File Name: Compound_8n SCF energy: –2082.600060 hartree Zero-point correction: +0.793767 hartree Enthalpy correction: +0.840169 hartree Free energy correction: +0.720195 hartree Truhlar's Delta G correction: +0.726733 hartree Grimme's Delta G correction: +0.726561 hartree Cartesian Coordinates O 0.00008 -1.65181 0.00027 C 0.00001 -0.44141 0.00006 P -1.00853 0.75875 1.01270 C -0.00004 1.98997 -0.00029 P 1.00853 0.75850 -1.01289 O 0.00006 3.19410 -0.00035 C -2.80698 0.54665 0.42990 C -3.07571 -0.12968 -0.88211 C -3.21771 -0.87434 0.17849 C 2.80695 0.54664 -0.42995 C 3.07566 -0.12959 0.88211 C 3.21784 -0.87428 -0.17844 C 3.10080 0.03357 2.37301 C 2.06889 -0.91720 3.00326 C 4.50071 -0.34423 2.88402 C 2.77472 1.48160 2.74972 H 2.26673 -1.95494 2.71625 H 2.12141 -0.84299 4.09553 H 1.05096 -0.66175 2.69326 H 4.74132 -1.38143 2.62676 H 5.27017 0.30415 2.45341 H 4.53592 -0.24322 3.97463 H 3.52841 2.17120 2.35490 H 1.79577 1.78009 2.35625 H 2.75020 1.58943 3.83954 C 3.49355 -2.18680 -0.84265 C 3.15787 -3.31763 0.13766 C 2.62520 -2.30519 -2.10228 C 4.98097 -2.26340 -1.22536 H 2.09923 -3.28388 0.41332 H 3.36849 -4.28872 -0.32440 H 3.76007 -3.23598 1.04952 H 2.82662 -3.25759 -2.60525 H 1.56134 -2.27035 -1.84317 H 2.84110 -1.49292 -2.80528 H 5.18710 -3.23137 -1.69609 H 5.25345 -1.47571 -1.93467 H 5.61920 -2.16750 -0.34025 C 3.74401 1.60330 -1.06793 C 3.17633 3.00961 -0.84076 C 5.12892 1.52059 -0.41875 C 3.88174 1.34984 -2.57450 H 2.22383 3.15685 -1.36483 H 3.00169 3.20029 0.22412 H 3.87472 3.76586 -1.21677 H 5.57304 0.52587 -0.53285 H 5.79943 2.24915 -0.88721 H 5.07668 1.74821 0.65200 H 2.90897 1.36992 -3.07911 H 4.51008 2.12207 -3.03318 H 4.34478 0.37631 -2.76809 C -3.74414 1.60322 1.06790 C -5.12902 1.52046 0.41865 C -3.88193 1.34967 2.57445 C -3.17655 3.00958 0.84086 H -5.79959 2.24895 0.88711 H -5.07674 1.74814 -0.65208 H -5.57307 0.52571 0.53266 H -2.90919 1.36980 3.07911 H -4.51036 2.12182 3.03314 H -4.34491 0.37608 2.76795 H -2.22411 3.15688 1.36501 H -3.00185 3.20033 -0.22401 H -3.87504 3.76576 1.21684 C -3.49324 -2.18685 0.84279 C -4.98063 -2.26359 1.22560 C -3.15749 -3.31770 -0.13746 C -2.62480 -2.30508 2.10238 H -5.25316 -1.47590 1.93488 H -5.61891 -2.16781 0.34052 H -5.18662 -3.23156 1.69639 H -3.75975 -3.23617 -1.04930 H -2.09887 -3.28386 -0.41318 H -3.36799 -4.28879 0.32466 H -2.84075 -1.49280 2.80535 H -2.82610 -3.25748 2.60542 H -1.56097 -2.27015 1.84322 C -3.10099 0.03340 -2.37301 C -2.06898 -0.91723 -3.00331 C -4.50088 -0.34465 -2.88389 C -2.77518 1.48146 -2.74982 H -2.12160 -0.84309 -4.09557 H -1.05106 -0.66160 -2.69340 H -2.26662 -1.95499 -2.71623 H -4.74132 -1.38187 -2.62654 H -5.27040 0.30364 -2.45328 H -4.53618 -0.24374 -3.97450 H -2.75079 1.58925 -3.83964 H -3.52896 2.17095 -2.35496 H -1.79625 1.78014 -2.35645