# generated using pymatgen data_Fe3SiNi _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.10996700 _cell_length_b 6.10996700 _cell_length_c 6.10996700 _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 228.09543514 _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 1.0 Fe Fe1 1 0.37771000 0.79351700 0.95367100 1.0 Fe Fe2 1 0.87771000 0.70648300 0.04632900 1.0 Fe Fe3 1 0.45367100 0.12229000 0.20648300 1.0 Fe Fe4 1 0.62229000 0.29351700 0.54632900 1.0 Fe Fe5 1 0.95367100 0.37771000 0.79351700 1.0 Fe Fe6 1 0.04632900 0.87771000 0.70648300 1.0 Fe Fe7 1 0.54632900 0.62229000 0.29351700 1.0 Fe Fe8 1 0.20648300 0.45367100 0.12229000 1.0 Fe Fe9 1 0.70648300 0.04632900 0.87771000 1.0 Fe Fe10 1 0.29351700 0.54632900 0.62229000 1.0 Fe Fe11 1 0.79351700 0.95367100 0.37771000 1.0 Si Si12 1 0.06484700 0.06484700 0.06484700 1.0 Si Si13 1 0.43515300 0.93515300 0.56484700 1.0 Si Si14 1 0.93515300 0.56484700 0.43515300 1.0 Si Si15 1 0.56484700 0.43515300 0.93515300 1.0 Ni Ni16 1 0.68496700 0.68496700 0.68496700 1.0 Ni Ni17 1 0.81503300 0.31503300 0.18496700 1.0 Ni Ni18 1 0.31503300 0.18496700 0.81503300 1.0 Ni Ni19 1 0.18496700 0.81503300 0.31503300 1.0