66 Coordinates from ORCA-job 002_Opt_OH Fe 0.01166566306222 -0.04644932853214 0.01953596599535 O 0.00050197094383 -0.06405992202277 1.84196714543502 H 0.64247368890855 0.41299974614694 2.37716152624948 N 2.09875810164966 0.02983238638552 -0.08419490911834 N -0.52263717716872 1.82459376123202 -0.41658833023175 N -1.18167143008148 -1.59535787217695 -0.35871707725125 N 0.06026943329741 -0.13623926456237 -2.36380822439635 N -0.27737943219207 3.99344854587796 0.45046607128185 N -1.81246663853381 2.53192692087525 1.38785679227027 N -2.75808132209662 -3.09010102813860 0.53691335054824 N -0.57008163347386 -3.11057513564299 1.29554224733270 C -0.17585137063703 2.22881330128586 -1.77204606148875 C -0.60134638986202 1.12802705477917 -2.71381836219878 C -0.76266680236537 -1.30337213767225 -2.69893577021801 C -1.83313547262740 -1.52967088399554 -1.65552545168613 C -0.86121959388819 2.77164287980367 0.46557978377071 C 1.12331910315045 4.15849866981339 0.14762467269568 C -1.00824486587687 5.21029821922863 0.72084942145611 C -1.78044068014721 3.12443784558771 2.70509807703861 C -2.88281865501726 1.59246282826719 1.16784413385527 C 1.36468711942984 -0.23769249969060 -3.01100925072794 C -1.50383802179369 -2.57821863181686 0.48311114110695 C -3.93011241726566 -2.26261841508089 0.38873252292497 C -3.00674948810594 -4.50281873291521 0.70404028737358 C -0.88611747884262 -3.59812386996373 2.61731508762749 C 0.82847280192239 -3.15288448887359 0.94922774076452 H 0.90575256358189 2.41853365244650 -1.88435931890800 H -0.69487222242597 3.16257564027156 -2.04262687898800 H -1.68880975261080 0.99288922933663 -2.62702156391214 H -0.37876133694556 1.40314283671788 -3.76158735697032 H -0.10074235425430 -2.18221852793539 -2.71813825058593 H -1.20910028904695 -1.19441713178241 -3.70594402588999 H -2.58797951717736 -0.72441112600059 -1.68853405072183 H -2.35844352042064 -2.47034919160546 -1.88477435416867 H 1.63532604395919 3.18755902007225 0.18356992534554 H 1.57873929866254 4.81356793782179 0.91078567352889 H 1.28526386631085 4.62015865769903 -0.84315732929260 H -2.08858533869984 5.01093053869696 0.72997663152479 H -0.79690291989759 5.93632928997802 -0.08416620398569 H -0.71405731538167 5.66777636103559 1.68260567704262 H -0.80535480027923 3.59470765302382 2.88944858050520 H -1.92925936059728 2.32598389821414 3.45257989874577 H -2.57927181160552 3.87502013866094 2.84169425836577 H -2.94393089855910 1.33389532114392 0.10261016751139 H -3.83591786649089 2.05640308181655 1.47845437742018 H -2.73392541276854 0.67448495877391 1.76065959007793 H 1.25057918833102 -0.33535997267500 -4.10805860238006 H 1.90486166204713 -1.11698077243284 -2.63048118807851 H 1.96316634389150 0.65988299970089 -2.80174834673347 H -3.65820180862452 -1.20212605775774 0.47327790421258 H -4.64144123419554 -2.50095736595915 1.19932211231077 H -4.44093361856345 -2.43055758344952 -0.57668020683614 H -2.07285198093093 -5.06939013670776 0.58879199301330 H -3.71040758336098 -4.83423083238055 -0.08025883691995 H -3.45420622021079 -4.73620971359577 1.68700032470157 H -1.91127554891460 -3.31781671883501 2.89278450208296 H -0.19359573672576 -3.13421280844670 3.34046178683430 H -0.77654778071024 -4.69530005324511 2.68764773089524 H 0.95747801393216 -2.96878594630971 -0.12609962406978 H 1.22400731379512 -4.15671462899747 1.18489518907292 H 1.41005944365871 -2.41033182141875 1.52081455174445 C 3.23148235738668 0.22247293886916 -0.11210378483578 C 4.64328438560710 0.46921110315697 -0.17574154849197 H 5.17258131147648 -0.47260316293735 -0.39737902082212 H 4.85371985360221 1.19918990750746 -0.97536013552134 H 4.99744176478011 0.87072943012234 0.78825999415626