53 Coordinates from ORCA-job 023_Opt_O Fe 0.01524258411098 0.01464167412231 -0.03538638886906 O 0.01208655027770 0.01400572171492 1.58788252845801 N 2.04155408960614 -0.00006163105341 -0.21144546238960 N 0.25735527936191 2.02854738345549 -0.20764124551686 N -1.94970302815368 0.01523491652175 -0.29358969465629 N -0.22842605177782 -1.93215986302503 -0.29280332831796 N -0.00917532491082 -0.00277155745460 -2.07136959332519 C -2.88638180040307 0.35721171665581 0.58649008315191 C -4.23547752436830 0.27559632345754 0.26923789672078 C -4.60580132285005 -0.16701697182416 -0.99522878539958 C -3.61751363060303 -0.54723644956054 -1.90027134703349 C -2.29538521491050 -0.45389766811436 -1.50392679208600 H -2.53861306574861 0.69462032560381 1.56301597996888 H -4.97911866206004 0.56076044054102 1.01596664500494 H -5.66059392780587 -0.22949700500944 -1.27684079245071 H -3.86692092348029 -0.92264925951057 -2.89438989666257 C -0.01519339836969 -2.90357274213538 0.59032947330456 C -0.26698585502714 -4.23185545087299 0.27435969339748 C -0.74432962505628 -4.54585032515399 -0.99253984047546 C -0.99093636088027 -3.51862620502266 -1.90024257565325 C -0.73441202061640 -2.21820124056097 -1.50433024425311 H -0.94110005187733 -5.58415241026973 -1.27304924904065 H -1.39101152874803 -3.72017497439254 -2.89574462621566 H 0.35755301852806 -2.60012797682086 1.56879886393343 H -0.08398667579497 -5.00432439861921 1.02405463379211 C -1.10556790023511 -0.97443954966406 -2.26792161734290 H -1.33226559811552 -1.17498926507236 -3.32398560033160 C 1.30813411143326 -0.48359298155165 -2.52819241417399 C 2.40161517903449 0.08711178072615 -1.65952145808258 H 1.47309782886499 -0.21268979287378 -3.58375604067166 H 1.31291223985067 -1.57974820728942 -2.46807571187096 C -0.33243408135201 1.36388509823193 -2.52484741180798 C 0.36239757804305 2.38402270632775 -1.65731500806646 H -1.42025069919189 1.49528472585327 -2.46384349860680 H -0.04362237715434 1.49839248235198 -3.58023651076164 H -0.08876457525951 3.37508732446760 -1.81999449356173 H 1.41723368853731 2.48502747442014 -1.92391357306723 C 1.51025926046345 2.34521779749276 0.52172197532667 C 2.51033078096467 1.18925044654872 0.53696449955474 H 2.61074002510753 1.12931648514475 -1.90992883048667 H 3.33934886833918 -0.46277387412929 -1.83415182828164 H 3.49455772594267 1.48941117909759 0.14379530029274 H 2.65290298752741 0.86725878570304 1.57480126805929 H 1.22414206167842 2.56623198813572 1.55617290164630 H 1.94358012143657 3.26360094224576 0.09550278732936 C 2.67695973783593 -1.19652178847244 0.36550385213572 H 3.77093055585281 -1.05421534841214 0.38390804512733 H 2.44949330219028 -2.07578455677500 -0.25010041265696 H 2.31205476672389 -1.34850211781130 1.38939517766577 C -0.84339997611568 2.80287647514468 0.38976513847415 H -1.75400117679018 2.68266238803079 -0.21050407579846 H -0.56916057244321 3.87155220610349 0.40453568493571 H -1.02081056879886 2.45670610007068 1.41619140983692