# generated using pymatgen
data_Fe3SiNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.10996663
_cell_length_b   6.10996663
_cell_length_c   6.10996663
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3SiNi
_chemical_formula_sum   'Fe12 Si4 Ni4'
_cell_volume   228.09539370
_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
  Fe  Fe0  1  0.12229000  0.20648300  0.45367100  1
  Fe  Fe1  1  0.37771000  0.79351700  0.95367100  1
  Fe  Fe2  1  0.87771000  0.70648300  0.04632900  1
  Fe  Fe3  1  0.45367100  0.12229000  0.20648300  1
  Fe  Fe4  1  0.62229000  0.29351700  0.54632900  1
  Fe  Fe5  1  0.95367100  0.37771000  0.79351700  1
  Fe  Fe6  1  0.04632900  0.87771000  0.70648300  1
  Fe  Fe7  1  0.54632900  0.62229000  0.29351700  1
  Fe  Fe8  1  0.20648300  0.45367100  0.12229000  1
  Fe  Fe9  1  0.70648300  0.04632900  0.87771000  1
  Fe  Fe10  1  0.29351700  0.54632900  0.62229000  1
  Fe  Fe11  1  0.79351700  0.95367100  0.37771000  1
  Si  Si12  1  0.06484700  0.06484700  0.06484700  1
  Si  Si13  1  0.43515300  0.93515300  0.56484700  1
  Si  Si14  1  0.93515300  0.56484700  0.43515300  1
  Si  Si15  1  0.56484700  0.43515300  0.93515300  1
  Ni  Ni16  1  0.68496700  0.68496700  0.68496700  1
  Ni  Ni17  1  0.81503300  0.31503300  0.18496700  1
  Ni  Ni18  1  0.31503300  0.18496700  0.81503300  1
  Ni  Ni19  1  0.18496700  0.81503300  0.31503300  1
