# generated using pymatgen data_Mn5O3F5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.43160615 _cell_length_b 6.43133912 _cell_length_c 10.98555063 _cell_angle_alpha 89.97620811 _cell_angle_beta 106.99366895 _cell_angle_gamma 59.98141604 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn5O3F5 _chemical_formula_sum 'Mn10 O6 F10' _cell_volume 370.32661903 _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 0.97970600 0.51022000 0.46951100 1.0 Mn Mn1 1 0.97984600 0.01014800 0.96970300 1.0 Mn Mn2 1 0.88580300 0.05706700 0.32404200 1.0 Mn Mn3 1 0.38122800 0.05706800 0.32416500 1.0 Mn Mn4 1 0.38109900 0.56176300 0.32405500 1.0 Mn Mn5 1 0.36984700 0.81496300 0.55491900 1.0 Mn Mn6 1 0.37131300 0.31430900 0.05702400 1.0 Mn Mn7 1 0.88554000 0.55722300 0.82335500 1.0 Mn Mn8 1 0.38056900 0.55724100 0.82331700 1.0 Mn Mn9 1 0.38056900 0.06222300 0.82337500 1.0 O O10 1 0.13003800 0.70467900 0.42543900 1.0 O O11 1 0.13083700 0.20847800 0.92240700 1.0 O O12 1 0.59059600 0.70510400 0.42532900 1.0 O O13 1 0.58288800 0.20887200 0.92228600 1.0 O O14 1 0.13036800 0.16530000 0.42529600 1.0 O O15 1 0.13112900 0.66059300 0.92225400 1.0 F F16 1 0.12467500 0.93765100 0.18697000 1.0 F F17 1 0.12199300 0.43896200 0.68283900 1.0 F F18 1 0.61771200 0.69119800 0.92640900 1.0 F F19 1 0.61740600 0.19134600 0.42596500 1.0 F F20 1 0.61099600 0.48297400 0.70551800 1.0 F F21 1 0.61237700 0.98025000 0.20568200 1.0 F F22 1 0.18846900 0.90552900 0.70552600 1.0 F F23 1 0.18593700 0.40670100 0.20565300 1.0 F F24 1 0.61111900 0.90571200 0.70541700 1.0 F F25 1 0.61261700 0.40708600 0.20555600 1.0