# generated using pymatgen
data_FeNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.52448610
_cell_length_b   3.36219430
_cell_length_c   45.43351682
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi
_chemical_formula_sum   'Fe8 Ni8'
_cell_volume   385.631184337
_cell_formula_units_Z   8
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
  Fe  Fe1  1  0.495896  0.512477  0.315497  1
  Fe  Fe2  1  0.495896  0.512477  0.370913  1
  Fe  Fe3  1  0.495896  0.512477  0.426461  1
  Fe  Fe4  1  0.495896  0.512477  0.482029  1
  Fe  Fe5  1  0.495896  0.512477  0.537598  1
  Fe  Fe6  1  0.495896  0.512477  0.593164  1
  Fe  Fe7  1  0.495896  0.512477  0.648734  1
  Fe  Fe8  1  0.495896  0.512477  0.704901  1
  Ni  Ni9  1  -0.004104  1.012477  0.288017  1
  Ni  Ni10  1  -0.004104  1.012477  0.343029  1
  Ni  Ni11  1  -0.004104  0.012477  0.398673  1
  Ni  Ni12  1  -0.004104  1.012477  0.454244  1
  Ni  Ni13  1  -0.004104  0.012477  0.509814  1
  Ni  Ni14  1  -0.004104  1.012477  0.565383  1
  Ni  Ni15  1  -0.004104  0.012477  0.620971  1
  Ni  Ni16  1  -0.004104  1.012477  0.676167  1
