# generated using pymatgen data_Mo3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.14638564 _cell_length_b 6.14638564 _cell_length_c 9.87561900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999611 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mo3O8 _chemical_formula_sum 'Mo6 O16' _cell_volume 323.09823540 _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 0.66315100 0.83157500 0.24845300 1.0 Mo Mo1 1 0.83157500 0.16842500 0.74845300 1.0 Mo Mo2 1 0.16842500 0.33684900 0.24845300 1.0 Mo Mo3 1 0.83157500 0.66315100 0.74845300 1.0 Mo Mo4 1 0.33684900 0.16842500 0.74845300 1.0 Mo Mo5 1 0.16842500 0.83157500 0.24845300 1.0 O O6 1 0.85061300 0.14938700 0.15208400 1.0 O O7 1 0.70122700 0.85061300 0.65208400 1.0 O O8 1 0.14938700 0.29877300 0.65208400 1.0 O O9 1 0.85061300 0.70122700 0.15208400 1.0 O O10 1 0.29877300 0.14938700 0.15208400 1.0 O O11 1 0.14938700 0.85061300 0.65208400 1.0 O O12 1 0.52013700 0.47986300 0.85320000 1.0 O O13 1 0.04027300 0.52013700 0.35320000 1.0 O O14 1 0.47986300 0.95972700 0.35320000 1.0 O O15 1 0.52013700 0.04027300 0.85320000 1.0 O O16 1 0.00000000 0.00000000 0.35873800 1.0 O O17 1 0.00000000 0.00000000 0.85873800 1.0 O O18 1 0.33333300 0.66666700 0.13519600 1.0 O O19 1 0.95972700 0.47986300 0.85320000 1.0 O O20 1 0.47986300 0.52013700 0.35320000 1.0 O O21 1 0.66666700 0.33333300 0.63519600 1.0