# generated using pymatgen data_NaV3O6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.06111864 _cell_length_b 5.06111864 _cell_length_c 5.33319930 _cell_angle_alpha 76.63778919 _cell_angle_beta 76.63778919 _cell_angle_gamma 111.59432399 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaV3O6 _chemical_formula_sum 'Na1 V3 O6' _cell_volume 115.78962215 _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 Na Na0 1 0.37411600 0.62588400 0.00000000 1.0 V V1 1 0.99334500 0.00665500 0.00000000 1.0 V V2 1 0.18068300 0.81931700 0.50000000 1.0 V V3 1 0.80700700 0.19299300 0.50000000 1.0 O O4 1 0.15811000 0.16644400 0.26266400 1.0 O O5 1 0.05034000 0.40280000 0.71595500 1.0 O O6 1 0.83355600 0.84189000 0.73733600 1.0 O O7 1 0.59720000 0.94966000 0.28404500 1.0 O O8 1 0.39019200 0.05121000 0.71633900 1.0 O O9 1 0.94879000 0.60980800 0.28366100 1.0