# generated using pymatgen data_Mn8O13F3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.50394000 _cell_length_b 5.52638650 _cell_length_c 9.96264390 _cell_angle_alpha 89.86930820 _cell_angle_beta 89.69159783 _cell_angle_gamma 87.85910570 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn8O13F3 _chemical_formula_sum 'Mn8 O13 F3' _cell_volume 247.79810271 _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 Mn Mn0 1 0.99118300 0.15585700 0.62251600 1.0 Mn Mn1 1 0.01704600 0.85727100 0.36561900 1.0 Mn Mn2 1 0.01475400 0.16525800 0.12673800 1.0 Mn Mn3 1 0.00783400 0.85527400 0.86909500 1.0 Mn Mn4 1 0.51375000 0.35630500 0.88421900 1.0 Mn Mn5 1 0.50439600 0.35791500 0.37729100 1.0 Mn Mn6 1 0.49183600 0.63869400 0.13021600 1.0 Mn Mn7 1 0.49518300 0.65238800 0.62619000 1.0 O O8 1 0.23409000 0.10864800 0.45772200 1.0 O O9 1 0.23206300 0.11188300 0.96109300 1.0 O O10 1 0.23755600 0.88589100 0.20781400 1.0 O O11 1 0.21928500 0.88606600 0.70806800 1.0 O O12 1 0.28011800 0.39593600 0.21519500 1.0 O O13 1 0.25768200 0.61010900 0.46048300 1.0 O O14 1 0.26518700 0.61093200 0.96384800 1.0 O O15 1 0.73344700 0.39050700 0.04096800 1.0 O O16 1 0.73364800 0.60964200 0.28830400 1.0 O O17 1 0.71793600 0.38444700 0.54136600 1.0 O O18 1 0.73260800 0.60970100 0.79108800 1.0 O O19 1 0.77152900 0.11404100 0.28606600 1.0 O O20 1 0.75755500 0.10905200 0.79023000 1.0 F F21 1 0.26504200 0.37923800 0.72601800 1.0 F F22 1 0.76028200 0.87561000 0.03657100 1.0 F F23 1 0.76599100 0.87933300 0.52328100 1.0