# generated using pymatgen data_Mn3OF5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.23654200 _cell_length_b 4.92285400 _cell_length_c 14.70601400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn3OF5 _chemical_formula_sum 'Mn6 O2 F10' _cell_volume 234.31127005 _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 0.00000000 0.77337500 0.00588300 1.0 Mn Mn1 1 0.00000000 0.72583800 0.33319400 1.0 Mn Mn2 1 0.00000000 0.78156100 0.65827600 1.0 Mn Mn3 1 0.50000000 0.21843900 0.15827600 1.0 Mn Mn4 1 0.50000000 0.22662500 0.50588300 1.0 Mn Mn5 1 0.50000000 0.27416200 0.83319400 1.0 O O6 1 0.50000000 0.94948600 0.59990900 1.0 O O7 1 0.00000000 0.05051400 0.09990900 1.0 F F8 1 0.50000000 0.93230000 0.27168200 1.0 F F9 1 0.50000000 0.95774300 0.93448800 1.0 F F10 1 0.00000000 0.06770000 0.77168200 1.0 F F11 1 0.00000000 0.04225700 0.43448800 1.0 F F12 1 0.00000000 0.42100100 0.22754700 1.0 F F13 1 0.00000000 0.43633500 0.56588400 1.0 F F14 1 0.00000000 0.47552600 0.90313600 1.0 F F15 1 0.50000000 0.56366500 0.06588400 1.0 F F16 1 0.50000000 0.52447400 0.40313600 1.0 F F17 1 0.50000000 0.57899900 0.72754700 1.0