# generated using pymatgen data_V3Fe3C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.58019177 _cell_length_b 7.58019177 _cell_length_c 7.58019177 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural V3Fe3C _chemical_formula_sum 'V12 Fe12 C4' _cell_volume 307.98217389 _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 V V0 1 0.80583600 0.80583600 0.19416400 1.0 V V1 1 0.19416400 0.19416400 0.80583600 1.0 V V2 1 0.80583600 0.19416400 0.80583600 1.0 V V3 1 0.19416400 0.80583600 0.19416400 1.0 V V4 1 0.19416400 0.80583600 0.80583600 1.0 V V5 1 0.80583600 0.19416400 0.19416400 1.0 V V6 1 0.44416400 0.44416400 0.05583600 1.0 V V7 1 0.05583600 0.05583600 0.44416400 1.0 V V8 1 0.44416400 0.05583600 0.44416400 1.0 V V9 1 0.05583600 0.44416400 0.05583600 1.0 V V10 1 0.05583600 0.44416400 0.44416400 1.0 V V11 1 0.44416400 0.05583600 0.05583600 1.0 Fe Fe12 1 0.12500000 0.62500000 0.62500000 1.0 Fe Fe13 1 0.62500000 0.12500000 0.62500000 1.0 Fe Fe14 1 0.62500000 0.62500000 0.12500000 1.0 Fe Fe15 1 0.62500000 0.62500000 0.62500000 1.0 Fe Fe16 1 0.73947300 0.42017600 0.42017600 1.0 Fe Fe17 1 0.42017600 0.73947300 0.42017600 1.0 Fe Fe18 1 0.42017600 0.42017600 0.73947300 1.0 Fe Fe19 1 0.42017600 0.42017600 0.42017600 1.0 Fe Fe20 1 0.51052700 0.82982400 0.82982400 1.0 Fe Fe21 1 0.82982400 0.51052700 0.82982400 1.0 Fe Fe22 1 0.82982400 0.82982400 0.51052700 1.0 Fe Fe23 1 0.82982400 0.82982400 0.82982400 1.0 C C24 1 0.62500000 0.12500000 0.12500000 1.0 C C25 1 0.12500000 0.62500000 0.12500000 1.0 C C26 1 0.12500000 0.12500000 0.62500000 1.0 C C27 1 0.12500000 0.12500000 0.12500000 1.0