# generated using pymatgen data_Mn3(OF2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.77722100 _cell_length_b 4.67312000 _cell_length_c 9.78709501 _cell_angle_alpha 89.99541239 _cell_angle_beta 90.00017176 _cell_angle_gamma 89.99974547 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn3(OF2)2 _chemical_formula_sum 'Mn6 O4 F8' _cell_volume 218.49226622 _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 0.03877700 0.00223300 0.99219000 1.0 Mn Mn1 1 0.03879300 0.00220600 0.34101000 1.0 Mn Mn2 1 0.99674800 0.96988700 0.66660400 1.0 Mn Mn3 1 0.46120400 0.50220000 0.84101200 1.0 Mn Mn4 1 0.50322800 0.46984800 0.16660400 1.0 Mn Mn5 1 0.46121700 0.50222900 0.49218400 1.0 O O6 1 0.18917200 0.80523700 0.49636700 1.0 O O7 1 0.18975500 0.80526300 0.83726500 1.0 O O8 1 0.31083300 0.30523700 0.99636800 1.0 O O9 1 0.31024600 0.30526100 0.33726400 1.0 F F10 1 0.22745600 0.80893000 0.16650400 1.0 F F11 1 0.27255200 0.30893500 0.66650400 1.0 F F12 1 0.72626800 0.71063800 0.00554100 1.0 F F13 1 0.72638700 0.71099100 0.32796200 1.0 F F14 1 0.65359000 0.68463900 0.66655900 1.0 F F15 1 0.84641800 0.18463700 0.16656000 1.0 F F16 1 0.77373600 0.21063800 0.50554100 1.0 F F17 1 0.77362000 0.21099100 0.82796200 1.0