# generated using pymatgen
data_FeNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.49121321
_cell_length_b   2.49121321
_cell_length_c   48.68944746
_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   'Fe6 Ni6'
_cell_volume   302.17368684
_cell_formula_units_Z   6
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  0.502519  0.502519  0.334781  1
  Fe  Fe2  1  0.502519  0.502519  0.406158  1
  Fe  Fe3  1  0.502519  0.502519  0.477555  1
  Fe  Fe4  1  0.502519  0.502519  0.548953  1
  Fe  Fe5  1  0.502519  0.502519  0.620353  1
  Fe  Fe6  1  0.502519  0.502519  0.692140  1
  Ni  Ni7  1  0.002519  0.002519  0.299035  1
  Ni  Ni8  1  0.002519  0.002519  0.370460  1
  Ni  Ni9  1  0.002519  0.002519  0.441857  1
  Ni  Ni10  1  0.002519  0.002519  0.513254  1
  Ni  Ni11  1  0.002519  0.002519  0.584652  1
  Ni  Ni12  1  0.002519  0.002519  0.656074  1
