# generated using pymatgen data_Li4V2Fe3Ni3O16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.85884663 _cell_length_b 5.85884663 _cell_length_c 9.49299896 _cell_angle_alpha 87.84873206 _cell_angle_beta 87.84873206 _cell_angle_gamma 59.96756428 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4V2Fe3Ni3O16 _chemical_formula_sum 'Li4 V2 Fe3 Ni3 O16' _cell_volume 281.84352336 _cell_formula_units_Z 1 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 Li Li0 1 0.67076900 0.67076900 0.89804600 1.0 Li Li1 1 0.99660000 0.99660000 0.99008800 1.0 Li Li2 1 0.00273000 0.00273000 0.49375400 1.0 Li Li3 1 0.33366600 0.33366600 0.40424500 1.0 V V4 1 0.67496900 0.67496900 0.49260100 1.0 V V5 1 0.35007500 0.35007500 0.98969400 1.0 Fe Fe6 1 0.83448500 0.34433000 0.21655000 1.0 Fe Fe7 1 0.34433000 0.83448500 0.21655000 1.0 Fe Fe8 1 0.17012300 0.17012300 0.71891000 1.0 Ni Ni9 1 0.82894600 0.82894600 0.21446500 1.0 Ni Ni10 1 0.65650700 0.17410600 0.71290400 1.0 Ni Ni11 1 0.17410600 0.65650700 0.71290400 1.0 O O12 1 0.82176700 0.33877800 0.59528500 1.0 O O13 1 0.51565100 0.51565100 0.34047200 1.0 O O14 1 0.66722900 0.66722900 0.10450200 1.0 O O15 1 0.99859000 0.99859000 0.30349200 1.0 O O16 1 0.98878200 0.98878200 0.79976600 1.0 O O17 1 0.33877800 0.82176700 0.59528500 1.0 O O18 1 0.95708500 0.50935800 0.35674100 1.0 O O19 1 0.50935800 0.95708500 0.35674100 1.0 O O20 1 0.16995900 0.16995900 0.08781300 1.0 O O21 1 0.82019600 0.82019600 0.58481800 1.0 O O22 1 0.48553000 0.04234500 0.84047100 1.0 O O23 1 0.04234500 0.48553000 0.84047100 1.0 O O24 1 0.34081900 0.34081900 0.61038500 1.0 O O25 1 0.65037200 0.17567600 0.08881900 1.0 O O26 1 0.48211600 0.48211600 0.85318900 1.0 O O27 1 0.17567600 0.65037200 0.08881900 1.0