# generated using pymatgen
data_YFeNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95769236
_cell_length_b   5.21017341
_cell_length_c   7.38635314
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YFeNi
_chemical_formula_sum   'Y4 Fe4 Ni4'
_cell_volume   190.79272877
_cell_formula_units_Z   4
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
  Y  Y0  1  0.00000000  0.25000000  0.87874400  1
  Y  Y1  1  0.50000000  0.25000000  0.62125600  1
  Y  Y2  1  0.50000000  0.75000000  0.37874400  1
  Y  Y3  1  0.00000000  0.75000000  0.12125600  1
  Fe  Fe4  1  0.25000000  0.25000000  0.25000000  1
  Fe  Fe5  1  0.75000000  0.25000000  0.25000000  1
  Fe  Fe6  1  0.75000000  0.75000000  0.75000000  1
  Fe  Fe7  1  0.25000000  0.75000000  0.75000000  1
  Ni  Ni8  1  0.50000000  0.50000000  0.00000000  1
  Ni  Ni9  1  0.50000000  0.00000000  0.00000000  1
  Ni  Ni10  1  0.00000000  0.00000000  0.50000000  1
  Ni  Ni11  1  0.00000000  0.50000000  0.50000000  1
