# generated using pymatgen data_Mn8O13F3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.49138400 _cell_length_b 5.49872250 _cell_length_c 9.95609763 _cell_angle_alpha 90.03087883 _cell_angle_beta 90.05798581 _cell_angle_gamma 90.93010487 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn8O13F3 _chemical_formula_sum 'Mn8 O13 F3' _cell_volume 245.85193032 _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 0.99657700 0.16003400 0.37239500 1.0 Mn Mn1 1 0.00626400 0.85052300 0.62508000 1.0 Mn Mn2 1 0.00639200 0.16149900 0.87436700 1.0 Mn Mn3 1 0.98356000 0.86218700 0.12073300 1.0 Mn Mn4 1 0.50594100 0.33846100 0.12262600 1.0 Mn Mn5 1 0.50171600 0.35123800 0.62644300 1.0 Mn Mn6 1 0.47864400 0.63749200 0.87993600 1.0 Mn Mn7 1 0.53175300 0.63680600 0.37741900 1.0 O O8 1 0.77575300 0.11069600 0.53864600 1.0 O O9 1 0.76983800 0.11277800 0.03479500 1.0 O O10 1 0.77291100 0.88523800 0.29023900 1.0 O O11 1 0.72645900 0.39161400 0.79177700 1.0 O O12 1 0.74160600 0.60534300 0.53921300 1.0 O O13 1 0.73271700 0.38780900 0.28675700 1.0 O O14 1 0.71952100 0.61448000 0.04083800 1.0 O O15 1 0.26025500 0.38798900 0.96504200 1.0 O O16 1 0.27022900 0.60787400 0.71205200 1.0 O O17 1 0.27701500 0.39092500 0.46007200 1.0 O O18 1 0.23320100 0.11379100 0.71211400 1.0 O O19 1 0.21837100 0.88471600 0.95842200 1.0 O O20 1 0.22677700 0.11422400 0.20844000 1.0 F F21 1 0.73945400 0.88707100 0.79745400 1.0 F F22 1 0.26111700 0.62151800 0.21417700 1.0 F F23 1 0.26392900 0.88569500 0.45096200 1.0