864337  0.591682  0.679044  1
  Zr  Zr31  1  0.140853  0.877326  0.705819  1
  Zr  Zr32  1  0.361741  0.377326  0.705819  1
  Ni  Ni33  1  0.922763  0.322497  0.291032  1
  Ni  Ni34  1  0.579831  0.822497  0.291032  1
  Ni  Ni35  1  0.420098  0.108157  0.317524  1
  Ni  Ni36  1  0.082495  0.608157  0.317524  1
  Ni  Ni37  1  0.924433  0.875988  0.346371  1
  Ni  Ni38  1  0.578161  0.375988  0.346371  1
  Ni  Ni39  1  0.421163  0.641097  0.374882  1
  Ni  Ni40  1  0.081431  0.141097  0.374882  1
  Ni  Ni41  1  0.921843  0.408887  0.402715  1
  Ni  Ni42  1  0.580750  0.908887  0.402715  1
  Ni  Ni43  1  0.421713  0.179939  0.429918  1
  Ni  Ni44  1  0.080880  0.679939  0.429918  1
  Ni  Ni45  1  0.922154  0.949109  0.457820  1
  Ni  Ni46  1  0.580439  0.449109  0.457820  1
  Ni  Ni47  1  0.421957  0.718069  0.485717  1
  Ni  Ni48  1  0.080636  0.218069  0.485717  1
  Ni  Ni49  1  0.921957  0.486690  0.513716  1
  Ni  Ni50  1  0.580636  0.986690  0.513716  1
  Ni  Ni51  1  0.422154  0.255650  0.541614  1
  Ni  Ni52  1  0.080439  0.755650  0.541614  1
  Ni  Ni53  1  0.921713  0.024821  0.569516  1
  Ni  Ni54  1  0.580880  0.524821  0.569516  1
  Ni  Ni55  1  0.421843  0.795872  0.596719  1
  Ni  Ni56  1  0.080750  0.295872  0.596719  1
  Ni  Ni57  1  0.921163  0.563662  0.624552  1
  Ni  Ni58  1  0.581431  0.063662  0.624552  1
  Ni  Ni59  1  0.424433  0.328772  0.653063  1
  Ni  Ni60  1  0.078161  0.828772  0.653063  1
  Ni  Ni61  1  0.920098  0.096603  0.681910  1
  Ni  Ni62  1  0.582495  0.596603  0.681910  1
  Ni  Ni63  1  0.422763  0.882262  0.708401  1
  Ni  Ni64  1  0.079831  0.382262  0.708401  1
