# generated using pymatgen data_V2FeO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.06425359 _cell_length_b 6.09405725 _cell_length_c 6.02638845 _cell_angle_alpha 119.64716835 _cell_angle_beta 89.93565120 _cell_angle_gamma 120.57853312 _symmetry_Int_Tables_number 1 _chemical_formula_structural V2FeO4 _chemical_formula_sum 'V4 Fe2 O8' _cell_volume 157.02017993 _cell_formula_units_Z 2 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 0.50000000 0.00000000 0.50000100 1.0 V V1 1 0.00000000 0.50000000 0.00000000 1.0 V V2 1 0.00000000 0.50000000 0.50000000 1.0 V V3 1 0.00000000 0.00000000 0.50000000 1.0 Fe Fe4 1 0.37041500 0.24966200 0.12463300 1.0 Fe Fe5 1 0.62958400 0.75033800 0.87536700 1.0 O O6 1 0.22956800 0.47712500 0.73879400 1.0 O O7 1 0.24017600 0.50461300 0.25164800 1.0 O O8 1 0.23802100 0.99089200 0.73429600 1.0 O O9 1 0.23645900 0.99002600 0.25473000 1.0 O O10 1 0.76198000 0.00910900 0.26570400 1.0 O O11 1 0.76354100 0.00997400 0.74526900 1.0 O O12 1 0.77043200 0.52287500 0.26120600 1.0 O O13 1 0.75982400 0.49538700 0.74835200 1.0