# generated using pymatgen data_Mn10CoN9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.32491882 _cell_length_b 7.83538800 _cell_length_c 16.22496125 _cell_angle_alpha 90.00000000 _cell_angle_beta 95.60261023 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn10CoN9 _chemical_formula_sum 'Mn40 Co4 N36' _cell_volume 800.23863503 _cell_formula_units_Z 4 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 0.43756400 0.85511200 0.09282500 1.0 Mn Mn1 1 0.56243600 0.35511200 0.40717500 1.0 Mn Mn2 1 0.56243600 0.14488800 0.90717500 1.0 Mn Mn3 1 0.43756400 0.64488800 0.59282500 1.0 Mn Mn4 1 0.53027300 0.10753300 0.56992100 1.0 Mn Mn5 1 0.46972700 0.60753300 0.93007900 1.0 Mn Mn6 1 0.46972700 0.89246700 0.43007900 1.0 Mn Mn7 1 0.53027300 0.39246700 0.06992100 1.0 Mn Mn8 1 0.79796200 0.78874200 0.73069900 1.0 Mn Mn9 1 0.20203800 0.28874200 0.76930100 1.0 Mn Mn10 1 0.20203800 0.21125800 0.26930100 1.0 Mn Mn11 1 0.79796200 0.71125800 0.23069900 1.0 Mn Mn12 1 0.74650300 0.32444000 0.71722500 1.0 Mn Mn13 1 0.25349700 0.82444000 0.78277500 1.0 Mn Mn14 1 0.25349700 0.67556000 0.28277500 1.0 Mn Mn15 1 0.74650300 0.17556000 0.21722500 1.0 Mn Mn16 1 0.73162900 0.41418900 0.86760600 1.0 Mn Mn17 1 0.26837100 0.91418900 0.63239400 1.0 Mn Mn18 1 0.26837100 0.58581100 0.13239400 1.0 Mn Mn19 1 0.73162900 0.08581100 0.36760600 1.0 Mn Mn20 1 0.95850400 0.11270900 0.87029300 1.0 Mn Mn21 1 0.04149500 0.61270900 0.62970700 1.0 Mn Mn22 1 0.04149500 0.88729100 0.12970700 1.0 Mn Mn23 1 0.95850400 0.38729100 0.37029300 1.0 Mn Mn24 1 0.96893500 0.11722900 0.63712000 1.0 Mn Mn25 1 0.03106500 0.61722900 0.86288000 1.0 Mn Mn26 1 0.03106500 0.88277100 0.36288000 1.0 Mn Mn27 1 0.96893500 0.38277100 0.13712000 1.0 Mn Mn28 1 0.25083500 0.36827700 0.59745900 1.0 Mn Mn29 1 0.74916500 0.86827700 0.90254100 1.0 Mn Mn30 1 0.74916500 0.63172300 0.40254100 1.0 Mn Mn31 1 0.25083500 0.13172300 0.09745900 1.0 Mn Mn32 1 0.52047100 0.05502800 0.75726600 1.0 Mn Mn33 1 0.47952900 0.55502800 0.74273400 1.0 Mn Mn34 1 0.47952900 0.94497200 0.24273400 1.0 Mn Mn35 1 0.52047100 0.44497200 0.25726600 1.0 Mn Mn36 1 0.76603200 0.80276900 0.54261800 1.0 Mn Mn37 1 0.23396800 0.30276900 0.95738200 1.0 Mn Mn38 1 0.23396800 0.19723100 0.45738200 1.0 Mn Mn39 1 0.76603200 0.69723100 0.04261800 1.0 Co Co40 1 0.74529300 0.42613800 0.56835800 1.0 Co Co41 1 0.25470700 0.92613800 0.93164200 1.0 Co Co42 1 0.25470700 0.57386200 0.43164200 1.0 Co Co43 1 0.74529300 0.07386200 0.06835800 1.0 N N44 1 0.52421700 0.43059200 0.63829300 1.0 N N45 1 0.47578300 0.93059200 0.86170700 1.0 N N46 1 0.47578300 0.56940800 0.36170700 1.0 N N47 1 0.52421700 0.06940800 0.13829300 1.0 N N48 1 0.51836100 0.28257300 0.79797000 1.0 N N49 1 0.48163900 0.78257300 0.70203000 1.0 N N50 1 0.48163900 0.71742700 0.20203000 1.0 N N51 1 0.51836100 0.21742700 0.29797000 1.0 N N52 1 0.81137800 0.07168700 0.96200700 1.0 N N53 1 0.18862200 0.57168700 0.53799300 1.0 N N54 1 0.18862200 0.92831300 0.03799300 1.0 N N55 1 0.81137800 0.42831300 0.46200700 1.0 N N56 1 0.47837700 0.86592800 0.54808000 1.0 N N57 1 0.52162300 0.36592800 0.95192000 1.0 N N58 1 0.52162300 0.13407200 0.45192000 1.0 N N59 1 0.47837700 0.63407200 0.04808000 1.0 N N60 1 0.69475900 0.10066100 0.67312800 1.0 N N61 1 0.30524100 0.60066100 0.82687200 1.0 N N62 1 0.30524100 0.89933900 0.32687200 1.0 N N63 1 0.69475900 0.39933900 0.17312800 1.0 N N64 1 0.99674100 0.37401100 0.65560300 1.0 N N65 1 0.00325900 0.87401100 0.84439700 1.0 N N66 1 0.00325900 0.62598900 0.34439700 1.0 N N67 1 0.99674100 0.12598900 0.15560300 1.0 N N68 1 0.03518100 0.34663600 0.86734200 1.0 N N69 1 0.96481900 0.84663600 0.63265800 1.0 N N70 1 0.96481900 0.65336400 0.13265800 1.0 N N71 1 0.03518100 0.15336400 0.36734200 1.0 N N72 1 0.22160000 0.13487200 0.56875400 1.0 N N73 1 0.77840000 0.63487200 0.93124600 1.0 N N74 1 0.77840000 0.86512800 0.43124600 1.0 N N75 1 0.22160000 0.36512800 0.06875400 1.0 N N76 1 0.21936200 0.05550800 0.72853800 1.0 N N77 1 0.78063800 0.55550800 0.77146200 1.0 N N78 1 0.78063800 0.94449200 0.27146200 1.0 N N79 1 0.21936200 0.44449200 0.22853800 1.0