# generated using pymatgen
data_FeNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.44209063
_cell_length_b   4.89525275
_cell_length_c   49.06398135
_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   826.723358441
_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  1.002786  0.124972  0.286551  1
  Fe  Fe2  1  1.002786  0.624972  0.336376  1
  Fe  Fe3  1  1.002786  0.124972  0.386332  1
  Fe  Fe4  1  1.002786  0.624972  0.436334  1
  Fe  Fe5  1  1.002786  0.124972  0.486340  1
  Fe  Fe6  1  1.002786  0.624972  0.536348  1
  Fe  Fe7  1  1.002786  0.124972  0.586353  1
  Fe  Fe8  1  1.002786  0.624972  0.636378  1
  Fe  Fe9  1  1.002786  0.124972  0.686300  1
  Ni  Ni10  1  0.502786  0.375726  0.311212  1
  Ni  Ni11  1  1.002786  0.624972  0.286293  1
  Ni  Ni12  1  0.502786  0.874218  0.311212  1
  Ni  Ni13  1  0.502786  0.874962  0.361294  1
  Ni  Ni14  1  1.002786  0.124972  0.336399  1
  Ni  Ni15  1  0.502786  0.374982  0.361294  1
  Ni  Ni16  1  0.502786  0.374970  0.411326  1
  Ni  Ni17  1  1.002786  0.624972  0.386336  1
  Ni  Ni18  1  0.502786  0.874974  0.411326  1
  Ni  Ni19  1  0.502786  0.874971  0.461336  1
  Ni  Ni20  1  1.002786  0.124972  0.436334  1
  Ni  Ni21  1  0.502786  0.374973  0.461336  1
  Ni  Ni22  1  0.502786  0.374973  0.511343  1
  Ni  Ni23  1  1.002786  0.624972  0.486340  1
  Ni  Ni24  1  0.502786  0.874971  0.511343  1
  Ni  Ni25  1  0.502786  0.874968  0.561350  1
  Ni  Ni26  1  1.002786  0.124972  0.536346  1
  Ni  Ni27  1  0.502786  0.374976  0.561350  1
  Ni  Ni28  1  0.502786  0.374983  0.611351  1
  Ni  Ni29  1  1.002786  0.624972  0.586358  1
  Ni  Ni30  1  0.502786  0.874961  0.611351  1
  Ni  Ni31  1  0.502786  0.875064  0.661316  1
  Ni  Ni32  1  1.002786  0.124972  0.636371  1
  Ni  Ni33  1  0.502786  0.374880  0.661316  1
  Ni  Ni34  1  0.502786  0.373544  0.711252  1
  Ni  Ni35  1  1.002786  0.624972  0.686457  1
  Ni  Ni36  1  0.502786  0.876400  0.711252  1
