# generated using pymatgen data_Mo3NO9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.27925800 _cell_length_b 11.27925803 _cell_length_c 3.61663200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999991 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mo3NO9 _chemical_formula_sum 'Mo6 N2 O18' _cell_volume 398.47035382 _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 Mo Mo0 1 0.64862200 0.10927800 0.75000000 1.0 Mo Mo1 1 0.89072200 0.53934300 0.75000000 1.0 Mo Mo2 1 0.46065700 0.35137800 0.75000000 1.0 Mo Mo3 1 0.35137800 0.89072200 0.25000000 1.0 Mo Mo4 1 0.10927800 0.46065700 0.25000000 1.0 Mo Mo5 1 0.53934300 0.64862200 0.25000000 1.0 N N6 1 0.00000000 0.00000000 0.50000000 1.0 N N7 1 0.00000000 0.00000000 0.00000000 1.0 O O8 1 0.78188300 0.27901200 0.75000000 1.0 O O9 1 0.72098800 0.50287100 0.75000000 1.0 O O10 1 0.49712900 0.21811700 0.75000000 1.0 O O11 1 0.21811700 0.72098800 0.25000000 1.0 O O12 1 0.27901200 0.49712900 0.25000000 1.0 O O13 1 0.50287100 0.78188300 0.25000000 1.0 O O14 1 0.72909500 0.01528500 0.75000000 1.0 O O15 1 0.98471500 0.71381000 0.75000000 1.0 O O16 1 0.28619000 0.27090500 0.75000000 1.0 O O17 1 0.27090500 0.98471500 0.25000000 1.0 O O18 1 0.01528500 0.28619000 0.25000000 1.0 O O19 1 0.71381000 0.72909500 0.25000000 1.0 O O20 1 0.42587800 0.91986800 0.75000000 1.0 O O21 1 0.08013200 0.50601100 0.75000000 1.0 O O22 1 0.49398900 0.57412200 0.75000000 1.0 O O23 1 0.57412200 0.08013200 0.25000000 1.0 O O24 1 0.91986800 0.49398900 0.25000000 1.0 O O25 1 0.50601100 0.42587800 0.25000000 1.0