# generated using pymatgen data_Mn6O7F5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.65149002 _cell_length_b 5.67529026 _cell_length_c 15.28970260 _cell_angle_alpha 91.15810523 _cell_angle_beta 90.83521139 _cell_angle_gamma 87.06035898 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn6O7F5 _chemical_formula_sum 'Mn12 O14 F10' _cell_volume 402.97554657 _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 0.00734400 0.16786800 0.42063900 1.0 Mn Mn1 1 0.03091100 0.85259400 0.24518500 1.0 Mn Mn2 1 0.00966800 0.15781600 0.08825000 1.0 Mn Mn3 1 0.01991200 0.16758800 0.74554200 1.0 Mn Mn4 1 0.02588000 0.84452300 0.58051600 1.0 Mn Mn5 1 0.00826000 0.86322100 0.91218900 1.0 Mn Mn6 1 0.47237500 0.34719600 0.58928400 1.0 Mn Mn7 1 0.47118900 0.32179000 0.92176500 1.0 Mn Mn8 1 0.51981100 0.34572800 0.25095000 1.0 Mn Mn9 1 0.49137800 0.63210900 0.08609500 1.0 Mn Mn10 1 0.47276200 0.63599900 0.41424900 1.0 Mn Mn11 1 0.47953900 0.63814600 0.75157700 1.0 O O12 1 0.21980700 0.11706000 0.63825800 1.0 O O13 1 0.20347700 0.10732800 0.97508300 1.0 O O14 1 0.24022900 0.88146900 0.13770100 1.0 O O15 1 0.22185100 0.88575000 0.47218800 1.0 O O16 1 0.23035400 0.89344700 0.80484800 1.0 O O17 1 0.28551300 0.38345100 0.14329400 1.0 O O18 1 0.27711600 0.61155700 0.30241000 1.0 O O19 1 0.26578200 0.38733200 0.47922600 1.0 O O20 1 0.27051300 0.61269600 0.64190900 1.0 O O21 1 0.27081500 0.38672000 0.81075700 1.0 O O22 1 0.71808400 0.37635600 0.02712000 1.0 O O23 1 0.72897700 0.39231600 0.36238500 1.0 O O24 1 0.71981100 0.38684200 0.69342800 1.0 O O25 1 0.79870300 0.11702600 0.19407900 1.0 F F26 1 0.25957400 0.10886700 0.31011000 1.0 F F27 1 0.24928500 0.60807300 0.97469200 1.0 F F28 1 0.75540100 0.62002700 0.19178800 1.0 F F29 1 0.72732400 0.61956600 0.52533600 1.0 F F30 1 0.73074100 0.63463800 0.86149500 1.0 F F31 1 0.74071900 0.11230100 0.53172600 1.0 F F32 1 0.78462500 0.89506200 0.35609100 1.0 F F33 1 0.75415500 0.87193800 0.02039300 1.0 F F34 1 0.76570100 0.13784100 0.84983800 1.0 F F35 1 0.77241600 0.87775900 0.68960500 1.0