# generated using pymatgen data_Mn6O7F5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.58756231 _cell_length_b 5.67141485 _cell_length_c 15.31632543 _cell_angle_alpha 90.04375814 _cell_angle_beta 89.63088294 _cell_angle_gamma 89.69334750 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn6O7F5 _chemical_formula_sum 'Mn12 O14 F10' _cell_volume 398.48557670 _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 0.00184300 0.15188200 0.40922900 1.0 Mn Mn1 1 0.01430600 0.84577300 0.24041300 1.0 Mn Mn2 1 0.02176800 0.16303800 0.07933700 1.0 Mn Mn3 1 0.03020000 0.16231000 0.74318300 1.0 Mn Mn4 1 0.01929300 0.83947900 0.57921800 1.0 Mn Mn5 1 0.02493400 0.85578200 0.91192900 1.0 Mn Mn6 1 0.50451900 0.36107900 0.59208800 1.0 Mn Mn7 1 0.49470900 0.33980400 0.92155100 1.0 Mn Mn8 1 0.49691600 0.34793300 0.25461100 1.0 Mn Mn9 1 0.50702600 0.63317300 0.09364000 1.0 Mn Mn10 1 0.51044700 0.65065700 0.42428100 1.0 Mn Mn11 1 0.47936500 0.63780100 0.75109700 1.0 O O12 1 0.21805300 0.11142100 0.30019900 1.0 O O13 1 0.23259500 0.11523300 0.63582200 1.0 O O14 1 0.21910400 0.11799600 0.97062900 1.0 O O15 1 0.23586000 0.88446000 0.13476200 1.0 O O16 1 0.21791000 0.88391100 0.46877500 1.0 O O17 1 0.23716200 0.88678700 0.80108400 1.0 O O18 1 0.28019000 0.39816200 0.14661600 1.0 O O19 1 0.27705700 0.60362800 0.64521600 1.0 O O20 1 0.27648500 0.39779800 0.81295500 1.0 O O21 1 0.72739700 0.38464200 0.02793600 1.0 O O22 1 0.72557500 0.61524700 0.19619900 1.0 O O23 1 0.71545300 0.38042300 0.36408500 1.0 O O24 1 0.72645200 0.61264900 0.53117600 1.0 O O25 1 0.72464100 0.38604400 0.69488800 1.0 F F26 1 0.25357200 0.61671700 0.32057200 1.0 F F27 1 0.25834100 0.37796700 0.48630200 1.0 F F28 1 0.26973900 0.61835800 0.98451400 1.0 F F29 1 0.72825700 0.62515400 0.86145300 1.0 F F30 1 0.76801500 0.12162500 0.18175900 1.0 F F31 1 0.75275200 0.12368000 0.52469900 1.0 F F32 1 0.75664400 0.88080800 0.34653700 1.0 F F33 1 0.75503400 0.86840600 0.02273500 1.0 F F34 1 0.77499800 0.12743800 0.84955700 1.0 F F35 1 0.76338800 0.87273400 0.69095200 1.0