Energies reported relative to the TS energy of -0.050420 -------------------------------------------------------------------------- Summary of reaction path following -------------------------------------------------------------------------- Energy RxCoord 1 -0.10949 -6.01566 2 -0.10948 -5.94937 3 -0.10945 -5.81682 4 -0.10932 -5.55189 5 -0.10911 -5.28913 6 -0.10875 -5.02739 7 -0.10812 -4.76548 8 -0.10699 -4.50555 9 -0.10481 -4.24379 10 -0.10101 -3.97944 11 -0.09550 -3.71435 12 -0.08857 -3.44909 13 -0.08060 -3.18379 14 -0.07196 -2.91846 15 -0.06298 -2.65313 16 -0.05395 -2.38780 17 -0.04506 -2.12248 18 -0.03650 -1.85716 19 -0.02840 -1.59185 20 -0.02088 -1.32655 21 -0.01410 -1.06125 22 -0.00829 -0.79596 23 -0.00377 -0.53066 24 -0.00093 -0.26538 25 0.00000 0.00000 26 -0.00079 0.26533 27 -0.00277 0.53056 28 -0.00537 0.79579 29 -0.00817 1.06102 30 -0.01094 1.32625 31 -0.01356 1.59150 32 -0.01599 1.85677 33 -0.01820 2.12207 34 -0.02021 2.38738 35 -0.02203 2.65270 36 -0.02368 2.91802 37 -0.02518 3.18334 38 -0.02654 3.44866 39 -0.02778 3.71398 40 -0.02892 3.97930 41 -0.02997 4.24462 42 -0.03093 4.50995 43 -0.03182 4.77527 44 -0.03265 5.04060 45 -0.03341 5.30592 46 -0.03412 5.57125 47 -0.03479 5.83658 48 -0.03540 6.10190 49 -0.03598 6.36722 50 -0.03652 6.63255 51 -0.03702 6.89787 52 -0.03750 7.16319 53 -0.03794 7.42851 54 -0.03836 7.69383 55 -0.03877 7.95915 56 -0.03915 8.22448 57 -0.03951 8.48980 58 -0.03986 8.75513 59 -0.04019 9.02046 60 -0.04050 9.28580 61 -0.04080 9.55113 62 -0.04109 9.81647 63 -0.04136 10.08180 64 -0.04162 10.34714 65 -0.04186 10.61248 66 -0.04210 10.87782 67 -0.04232 11.14316 68 -0.04252 11.40850 69 -0.04272 11.67384 70 -0.04290 11.93918 71 -0.04307 12.20453 72 -0.04323 12.46987 73 -0.04338 12.73521 74 -0.04352 13.00055 75 -0.04365 13.26589 76 -0.04377 13.53123 77 -0.04388 13.79657 78 -0.04399 14.06191 79 -0.04409 14.32725 80 -0.04418 14.59259 81 -0.04426 14.85794 82 -0.04434 15.12328 83 -0.04442 15.38863 84 -0.04449 15.65397 85 -0.04456 15.91932 86 -0.04462 16.18467 87 -0.04468 16.45001 88 -0.04473 16.71536 89 -0.04478 16.98070 90 -0.04483 17.24605 91 -0.04487 17.51139 92 -0.04491 17.77674 93 -0.04495 18.04208 --------------------------------------------------------------------------