# generated using pymatgen
data_FeNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.49655920
_cell_length_b   4.98209632
_cell_length_c   49.75736177
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi3
_chemical_formula_sum   'Fe9 Ni27'
_cell_volume   866.782931801
_cell_formula_units_Z   9
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  1.002758  0.124002  0.286961  1
  Fe  Fe2  1  1.002758  0.624002  0.337113  1
  Fe  Fe3  1  1.002758  0.124002  0.386989  1
  Fe  Fe4  1  1.002758  0.624002  0.437070  1
  Fe  Fe5  1  1.002758  0.124002  0.487131  1
  Fe  Fe6  1  1.002758  0.624002  0.537193  1
  Fe  Fe7  1  1.002758  0.124002  0.587278  1
  Fe  Fe8  1  1.002758  0.624002  0.637289  1
  Fe  Fe9  1  1.002758  0.124002  0.687074  1
  Ni  Ni10  1  0.502758  0.374518  0.312176  1
  Ni  Ni11  1  1.002758  0.624002  0.287933  1
  Ni  Ni12  1  0.502758  0.873486  0.312176  1
  Ni  Ni13  1  0.502758  0.874032  0.361931  1
  Ni  Ni14  1  1.002758  0.124002  0.336903  1
  Ni  Ni15  1  0.502758  0.373972  0.361931  1
  Ni  Ni16  1  0.502758  0.373966  0.412031  1
  Ni  Ni17  1  1.002758  0.624002  0.387028  1
  Ni  Ni18  1  0.502758  0.874038  0.412031  1
  Ni  Ni19  1  0.502758  0.874005  0.462097  1
  Ni  Ni20  1  1.002758  0.124002  0.437064  1
  Ni  Ni21  1  0.502758  0.374000  0.462097  1
  Ni  Ni22  1  0.502758  0.373995  0.512163  1
  Ni  Ni23  1  1.002758  0.624002  0.487131  1
  Ni  Ni24  1  0.502758  0.874009  0.512163  1
  Ni  Ni25  1  0.502758  0.874015  0.562226  1
  Ni  Ni26  1  1.002758  0.124002  0.537200  1
  Ni  Ni27  1  0.502758  0.373989  0.562226  1
  Ni  Ni28  1  0.502758  0.373940  0.612290  1
  Ni  Ni29  1  1.002758  0.624002  0.587250  1
  Ni  Ni30  1  0.502758  0.874064  0.612290  1
  Ni  Ni31  1  0.502758  0.873559  0.662364  1
  Ni  Ni32  1  1.002758  0.124002  0.637401  1
  Ni  Ni33  1  0.502758  0.374445  0.662364  1
  Ni  Ni34  1  0.502758  0.373788  0.711563  1
  Ni  Ni35  1  1.002758  0.624002  0.687351  1
  Ni  Ni36  1  0.502758  0.874217  0.711563  1
