Energies reported relative to the TS energy of -0.051505 -------------------------------------------------------------------------- Summary of reaction path following -------------------------------------------------------------------------- Energy RxCoord 1 -0.04255 -18.89411 2 -0.04251 -18.63546 3 -0.04247 -18.37673 4 -0.04243 -18.11794 5 -0.04238 -17.85913 6 -0.04234 -17.60031 7 -0.04229 -17.34148 8 -0.04224 -17.08265 9 -0.04218 -16.82383 10 -0.04212 -16.56500 11 -0.04206 -16.30617 12 -0.04200 -16.04734 13 -0.04193 -15.78850 14 -0.04186 -15.52967 15 -0.04178 -15.27084 16 -0.04170 -15.01200 17 -0.04161 -14.75316 18 -0.04152 -14.49432 19 -0.04142 -14.23548 20 -0.04131 -13.97664 21 -0.04120 -13.71779 22 -0.04107 -13.45895 23 -0.04094 -13.20010 24 -0.04081 -12.94125 25 -0.04066 -12.68240 26 -0.04050 -12.42355 27 -0.04034 -12.16470 28 -0.04016 -11.90585 29 -0.03997 -11.64700 30 -0.03977 -11.38815 31 -0.03956 -11.12930 32 -0.03933 -10.87045 33 -0.03910 -10.61160 34 -0.03885 -10.35275 35 -0.03858 -10.09390 36 -0.03830 -9.83506 37 -0.03801 -9.57621 38 -0.03771 -9.31736 39 -0.03738 -9.05851 40 -0.03705 -8.79966 41 -0.03669 -8.54082 42 -0.03633 -8.28197 43 -0.03594 -8.02313 44 -0.03554 -7.76429 45 -0.03512 -7.50545 46 -0.03468 -7.24661 47 -0.03422 -6.98777 48 -0.03374 -6.72894 49 -0.03324 -6.47011 50 -0.03271 -6.21128 51 -0.03216 -5.95245 52 -0.03157 -5.69362 53 -0.03096 -5.43479 54 -0.03031 -5.17597 55 -0.02962 -4.91714 56 -0.02889 -4.65832 57 -0.02811 -4.39950 58 -0.02727 -4.14068 59 -0.02635 -3.88186 60 -0.02536 -3.62303 61 -0.02428 -3.36421 62 -0.02308 -3.10539 63 -0.02176 -2.84657 64 -0.02029 -2.58774 65 -0.01865 -2.32892 66 -0.01683 -2.07010 67 -0.01481 -1.81130 68 -0.01258 -1.55252 69 -0.01016 -1.29377 70 -0.00759 -1.03503 71 -0.00499 -0.77629 72 -0.00257 -0.51756 73 -0.00073 -0.25882 74 0.00000 0.00000 75 -0.00089 0.25887 76 -0.00361 0.51767 77 -0.00799 0.77647 78 -0.01368 1.03527 79 -0.02035 1.29408 80 -0.02777 1.55288 81 -0.03576 1.81170 82 -0.04420 2.07052 83 -0.05294 2.32934 84 -0.06183 2.58817 85 -0.07065 2.84700 86 -0.07915 3.10583 87 -0.08703 3.36465 88 -0.09392 3.62342 89 -0.09947 3.88206 90 -0.10339 4.14015 91 -0.10567 4.39608 92 -0.10678 4.64841 93 -0.10738 4.90185 94 -0.10779 5.15875 95 -0.10811 5.41698 96 -0.10835 5.67572 97 -0.10852 5.93453 98 -0.10863 6.19330 99 -0.10865 6.32237 100 -0.10866 6.38699 --------------------------------------------------------------------------