# generated using pymatgen data_Fe2NiC _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.39823200 _cell_length_b 5.07589900 _cell_length_c 6.76006900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe2NiC _chemical_formula_sum 'Fe8 Ni4 C4' _cell_volume 150.91841476 _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 0.17154300 0.67884900 0.06993500 1.0 Fe Fe1 1 0.32845700 0.17884900 0.43006500 1.0 Fe Fe2 1 0.82845700 0.32115100 0.56993500 1.0 Fe Fe3 1 0.67154300 0.82115100 0.93006500 1.0 Fe Fe4 1 0.82845700 0.32115100 0.93006500 1.0 Fe Fe5 1 0.67154300 0.82115100 0.56993500 1.0 Fe Fe6 1 0.17154300 0.67884900 0.43006500 1.0 Fe Fe7 1 0.32845700 0.17884900 0.06993500 1.0 Ni Ni8 1 0.66084200 0.54020100 0.25000000 1.0 Ni Ni9 1 0.83915800 0.04020100 0.25000000 1.0 Ni Ni10 1 0.33915800 0.45979900 0.75000000 1.0 Ni Ni11 1 0.16084200 0.95979900 0.75000000 1.0 C C12 1 0.06186300 0.38148000 0.25000000 1.0 C C13 1 0.43813700 0.88148000 0.25000000 1.0 C C14 1 0.93813700 0.61852000 0.75000000 1.0 C C15 1 0.56186300 0.11852000 0.75000000 1.0