# Saddle/wB97XD/def2svpp 0 1 C 5.548653504928 -0.451709768866 -0.571652291383 H 7.342301717281 -1.585352625380 -0.301778945181 C 6.796348891704 -0.888174781143 -0.945167221000 C 5.387598064550 0.888010383593 -2.630333468969 C 4.860630306968 0.463757272269 -1.423613817167 C 3.259659083481 1.410855774160 -3.764555443546 C 4.557126394444 1.796025468262 -3.469462080562 C 2.841137719818 3.440294602459 -4.988522895915 C 2.371869603489 2.238273367489 -4.513256854445 H 2.182051648953 4.081325798612 -5.582287696117 O 2.790781791073 0.218954186716 -3.302670300233 O 3.623403844626 0.889155074860 -1.050352650259 P 2.305102052657 0.116609297989 -1.717899151175 O 1.107565509035 0.953240762433 -1.442024702897 O 2.386445782962 -1.348587040559 -1.377756472337 H -0.183076931254 -3.589830162138 2.441045914868 H 0.006831263973 -5.218435176832 -3.091876172625 C -0.221307847648 -4.880917277196 -2.076852507749 C -0.789570475106 -4.004237178340 0.503637161165 C 0.594125615536 -3.927833764581 -1.477880753746 C 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3.611484729351 -3.544041206241 C 6.695486609130 4.845061899358 -3.991215322855 H 6.941702532494 3.029239166657 -2.892865121569 H 7.675511454046 5.230285535969 -3.695588925460 C 4.612328319315 5.157057925784 -5.164869356439 C 5.857004535250 5.624873099107 -4.823656836771 H 3.944532656034 5.759505100004 -5.788467144875 H 6.196348009827 6.601997973849 -5.178587737366 C -1.885484097324 -0.755268140148 3.708758353140 H -2.281024093272 -1.182780627249 4.644261561262 H -0.834317542578 -1.069319826214 3.634878064421 H -1.909696185357 0.343681942151 3.828171979908 C -4.232016053318 -1.193017927220 2.821185016378 H -4.618332392952 -0.155981261324 2.792230664009 H -4.801827523073 -1.773669377317 2.078661182270 H -4.447087737062 -1.592510875826 3.825733991499 Options END MinFC=-1 DownDC=999 MaxIRCSTEP=30 Saddle+IRC SaddleFC=99999 Gauproc=20 GauMem=4000 MaxStepSize=0.3 DownFC=9999999 Opt=Cartesian