# generated using pymatgen data_Mn3O5F _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.44909500 _cell_length_b 5.46224984 _cell_length_c 7.10944602 _cell_angle_alpha 72.60025969 _cell_angle_beta 72.61389556 _cell_angle_gamma 72.17775714 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn3O5F _chemical_formula_sum 'Mn6 O10 F2' _cell_volume 187.16363959 _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 Mn Mn0 1 0.65257700 0.66732600 0.84256300 1.0 Mn Mn1 1 0.35953500 0.31563900 0.66807400 1.0 Mn Mn2 1 0.65106800 0.65846300 0.33311800 1.0 Mn Mn3 1 0.33168200 0.33151100 0.16193700 1.0 Mn Mn4 1 0.00771600 0.02263400 0.50208600 1.0 Mn Mn5 1 0.99815000 0.00548400 0.99148000 1.0 O O6 1 0.35696300 0.97535400 0.33145800 1.0 O O7 1 0.56695500 0.56237600 0.62926200 1.0 O O8 1 0.23316900 0.23458800 0.95751600 1.0 O O9 1 0.11186700 0.10848000 0.70000900 1.0 O O10 1 0.76469400 0.76565400 0.03928800 1.0 O O11 1 0.42793000 0.43303300 0.37389000 1.0 O O12 1 0.96947000 0.36614400 0.32817100 1.0 O O13 1 0.64863200 0.02329800 0.66517600 1.0 O O14 1 0.30122500 0.69411500 0.00302000 1.0 O O15 1 0.69041900 0.30774700 0.00140700 1.0 F F16 1 0.03539100 0.63514200 0.66691300 1.0 F F17 1 0.89255600 0.89301300 0.30463400 1.0