# generated using pymatgen data_Mn2OF3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.08925862 _cell_length_b 5.16223705 _cell_length_c 10.63917278 _cell_angle_alpha 89.98462266 _cell_angle_beta 89.94041044 _cell_angle_gamma 89.99961781 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn2OF3 _chemical_formula_sum 'Mn4 O2 F6' _cell_volume 169.66795347 _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 0.24452600 0.50099100 0.84621000 1.0 Mn Mn1 1 0.24448900 0.99886900 0.34633500 1.0 Mn Mn2 1 0.74423000 0.05086400 0.63889400 1.0 Mn Mn3 1 0.74415800 0.44913400 0.13887800 1.0 O O4 1 0.24418700 0.24077100 0.70376700 1.0 O O5 1 0.24411200 0.25926700 0.20383900 1.0 F F6 1 0.24429100 0.84399800 0.55959100 1.0 F F7 1 0.24424000 0.65600200 0.05954600 1.0 F F8 1 0.74426400 0.31073700 0.94532400 1.0 F F9 1 0.74444800 0.75085600 0.78661300 1.0 F F10 1 0.74423100 0.18933700 0.44537500 1.0 F F11 1 0.74442700 0.74917400 0.28662500 1.0