# generated using pymatgen data_Mn6O7F5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.62448333 _cell_length_b 5.66810254 _cell_length_c 15.31724974 _cell_angle_alpha 89.91491028 _cell_angle_beta 89.31829096 _cell_angle_gamma 89.50288406 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn6O7F5 _chemical_formula_sum 'Mn12 O14 F10' _cell_volume 401.45253822 _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 0.01651200 0.16659900 0.41199400 1.0 Mn Mn1 1 0.99940600 0.84642500 0.24285400 1.0 Mn Mn2 1 0.02068900 0.16050200 0.07899800 1.0 Mn Mn3 1 0.02062600 0.16394800 0.74525100 1.0 Mn Mn4 1 0.04204500 0.85007100 0.58125200 1.0 Mn Mn5 1 0.02612700 0.85350100 0.91140500 1.0 Mn Mn6 1 0.49124400 0.35161100 0.58891000 1.0 Mn Mn7 1 0.49345500 0.34049800 0.92193500 1.0 Mn Mn8 1 0.49281400 0.34475000 0.25366600 1.0 Mn Mn9 1 0.50306700 0.63435800 0.09374200 1.0 Mn Mn10 1 0.49079000 0.63958000 0.42066400 1.0 Mn Mn11 1 0.48374700 0.63338300 0.74990500 1.0 O O12 1 0.21169400 0.10628700 0.30116100 1.0 O O13 1 0.22721100 0.11282900 0.63672300 1.0 O O14 1 0.21908300 0.11374600 0.96950300 1.0 O O15 1 0.22941000 0.88515800 0.13543300 1.0 O O16 1 0.23006500 0.89245900 0.47016700 1.0 O O17 1 0.23488700 0.88752200 0.80121200 1.0 O O18 1 0.28023500 0.39352300 0.14518200 1.0 O O19 1 0.28358200 0.40008300 0.48260400 1.0 O O20 1 0.28091900 0.60910000 0.64331000 1.0 O O21 1 0.27670100 0.40084400 0.81403100 1.0 O O22 1 0.72697400 0.38404600 0.02756600 1.0 O O23 1 0.71920300 0.61680200 0.19640000 1.0 O O24 1 0.71603600 0.38015100 0.36101000 1.0 O O25 1 0.72055000 0.38208700 0.69472200 1.0 F F26 1 0.23404000 0.60776800 0.31132800 1.0 F F27 1 0.26914600 0.61769900 0.98455900 1.0 F F28 1 0.76074000 0.62117000 0.53304500 1.0 F F29 1 0.73138500 0.62539600 0.86192100 1.0 F F30 1 0.76580200 0.11918600 0.18275800 1.0 F F31 1 0.76518900 0.12516400 0.52591800 1.0 F F32 1 0.74643800 0.87169200 0.35641800 1.0 F F33 1 0.75633200 0.86795300 0.02230500 1.0 F F34 1 0.76949200 0.12492700 0.85218800 1.0 F F35 1 0.76436100 0.86918000 0.68996000 1.0