# generated using pymatgen data_Mn6O5F7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.74097900 _cell_length_b 4.74222100 _cell_length_c 15.63151868 _cell_angle_alpha 89.50528572 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn6O5F7 _chemical_formula_sum 'Mn12 O10 F14' _cell_volume 425.55209465 _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 0.84431500 0.96134600 0.41929900 1.0 Mn Mn1 1 0.18513200 0.98970400 0.24559700 1.0 Mn Mn2 1 0.86381300 0.99218900 0.08155900 1.0 Mn Mn3 1 0.81486800 0.98970400 0.74559700 1.0 Mn Mn4 1 0.13618700 0.99218900 0.58155900 1.0 Mn Mn5 1 0.15568500 0.96134600 0.91929900 1.0 Mn Mn6 1 0.66590600 0.52464000 0.58527600 1.0 Mn Mn7 1 0.65416500 0.53305700 0.91984500 1.0 Mn Mn8 1 0.62508700 0.48895400 0.25053300 1.0 Mn Mn9 1 0.33409400 0.52464000 0.08527600 1.0 Mn Mn10 1 0.34583500 0.53305700 0.41984500 1.0 Mn Mn11 1 0.37491300 0.48895400 0.75053300 1.0 O O12 1 0.88248000 0.79615100 0.63759300 1.0 O O13 1 0.89541500 0.78323600 0.97416600 1.0 O O14 1 0.11752000 0.79615100 0.13759300 1.0 O O15 1 0.10458500 0.78323600 0.47416600 1.0 O O16 1 0.39074000 0.71167200 0.30978900 1.0 O O17 1 0.62092500 0.72072800 0.47618100 1.0 O O18 1 0.60926000 0.71167200 0.80978900 1.0 O O19 1 0.37907500 0.72072800 0.97618100 1.0 O O20 1 0.37796800 0.29906200 0.18984100 1.0 O O21 1 0.62203200 0.29906200 0.68984100 1.0 F F22 1 0.87835700 0.74110900 0.29926800 1.0 F F23 1 0.12164300 0.74110900 0.79926800 1.0 F F24 1 0.61243300 0.74979000 0.13893100 1.0 F F25 1 0.38756700 0.74979000 0.63893100 1.0 F F26 1 0.63179200 0.28034900 0.02863800 1.0 F F27 1 0.61356500 0.23018900 0.36669400 1.0 F F28 1 0.36820800 0.28034900 0.52863800 1.0 F F29 1 0.38643500 0.23018900 0.86669400 1.0 F F30 1 0.86407200 0.23525900 0.19361200 1.0 F F31 1 0.87946500 0.25043200 0.52460400 1.0 F F32 1 0.10513100 0.21213500 0.35857400 1.0 F F33 1 0.12053500 0.25043200 0.02460400 1.0 F F34 1 0.89486900 0.21213500 0.85857400 1.0 F F35 1 0.13592800 0.23525900 0.69361200 1.0