# generated using pymatgen data_V2Ni3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.88335220 _cell_length_b 6.40692238 _cell_length_c 8.18429802 _cell_angle_alpha 90.00018308 _cell_angle_beta 89.99991863 _cell_angle_gamma 62.63750467 _symmetry_Int_Tables_number 1 _chemical_formula_structural V2Ni3O8 _chemical_formula_sum 'V4 Ni6 O16' _cell_volume 273.98428335 _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 0.12458737 0.75081653 0.61828907 1.0 V V1 1 0.87542181 0.24918243 0.38170991 1.0 V V2 1 0.37542186 0.24918138 0.11828710 1.0 V V3 1 0.62458756 0.75081838 0.88171494 1.0 Ni Ni4 1 0.49997026 0.00000025 0.49999885 1.0 Ni Ni5 1 0.99997386 -0.00000221 0.99999915 1.0 Ni Ni6 1 0.11952353 0.26096562 0.75004873 1.0 Ni Ni7 1 0.38046024 0.73903134 0.25003148 1.0 Ni Ni8 1 0.88045584 0.73903373 0.24995809 1.0 Ni Ni9 1 0.61951769 0.26096743 0.74996311 1.0 O O10 1 0.50020733 0.99961349 0.74559895 1.0 O O11 1 0.49980112 0.00038465 0.25439990 1.0 O O12 1 0.00020727 0.99961092 0.75440564 1.0 O O13 1 0.99980102 0.00038712 0.24559377 1.0 O O14 1 0.75269939 0.49458796 0.76843103 1.0 O O15 1 0.24730477 0.50541251 0.23156702 1.0 O O16 1 0.74730668 0.50541057 0.26844186 1.0 O O17 1 0.25269645 0.49459123 0.73155928 1.0 O O18 1 0.35596344 0.76299908 0.49704849 1.0 O O19 1 0.11889257 0.23708793 0.50302612 1.0 O O20 1 0.14404133 0.23701775 0.99705174 1.0 O O21 1 0.38112653 0.76290452 0.00302316 1.0 O O22 1 0.64404538 0.23701520 0.50295130 1.0 O O23 1 0.88112738 0.76290301 0.49697611 1.0 O O24 1 0.85596629 0.76299473 0.00294957 1.0 O O25 1 0.61889304 0.23708546 0.99697661 1.0