# generated using pymatgen data_Mn6O5F7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.69259100 _cell_length_b 5.71291418 _cell_length_c 15.66917065 _cell_angle_alpha 89.70569296 _cell_angle_beta 89.85071942 _cell_angle_gamma 89.93068840 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn6O5F7 _chemical_formula_sum 'Mn12 O10 F14' _cell_volume 420.05765099 _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 0.98746200 0.17061500 0.58375100 1.0 Mn Mn1 1 0.99677000 0.83187300 0.76301200 1.0 Mn Mn2 1 0.99748300 0.15422200 0.92411200 1.0 Mn Mn3 1 0.95260100 0.16260300 0.24932200 1.0 Mn Mn4 1 0.97377300 0.85642000 0.42116600 1.0 Mn Mn5 1 0.97467300 0.85965800 0.08683000 1.0 Mn Mn6 1 0.52733100 0.33256100 0.41813900 1.0 Mn Mn7 1 0.50424300 0.33595200 0.07762800 1.0 Mn Mn8 1 0.46705800 0.35654200 0.74418100 1.0 Mn Mn9 1 0.49574800 0.64726400 0.91170500 1.0 Mn Mn10 1 0.51118700 0.65051000 0.57910600 1.0 Mn Mn11 1 0.51346000 0.65496400 0.24157400 1.0 O O12 1 0.77570200 0.10887600 0.36498300 1.0 O O13 1 0.78382100 0.11383800 0.02949200 1.0 O O14 1 0.78267100 0.88297000 0.86819700 1.0 O O15 1 0.77779200 0.89228600 0.53082600 1.0 O O16 1 0.76800000 0.89088900 0.19163300 1.0 O O17 1 0.73295700 0.39608800 0.52272200 1.0 O O18 1 0.70748100 0.39376500 0.18432000 1.0 O O19 1 0.28577300 0.37605300 0.97097300 1.0 O O20 1 0.28065800 0.61916000 0.80610300 1.0 O O21 1 0.27258900 0.39607100 0.63382200 1.0 F F22 1 0.76402400 0.10451000 0.70215800 1.0 F F23 1 0.74066000 0.37945800 0.84838300 1.0 F F24 1 0.74959900 0.61103400 0.69118800 1.0 F F25 1 0.74291600 0.60716300 0.35530400 1.0 F F26 1 0.73093400 0.61416700 0.01821000 1.0 F F27 1 0.26223700 0.61159200 0.46264400 1.0 F F28 1 0.24280300 0.61734700 0.13249000 1.0 F F29 1 0.27352400 0.38033900 0.30669400 1.0 F F30 1 0.23207400 0.11782400 0.81639300 1.0 F F31 1 0.24736700 0.10679500 0.47587000 1.0 F F32 1 0.23668100 0.89221000 0.64481400 1.0 F F33 1 0.23985200 0.87566400 0.98682600 1.0 F F34 1 0.23698300 0.12288300 0.14693400 1.0 F F35 1 0.23111400 0.87583300 0.30849000 1.0