52 Coordinates from ORCA-job 004_Opt_OH+ Fe -0.01459451777365 -0.02624731130417 -0.03179018916890 O 0.14694302238757 -0.00958640088236 1.71533345096962 H 0.66523247022350 0.74149231738394 2.03664129639398 N 1.81161495120912 0.02371221193596 -0.42097121245700 N 0.14383766283472 1.81134539341058 -0.30108309220366 N -1.78769336717265 0.23956320647087 -0.47259744457659 N 0.09610214362036 -1.79674283973229 -0.55218138022073 C 2.38636161396258 1.24358917887384 -0.43018567952605 C 2.43982172321848 -1.19646804549042 -0.60277508086297 C -1.03372454125184 2.53436962199080 -0.39632189362643 C 1.40051816475553 2.30197428106429 -0.36233660550702 C -2.71785381909157 -0.74817845831191 -0.62369302783021 C -2.24182020224606 1.63422316517466 -0.61041768117353 C 1.44569613878345 -2.33273613748807 -0.80182136927859 C -0.96101919802590 -2.64873186293660 -0.68166723536932 C -2.33344015158049 -2.16824720173535 -0.20498891534426 O 3.64044287284503 -1.35113327686737 -0.63717021297442 O -1.10189205101400 3.74273962080056 -0.35875199074883 O -3.86159076382817 -0.52712492695933 -0.99900513814195 O -0.83977315744241 -3.79841353679078 -1.08429394343128 C -2.72857679028401 1.95050085880803 -2.03313677585944 C -3.29396406540914 1.99854499103066 0.43559639936420 C 1.80740202167532 -3.44949309641229 0.17478517624158 C 1.62746722805290 -2.77613638182634 -2.26115329131104 C 3.75511195999507 1.56413651588361 -0.54744244058694 C 4.11951068969172 2.89103477738915 -0.58443533270579 C 1.80889347771679 3.65001738217525 -0.42201406662877 C 3.15347687521733 3.92639051501380 -0.52497210658364 C -3.39510613639989 -3.13244009664103 -0.71558471155560 C -2.32480680407420 -2.20508861912598 1.33647715757448 H 4.49383043795131 0.76704599519975 -0.59236407968468 H 5.17816838348305 3.15573455656666 -0.65729171152747 H 1.06510606597805 4.44188540089568 -0.36951864536273 H 3.48768640028960 4.96735016888921 -0.55444140524940 H -1.96098441085063 1.67771575320330 -2.77656807958626 H -3.64865788154805 1.39290755394674 -2.24905679668878 H -2.92780588508975 3.03110276761067 -2.11593284738457 H -4.22790462248862 1.45295599510047 0.24549414773494 H -2.93403934100681 1.75470388523899 1.44985425985237 H -3.49234934938033 3.08112130071270 0.38854725299932 H 1.64226327645143 -3.12213282671186 1.21549615411700 H 1.19852062413424 -4.34183806586207 -0.02131659269258 H 2.87239814072284 -3.70385638116858 0.05383315501631 H 0.98355637925427 -3.63988025685163 -2.47034135868469 H 1.36494026316734 -1.95769608617704 -2.95234804129782 H 2.67990314159224 -3.05446841902724 -2.43073549235971 H -4.38277244214868 -2.83760660038986 -0.33376235269734 H -3.43940853135040 -3.13353759299956 -1.81602516324308 H -3.16483716898454 -4.15334983870741 -0.38003498799950 H -2.09878237114740 -3.22807651450833 1.68184721788318 H -1.58211312161408 -1.52174510457002 1.77247442484748 H -3.32032565745466 -1.92351812581317 1.71911501465336