File Name: Compound_3b SCF energy: –1449.663457 hartree Zero-point correction: +0.258353 hartree Enthalpy correction: +0.278462 hartree Free energy correction: +0.208520 hartree Truhlar's Delta G correction: +0.213349 hartree Grimme's Delta G correction: +0.212677 hartree Cartesian Coordinates O -0.31302 2.37239 0.97773 C -0.58196 1.68864 0.01884 P 0.52748 0.28093 -0.58096 C -0.57459 -1.18619 -0.21103 C -1.36464 -1.13384 1.07199 C -1.86581 -2.25987 1.61831 C -1.85070 -3.56588 0.98542 C -1.94573 -3.79599 -0.35286 C -2.06955 -2.78088 -1.38301 C -1.52117 -1.55034 -1.32734 H 0.15097 -2.01261 -0.12574 H -1.52530 -0.17875 1.57102 H -2.34592 -2.19688 2.59323 H -1.90463 -4.42836 1.64650 H -2.06851 -4.82829 -0.67416 H -2.66414 -3.04513 -2.25542 H -1.74623 -0.82924 -2.11035 C 1.62996 0.22863 0.94954 C 2.37677 -1.07574 1.05074 C 2.59762 1.38197 0.95198 H 0.96683 0.32628 1.81273 C 3.30222 -1.49447 0.16489 H 2.11907 -1.72196 1.88764 C 3.57781 1.55422 0.04213 H 2.46021 2.13155 1.72731 C 3.82963 -0.72978 -0.95239 H 3.71244 -2.49434 0.29484 C 3.95457 0.62051 -1.00402 H 4.15736 2.47420 0.09125 H 4.26086 -1.30574 -1.76838 H 4.47675 1.04322 -1.85979 P -2.07036 1.96181 -1.14708 O -3.13915 3.82465 0.71893 C -2.70932 3.07379 -0.03706