# generated using pymatgen
data_FeNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97010691
_cell_length_b   4.97010691
_cell_length_c   46.57801146
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   60.00000001
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi3
_chemical_formula_sum   'Fe10 Ni30'
_cell_volume   996.421376297
_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
  Fe  Fe1  1  0.166770  0.916873  0.274570  1
  Fe  Fe2  1  0.833436  0.583539  0.315013  1
  Fe  Fe3  1  0.500103  0.250206  0.359886  1
  Fe  Fe4  1  0.166770  0.916873  0.403013  1
  Fe  Fe5  1  0.833436  0.583539  0.446703  1
  Fe  Fe6  1  0.500103  0.250206  0.490265  1
  Fe  Fe7  1  0.166770  0.916873  0.533871  1
  Fe  Fe8  1  0.833436  0.583539  0.577415  1
  Fe  Fe9  1  0.500103  0.250206  0.621155  1
  Fe  Fe10  1  0.166770  0.916873  0.663865  1
  Ni  Ni11  1  0.333859  0.083962  0.316790  1
  Ni  Ni12  1  0.333859  0.582693  0.316790  1
  Ni  Ni13  1  0.832590  0.083962  0.316790  1
  Ni  Ni14  1  0.999506  0.749609  0.359386  1
  Ni  Ni15  1  0.999506  0.251400  0.359386  1
  Ni  Ni16  1  0.501297  0.749609  0.359386  1
  Ni  Ni17  1  0.666927  0.417030  0.403113  1
  Ni  Ni18  1  0.666927  0.916557  0.403113  1
  Ni  Ni19  1  0.166454  0.417030  0.403113  1
  Ni  Ni20  1  0.333402  0.083505  0.446677  1
  Ni  Ni21  1  0.333402  0.583608  0.446677  1
  Ni  Ni22  1  0.833505  0.083505  0.446677  1
  Ni  Ni23  1  0.000115  0.750218  0.490274  1
  Ni  Ni24  1  0.000115  0.250181  0.490274  1
  Ni  Ni25  1  0.500078  0.750218  0.490274  1
  Ni  Ni26  1  0.666752  0.416855  0.533858  1
  Ni  Ni27  1  0.666752  0.916908  0.533858  1
  Ni  Ni28  1  0.166805  0.416855  0.533858  1
  Ni  Ni29  1  0.333485  0.083588  0.577460  1
  Ni  Ni30  1  0.333485  0.583441  0.577460  1
  Ni  Ni31  1  0.833338  0.083588  0.577460  1
  Ni  Ni32  1  0.999759  0.749862  0.621011  1
  Ni  Ni33  1  0.999759  0.250894  0.621011  1
  Ni  Ni34  1  0.500791  0.749862  0.621011  1
  Ni  Ni35  1  0.667142  0.417245  0.664808  1
  Ni  Ni36  1  0.667142  0.916127  0.664808  1
  Ni  Ni37  1  0.166024  0.417245  0.664808  1
  Ni  Ni38  1  0.332973  0.083076  0.706981  1
  Ni  Ni39  1  0.332973  0.584465  0.706981  1
  Ni  Ni40  1  0.834362  0.083076  0.706981  1
