Table 8C. Continuous split-core remanent measurements for Hole 1054C after 20 mT demagnetization. Leg Site Hole Core Type Section Interval Depth Declination Inclination Intensity (A/m) Demagnetization level NRM X mean (emu) NRM Y mean (emu) NRM Z mean (emu) Date Drift corrected Tray corrected Run # 172 1054 C 1 H 1 0 0 3.4 -6.2 1.95E-04 20 2.01E-05 1.00E-06 -4.04E-06 2/21/97 Yes Yes 695 172 1054 C 1 H 1 5 0.05 27 -4.9 4.64E-04 20 4.38E-05 2.25E-05 -7.28E-06 2/21/97 Yes Yes 695 172 1054 C 1 H 1 10 0.1 85 6.1 3.86E-04 20 3.43E-06 4.15E-05 6.63E-06 2/21/97 Yes Yes 695 172 1054 C 1 H 1 15 0.15 300 36 1.36E-03 20 5.97E-05 -1.03E-04 1.38E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 1 20 0.2 240 70 8.89E-04 20 -1.58E-05 -2.91E-05 1.44E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 1 25 0.25 130 41 5.40E-04 20 -2.81E-05 3.35E-05 6.12E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 30 0.3 92 38 2.15E-04 20 -8.65E-07 1.85E-05 2.26E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 35 0.35 120 61 4.14E-05 20 -1.15E-06 1.81E-06 6.05E-06 2/21/97 Yes Yes 695 172 1054 C 1 H 1 40 0.4 350 47 5.70E-05 20 4.15E-06 -3.94E-07 6.97E-06 2/21/97 Yes Yes 695 172 1054 C 1 H 1 45 0.45 300 67 7.37E-05 20 1.69E-06 -2.73E-06 1.14E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 50 0.5 6.9 48 1.20E-04 20 8.40E-06 8.73E-07 1.54E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 55 0.55 350 51 2.38E-04 20 1.57E-05 -2.44E-06 3.19E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 60 0.6 0.7 60 2.91E-04 20 1.55E-05 -5.59E-08 4.33E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 65 0.65 4.1 62 3.39E-04 20 1.67E-05 1.14E-06 5.17E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 70 0.7 21 62 3.69E-04 20 1.69E-05 6.82E-06 5.65E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 75 0.75 26 60 3.79E-04 20 1.84E-05 8.94E-06 5.63E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 80 0.8 24 56 4.26E-04 20 2.32E-05 1.05E-05 6.07E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 85 0.85 43 62 3.82E-04 20 1.41E-05 1.31E-05 5.80E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 90 0.9 40 50 3.16E-04 20 1.66E-05 1.37E-05 4.18E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 95 0.95 40 48 5.95E-04 20 3.19E-05 2.77E-05 7.71E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 100 1 49 53 7.07E-04 20 2.96E-05 3.44E-05 9.83E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 105 1.05 46 58 6.72E-04 20 2.62E-05 2.81E-05 9.83E-05 2/21/97 Yes Yes 695 172 1054 C 1 H 1 110 1.1 42 56 7.21E-04 20 3.13E-05 2.89E-05 1.03E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 1 115 1.15 42 58 7.39E-04 20 3.09E-05 2.78E-05 1.09E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 1 120 1.2 44 62 7.12E-04 20 2.58E-05 2.49E-05 1.09E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 1 125 1.25 42 54 9.82E-04 20 4.60E-05 4.17E-05 1.37E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 1 130 1.3 41 54 1.08E-03 20 5.12E-05 4.49E-05 1.52E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 1 135 1.35 41 60 1.01E-03 20 4.02E-05 3.61E-05 1.51E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 1 140 1.4 48 53 1.10E-03 20 4.76E-05 5.39E-05 1.51E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 1 145 1.45 45 47 1.25E-03 20 6.45E-05 6.54E-05 1.57E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 1 150 1.5 47 49 8.30E-04 20 3.99E-05 4.36E-05 1.08E-04 2/21/97 Yes Yes 695 172 1054 C 1 H 2 0 1.5 20 56 3.89E-04 20 2.13E-05 7.88E-06 5.54E-05 2/21/97 Yes Yes 698 172 1054 C 1 H 2 5 1.55 34 45 1.06E-03 20 6.64E-05 4.50E-05 1.29E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 10 1.6 38 47 1.13E-03 20 6.44E-05 5.08E-05 1.44E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 15 1.65 35 48 1.14E-03 20 6.61E-05 4.68E-05 1.48E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 20 1.7 38 49 1.16E-03 20 6.40E-05 5.12E-05 1.51E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 25 1.75 41 53 9.64E-04 20 4.67E-05 4.13E-05 1.33E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 30 1.8 37 52 8.40E-04 20 4.32E-05 3.37E-05 1.15E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 35 1.85 34 46 8.57E-04 20 5.20E-05 3.58E-05 1.07E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 40 1.9 30 45 1.05E-03 20 6.85E-05 4.08E-05 1.29E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 45 1.95 34 43 1.33E-03 20 8.52E-05 5.82E-05 1.57E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 50 2 34 46 1.33E-03 20 8.15E-05 5.54E-05 1.66E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 55 2.05 30 44 1.40E-03 20 9.15E-05 5.49E-05 1.70E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 60 2.1 36 47 1.30E-03 20 7.63E-05 5.60E-05 1.65E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 65 2.15 34 47 1.25E-03 20 7.38E-05 5.16E-05 1.59E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 70 2.2 32 49 1.23E-03 20 7.14E-05 4.66E-05 1.61E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 75 2.25 32 47 1.26E-03 20 7.78E-05 4.88E-05 1.58E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 80 2.3 32 44 1.46E-03 20 9.44E-05 6.09E-05 1.76E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 85 2.35 28 47 1.41E-03 20 9.01E-05 4.87E-05 1.79E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 90 2.4 31 47 1.41E-03 20 8.77E-05 5.28E-05 1.78E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 95 2.45 33 45 1.44E-03 20 9.04E-05 5.98E-05 1.76E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 100 2.5 26 46 1.53E-03 20 1.02E-04 5.06E-05 1.90E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 105 2.55 25 44 1.77E-03 20 1.23E-04 5.92E-05 2.12E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 110 2.6 31 43 1.87E-03 20 1.24E-04 7.51E-05 2.20E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 115 2.65 29 44 1.75E-03 20 1.18E-04 6.53E-05 2.09E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 120 2.7 28 42 1.78E-03 20 1.24E-04 6.78E-05 2.07E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 125 2.75 25 45 1.66E-03 20 1.14E-04 5.37E-05 2.03E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 130 2.8 24 41 1.99E-03 20 1.45E-04 6.69E-05 2.28E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 135 2.85 28 40 2.12E-03 20 1.52E-04 8.35E-05 2.35E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 140 2.9 23 41 1.95E-03 20 1.42E-04 6.22E-05 2.23E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 145 2.95 16 38 1.97E-03 20 1.57E-04 4.73E-05 2.11E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 2 150 3 16 37 1.48E-03 20 1.20E-04 3.54E-05 1.56E-04 2/21/97 Yes Yes 698 172 1054 C 1 H 3 0 3 12 44 6.44E-04 20 4.81E-05 9.84E-06 7.66E-05 2/21/97 Yes Yes 701 172 1054 C 1 H 3 5 3.05 23 40 1.79E-03 20 1.35E-04 5.76E-05 1.98E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 10 3.1 27 42 1.90E-03 20 1.33E-04 7.09E-05 2.20E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 15 3.15 23 45 1.58E-03 20 1.09E-04 4.79E-05 1.94E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 20 3.2 21 42 1.70E-03 20 1.25E-04 4.84E-05 1.98E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 25 3.25 30 45 1.65E-03 20 1.07E-04 6.22E-05 2.01E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 30 3.3 29 44 1.53E-03 20 1.01E-04 5.78E-05 1.85E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 35 3.35 25 42 1.43E-03 20 1.02E-04 4.81E-05 1.66E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 40 3.4 20 43 1.36E-03 20 1.00E-04 3.66E-05 1.59E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 45 3.45 20 42 1.33E-03 20 9.95E-05 3.65E-05 1.53E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 50 3.5 19 38 1.41E-03 20 1.11E-04 3.91E-05 1.50E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 55 3.55 18 42 1.32E-03 20 9.88E-05 3.37E-05 1.52E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 60 3.6 21 46 1.22E-03 20 8.43E-05 3.27E-05 1.51E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 65 3.65 26 42 1.32E-03 20 9.27E-05 4.71E-05 1.53E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 70 3.7 26 40 1.52E-03 20 1.11E-04 5.58E-05 1.70E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 75 3.75 24 42 1.50E-03 20 1.08E-04 4.92E-05 1.75E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 80 3.8 24 43 1.51E-03 20 1.07E-04 4.88E-05 1.79E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 85 3.85 21 47 1.27E-03 20 8.55E-05 3.29E-05 1.61E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 90 3.9 16 46 1.12E-03 20 7.89E-05 2.30E-05 1.39E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 95 3.95 16 40 1.26E-03 20 9.77E-05 2.91E-05 1.40E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 100 4 18 39 1.26E-03 20 9.82E-05 3.28E-05 1.39E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 105 4.05 15 38 1.20E-03 20 9.70E-05 2.57E-05 1.29E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 110 4.1 16 39 1.15E-03 20 9.07E-05 2.60E-05 1.25E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 115 4.15 19 41 1.04E-03 20 7.91E-05 2.72E-05 1.17E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 120 4.2 15 41 1.00E-03 20 7.75E-05 2.18E-05 1.15E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 125 4.25 12 36 1.30E-03 20 1.09E-04 2.36E-05 1.34E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 130 4.3 17 38 1.47E-03 20 1.18E-04 3.66E-05 1.57E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 135 4.35 14 40 1.41E-03 20 1.11E-04 2.84E-05 1.58E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 140 4.4 14 39 1.53E-03 20 1.24E-04 3.04E-05 1.65E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 145 4.45 14 36 1.53E-03 20 1.29E-04 3.16E-05 1.54E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 3 150 4.5 18 39 1.08E-03 20 8.45E-05 2.82E-05 1.18E-04 2/21/97 Yes Yes 701 172 1054 C 1 H 4 0 4.5 2.9 37 3.88E-04 20 3.26E-05 1.49E-06 3.97E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 5 4.55 6.2 29 1.15E-03 20 1.06E-04 1.18E-05 9.60E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 10 4.6 6.3 32 1.20E-03 20 1.07E-04 1.22E-05 1.09E-04 2/21/97 Yes Yes 704 172 1054 C 1 H 4 15 4.65 7.5 40 8.76E-04 20 7.07E-05 9.53E-06 9.69E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 20 4.7 11 37 8.32E-04 20 6.93E-05 1.38E-05 8.60E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 25 4.75 11 32 8.70E-04 20 7.66E-05 1.50E-05 8.04E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 30 4.8 8.6 36 7.73E-04 20 6.53E-05 1.02E-05 7.88E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 35 4.85 9.6 36 7.82E-04 20 6.64E-05 1.15E-05 7.87E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 40 4.9 10 34 7.74E-04 20 6.67E-05 1.26E-05 7.55E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 45 4.95 8.5 37 6.74E-04 20 5.61E-05 8.48E-06 7.07E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 50 5 9.4 36 6.85E-04 20 5.76E-05 9.69E-06 7.03E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 55 5.05 8.4 37 7.68E-04 20 6.45E-05 9.75E-06 7.96E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 60 5.1 6 36 8.54E-04 20 7.31E-05 7.68E-06 8.64E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 65 5.15 9.4 31 1.21E-03 20 1.08E-04 1.82E-05 1.08E-04 2/21/97 Yes Yes 704 172 1054 C 1 H 4 70 5.2 10 33 1.28E-03 20 1.12E-04 2.05E-05 1.22E-04 2/21/97 Yes Yes 704 172 1054 C 1 H 4 75 5.25 9.6 36 1.06E-03 20 8.90E-05 1.55E-05 1.09E-04 2/21/97 Yes Yes 704 172 1054 C 1 H 4 80 5.3 7.2 40 7.59E-04 20 6.12E-05 7.88E-06 8.39E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 85 5.35 7.4 40 6.61E-04 20 5.35E-05 6.97E-06 7.28E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 90 5.4 3.6 36 6.31E-04 20 5.42E-05 3.25E-06 6.37E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 95 5.45 1.4 31 8.52E-04 20 7.73E-05 2.09E-06 7.66E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 100 5.5 5.7 35 9.38E-04 20 8.11E-05 8.49E-06 9.31E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 105 5.55 3.5 36 8.17E-04 20 6.96E-05 4.41E-06 8.39E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 110 5.6 2.3 32 9.79E-04 20 8.78E-05 3.71E-06 8.94E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 115 5.65 5.7 31 1.16E-03 20 1.04E-04 1.05E-05 1.04E-04 2/21/97 Yes Yes 704 172 1054 C 1 H 4 120 5.7 7.6 34 1.11E-03 20 9.65E-05 1.33E-05 1.08E-04 2/21/97 Yes Yes 704 172 1054 C 1 H 4 125 5.75 7.6 36 1.05E-03 20 8.95E-05 1.22E-05 1.07E-04 2/21/97 Yes Yes 704 172 1054 C 1 H 4 130 5.8 4.8 34 1.09E-03 20 9.53E-05 8.21E-06 1.06E-04 2/21/97 Yes Yes 704 172 1054 C 1 H 4 135 5.85 360 36 9.74E-04 20 8.35E-05 -3.15E-06 9.95E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 140 5.9 5.8 31 1.11E-03 20 1.00E-04 1.05E-05 9.92E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 145 5.95 8.2 27 1.22E-03 20 1.14E-04 1.67E-05 9.55E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 4 150 6 11 30 6.02E-04 20 5.44E-05 1.14E-05 5.21E-05 2/21/97 Yes Yes 704 172 1054 C 1 H 5 0 6 2.9 37 2.22E-04 20 1.83E-05 7.41E-07 2.30E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 5 6.05 5.1 35 5.15E-04 20 4.45E-05 4.12E-06 5.08E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 10 6.1 360 38 6.30E-04 20 5.26E-05 -1.67E-06 6.69E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 15 6.15 350 42 6.83E-04 20 5.34E-05 -7.44E-06 7.86E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 20 6.2 1.9 44 5.54E-04 20 4.24E-05 1.38E-06 6.62E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 25 6.25 360 43 4.67E-04 20 3.59E-05 -9.39E-07 5.54E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 30 6.3 360 42 4.57E-04 20 3.57E-05 -2.72E-06 5.28E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 35 6.35 360 37 5.40E-04 20 4.56E-05 -2.13E-06 5.60E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 40 6.4 360 40 4.92E-04 20 3.99E-05 -6.15E-07 5.49E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 45 6.45 1.7 53 2.00E-04 20 1.27E-05 2.92E-07 2.74E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 50 6.5 0.4 66 6.26E-05 20 2.63E-06 -9.01E-08 9.84E-06 2/21/97 Yes Yes 707 172 1054 C 1 H 5 55 6.55 350 36 1.01E-04 20 8.44E-06 -1.09E-06 1.03E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 60 6.6 350 37 1.08E-04 20 9.05E-06 -1.08E-06 1.10E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 65 6.65 350 39 9.68E-05 20 7.65E-06 -2.03E-06 1.04E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 70 6.7 350 28 1.58E-04 20 1.44E-05 -3.27E-06 1.26E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 75 6.75 350 23 3.87E-04 20 3.75E-05 -4.63E-06 2.56E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 80 6.8 360 25 5.36E-04 20 5.12E-05 -4.30E-06 3.90E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 85 6.85 360 26 3.49E-04 20 3.31E-05 -2.26E-06 2.61E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 90 6.9 350 31 1.53E-04 20 1.37E-05 -2.60E-06 1.34E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 95 6.95 350 22 2.88E-04 20 2.79E-05 -4.74E-06 1.86E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 100 7 350 20 6.03E-04 20 5.93E-05 -8.65E-06 3.62E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 105 7.05 350 21 8.87E-04 20 8.74E-05 -1.06E-05 5.36E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 110 7.1 350 30 9.68E-04 20 8.76E-05 -1.47E-05 8.31E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 115 7.15 340 40 8.11E-04 20 6.38E-05 -1.81E-05 8.99E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 120 7.2 340 36 8.15E-04 20 6.75E-05 -2.05E-05 8.26E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 125 7.25 350 34 8.05E-04 20 6.95E-05 -1.38E-05 7.82E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 130 7.3 360 48 7.42E-04 20 5.26E-05 -1.17E-06 9.58E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 135 7.35 350 57 6.31E-04 20 3.60E-05 -8.28E-06 9.13E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 140 7.4 350 37 8.06E-04 20 6.77E-05 -1.31E-05 8.31E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 145 7.45 350 27 8.88E-04 20 8.37E-05 -8.87E-06 6.90E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 5 150 7.5 360 29 5.83E-04 20 5.41E-05 -4.46E-06 4.85E-05 2/21/97 Yes Yes 707 172 1054 C 1 H 6 0 7.5 350 30 1.10E-04 20 9.56E-06 -1.55E-06 9.31E-06 2/21/97 Yes Yes 710 172 1054 C 1 H 6 5 7.55 350 19 5.08E-04 20 5.08E-05 -4.79E-06 2.77E-05 2/21/97 Yes Yes 710 172 1054 C 1 H 6 10 7.6 350 16 5.29E-04 20 5.25E-05 -1.16E-05 2.53E-05 2/21/97 Yes Yes 710 172 1054 C 1 H 6 15 7.65 350 21 3.68E-04 20 3.57E-05 -6.72E-06 2.29E-05 2/21/97 Yes Yes 710 172 1054 C 1 H 6 20 7.7 340 27 4.19E-04 20 3.78E-05 -1.24E-05 3.27E-05 2/21/97 Yes Yes 710 172 1054 C 1 H 6 25 7.75 330 33 6.57E-04 20 5.22E-05 -2.66E-05 6.20E-05 2/21/97 Yes Yes 710 172 1054 C 1 H 6 30 7.8 340 38 1.18E-03 20 9.41E-05 -3.19E-05 1.25E-04 2/21/97 Yes Yes 710 172 1054 C 1 H 6 35 7.85 340 62 1.03E-03 20 4.74E-05 -1.96E-05 1.57E-04 2/21/97 Yes Yes 710 172 1054 C 1 H 6 40 7.9 310 43 4.74E-04 20 2.58E-05 -2.69E-05 5.57E-05 2/21/97 Yes Yes 710 172 1054 C 1 H 6 45 7.95 330 6.9 6.65E-04 20 5.93E-05 -3.81E-05 1.37E-05 2/21/97 Yes Yes 710 172 1054 C 1 H 6 50 8 330 -2.9 7.59E-04 20 6.90E-05 -4.21E-05 -6.74E-06 2/21/97 Yes Yes 710 172 1054 C 1 H 6 55 8.05 340 -0.5 1.01E-03 20 9.87E-05 -4.10E-05 -1.60E-06 2/21/97 Yes Yes 710 172 1054 C 1 H 6 60 8.1 350 35 7.03E-04 20 6.03E-05 -1.07E-05 6.93E-05 2/21/97 Yes Yes 710 172 1054 C 2 H 1 0 8.2 150 42 1.18E-04 20 -8.66E-06 4.12E-06 1.32E-05 2/21/97 Yes Yes 713 172 1054 C 2 H 1 5 8.25 170 9.7 2.17E-04 20 -2.24E-05 3.71E-06 6.00E-06 2/21/97 Yes Yes 713 172 1054 C 2 H 1 10 8.3 13 26 1.72E-04 20 1.59E-05 3.85E-06 1.27E-05 2/21/97 Yes Yes 713 172 1054 C 2 H 1 15 8.35 60 -17 6.72E-04 20 3.37E-05 6.05E-05 -3.50E-05 2/21/97 Yes Yes 713 172 1054 C 2 H 1 20 8.4 42 -27 9.68E-04 20 6.78E-05 6.23E-05 -7.77E-05 2/21/97 Yes Yes 713 172 1054 C 2 H 1 25 8.45 330 4.9 1.44E-03 20 1.29E-04 -8.19E-05 2.09E-05 2/21/97 Yes Yes 713 172 1054 C 2 H 1 30 8.5 310 41 2.34E-03 20 1.22E-04 -1.43E-04 2.69E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 35 8.55 300 65 2.41E-03 20 5.55E-05 -9.57E-05 3.78E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 40 8.6 300 77 2.38E-03 20 2.52E-05 -5.29E-05 4.02E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 45 8.65 280 73 2.45E-03 20 1.40E-05 -7.77E-05 4.06E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 50 8.7 260 64 2.28E-03 20 -1.26E-05 -1.07E-04 3.56E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 55 8.75 270 60 2.20E-03 20 -9.38E-06 -1.20E-04 3.30E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 60 8.8 270 61 2.18E-03 20 -1.08E-06 -1.15E-04 3.30E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 65 8.85 260 59 2.08E-03 20 -1.69E-05 -1.14E-04 3.10E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 70 8.9 260 55 2.01E-03 20 -3.03E-05 -1.20E-04 2.88E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 75 8.95 250 53 1.95E-03 20 -3.73E-05 -1.21E-04 2.70E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 80 9 260 52 1.94E-03 20 -2.84E-05 -1.26E-04 2.65E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 85 9.05 260 51 2.06E-03 20 -2.49E-05 -1.38E-04 2.77E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 90 9.1 260 50 2.07E-03 20 -2.68E-05 -1.43E-04 2.74E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 95 9.15 260 46 2.12E-03 20 -2.39E-05 -1.57E-04 2.65E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 100 9.2 260 43 1.91E-03 20 -1.56E-05 -1.49E-04 2.27E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 105 9.25 270 41 1.62E-03 20 3.83E-06 -1.33E-04 1.82E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 110 9.3 270 35 1.72E-03 20 1.05E-05 -1.51E-04 1.72E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 115 9.35 270 37 1.66E-03 20 3.72E-06 -1.45E-04 1.72E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 120 9.4 270 36 1.64E-03 20 2.45E-06 -1.45E-04 1.66E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 125 9.45 270 33 1.69E-03 20 -2.68E-07 -1.54E-04 1.61E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 130 9.5 270 30 1.85E-03 20 -3.13E-06 -1.73E-04 1.62E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 135 9.55 260 30 1.86E-03 20 -1.65E-05 -1.74E-04 1.59E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 140 9.6 260 26 1.95E-03 20 -2.10E-05 -1.88E-04 1.49E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 145 9.65 260 25 2.10E-03 20 -1.91E-05 -2.06E-04 1.51E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 1 150 9.7 260 28 1.50E-03 20 -1.62E-05 -1.43E-04 1.23E-04 2/21/97 Yes Yes 713 172 1054 C 2 H 2 0 9.7 260 32 5.02E-04 20 -1.20E-05 -4.48E-05 4.58E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 5 9.75 260 19 1.62E-03 20 -3.17E-05 -1.63E-04 9.05E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 10 9.8 260 21 1.44E-03 20 -2.03E-05 -1.44E-04 8.95E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 15 9.85 260 20 1.49E-03 20 -3.36E-05 -1.47E-04 8.93E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 20 9.9 260 16 1.42E-03 20 -3.13E-05 -1.45E-04 6.61E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 25 9.95 270 16 1.26E-03 20 -1.02E-05 -1.31E-04 6.04E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 30 10 260 17 1.21E-03 20 -1.18E-05 -1.25E-04 6.25E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 35 10.05 270 13 1.30E-03 20 -7.61E-06 -1.37E-04 5.12E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 40 10.1 270 8.8 1.36E-03 20 7.95E-06 -1.46E-04 3.60E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 45 10.15 270 7.6 1.30E-03 20 6.60E-06 -1.40E-04 2.96E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 50 10.2 270 6.8 1.21E-03 20 3.68E-06 -1.31E-04 2.48E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 55 10.25 270 11 1.22E-03 20 -1.54E-06 -1.30E-04 4.08E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 60 10.3 260 18 1.32E-03 20 -1.36E-05 -1.36E-04 6.85E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 65 10.35 270 14 1.41E-03 20 -2.22E-06 -1.48E-04 5.92E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 70 10.4 280 12 1.10E-03 20 1.57E-05 -1.15E-04 4.04E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 75 10.45 280 13 1.07E-03 20 1.72E-05 -1.12E-04 4.01E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 80 10.5 270 15 8.97E-04 20 7.52E-06 -9.35E-05 4.09E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 85 10.55 280 13 8.22E-04 20 1.08E-05 -8.62E-05 3.25E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 90 10.6 280 7.7 9.18E-04 20 2.06E-05 -9.67E-05 2.11E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 95 10.65 280 14 8.94E-04 20 1.44E-05 -9.28E-05 3.78E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 100 10.7 280 20 8.39E-04 20 7.99E-06 -8.49E-05 5.02E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 105 10.75 280 25 6.37E-04 20 6.00E-06 -6.25E-05 4.59E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 110 10.8 280 13 6.59E-04 20 1.11E-05 -6.86E-05 2.47E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 115 10.85 280 9.3 6.99E-04 20 1.72E-05 -7.29E-05 1.90E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 120 10.9 280 14 6.21E-04 20 1.22E-05 -6.43E-05 2.51E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 125 10.95 270 20 4.85E-04 20 1.82E-06 -4.93E-05 2.95E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 130 11 260 31 4.04E-04 20 -9.25E-06 -3.63E-05 3.57E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 135 11.05 260 19 4.80E-04 20 -1.03E-05 -4.80E-05 2.69E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 140 11.1 260 13 4.55E-04 20 -9.31E-06 -4.70E-05 1.81E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 145 11.15 260 14 4.92E-04 20 -4.67E-06 -5.16E-05 2.03E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 2 150 11.2 280 21 3.36E-04 20 5.24E-06 -3.34E-05 2.07E-05 2/21/97 Yes Yes 716 172 1054 C 2 H 3 0 11.2 230 -1 7.47E-05 20 -5.81E-06 -6.18E-06 -6.23E-07 2/21/97 Yes Yes 719 172 1054 C 2 H 3 5 11.25 260 9.8 2.99E-04 20 -3.00E-06 -3.18E-05 8.45E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 10 11.3 280 12 2.67E-04 20 2.49E-06 -2.82E-05 8.86E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 15 11.35 270 14 1.67E-04 20 -1.49E-07 -1.76E-05 6.62E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 20 11.4 260 10 1.66E-04 20 -2.70E-06 -1.76E-05 4.61E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 25 11.45 260 3.1 1.92E-04 20 -2.37E-06 -2.06E-05 1.56E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 30 11.5 260 7.6 2.53E-04 20 -4.76E-06 -2.68E-05 5.69E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 35 11.55 260 6.7 2.27E-04 20 -3.46E-06 -2.42E-05 4.36E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 40 11.6 270 2.5 2.17E-04 20 1.87E-06 -2.34E-05 1.37E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 45 11.65 280 -3.3 2.10E-04 20 3.23E-06 -2.26E-05 -2.38E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 50 11.7 280 -9.6 2.07E-04 20 5.41E-06 -2.15E-05 -6.06E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 55 11.75 280 -3 2.46E-04 20 5.89E-06 -2.59E-05 -2.24E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 60 11.8 280 1.5 2.60E-04 20 3.62E-06 -2.81E-05 9.17E-07 2/21/97 Yes Yes 719 172 1054 C 2 H 3 65 11.85 280 -3.6 2.59E-04 20 3.89E-06 -2.78E-05 -2.93E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 70 11.9 280 -5.7 2.59E-04 20 5.26E-06 -2.73E-05 -4.65E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 75 11.95 280 -12 2.81E-04 20 4.72E-06 -2.93E-05 -1.08E-05 2/21/97 Yes Yes 719 172 1054 C 2 H 3 80 12 280 -13 2.71E-04 20 5.45E-06 -2.82E-05 -1.06E-05 2/21/97 Yes Yes 719 172 1054 C 2 H 3 85 12.05 280 -9.8 2.24E-04 20 3.45E-06 -2.38E-05 -6.94E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 90 12.1 270 -6.9 3.30E-04 20 -1.39E-06 -3.59E-05 -7.02E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 95 12.15 270 -8.4 5.12E-04 20 -4.62E-06 -5.47E-05 -1.31E-05 2/21/97 Yes Yes 719 172 1054 C 2 H 3 100 12.2 270 -13 5.68E-04 20 2.57E-06 -5.99E-05 -2.20E-05 2/21/97 Yes Yes 719 172 1054 C 2 H 3 105 12.25 280 -16 4.22E-04 20 8.07E-06 -4.33E-05 -2.04E-05 2/21/97 Yes Yes 719 172 1054 C 2 H 3 110 12.3 280 -11 2.24E-04 20 2.12E-06 -2.37E-05 -8.04E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 115 12.35 280 10 1.92E-04 20 2.91E-06 -2.04E-05 5.32E-06 2/21/97 Yes Yes 719 172 1054 C 2 H 3 120 12.4 270 50 1.51E-04 20 -4.06E-07 -1.05E-05 1.98E-05 2/21/97 Yes Yes 719 172 1054 C 2 H 3 125 12.45 210 76 2.36E-04 20 -5.29E-06 -3.35E-06 3.98E-05 2/21/97 Yes Yes 719 172 1054 C 2 H 3 130 12.5 250 57 5.21E-04 20 -8.32E-06 -2.98E-05 7.53E-05 2/21/97 Yes Yes 719 172 1054 C 2 H 3 135 12.55 260 35 1.24E-03 20 -1.07E-05 -1.10E-04 1.22E-04 2/21/97 Yes Yes 719 172 1054 C 2 H 3 140 12.6 260 33 1.48E-03 20 -1.54E-05 -1.33E-04 1.42E-04 2/21/97 Yes Yes 719 172 1054 C 2 H 3 145 12.65 270 33 1.42E-03 20 -1.02E-05 -1.29E-04 1.32E-04 2/21/97 Yes Yes 719 172 1054 C 2 H 3 150 12.7 270 33 9.81E-04 20 -3.42E-06 -8.88E-05 9.28E-05 2/21/97 Yes Yes 719 172 1054 C 2 H 4 0 12.7 280 48 3.14E-04 20 3.27E-06 -2.28E-05 3.98E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 5 12.75 250 36 8.64E-04 20 -2.27E-05 -7.20E-05 8.82E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 10 12.8 230 27 1.09E-03 20 -6.87E-05 -7.78E-05 8.62E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 15 12.85 230 3 9.36E-04 20 -6.42E-05 -7.73E-05 8.22E-06 2/21/97 Yes Yes 722 172 1054 C 2 H 4 20 12.9 250 -6.9 6.66E-04 20 -2.07E-05 -6.86E-05 -1.42E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 25 12.95 260 -1.1 6.89E-04 20 -1.87E-05 -7.23E-05 -2.69E-06 2/21/97 Yes Yes 722 172 1054 C 2 H 4 30 13 250 1.7 6.60E-04 20 -2.47E-05 -6.70E-05 3.34E-06 2/21/97 Yes Yes 722 172 1054 C 2 H 4 35 13.05 250 -3 5.50E-04 20 -2.12E-05 -5.56E-05 -5.24E-06 2/21/97 Yes Yes 722 172 1054 C 2 H 4 40 13.1 260 -9.7 4.76E-04 20 -8.66E-06 -5.01E-05 -1.42E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 45 13.15 270 -11 4.49E-04 20 -7.43E-07 -4.80E-05 -1.48E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 50 13.2 270 -2.4 3.65E-04 20 1.30E-06 -3.97E-05 -2.71E-06 2/21/97 Yes Yes 722 172 1054 C 2 H 4 55 13.25 260 8 3.60E-04 20 -8.75E-06 -3.78E-05 8.55E-06 2/21/97 Yes Yes 722 172 1054 C 2 H 4 60 13.3 260 9.2 3.67E-04 20 -4.30E-06 -3.93E-05 9.82E-06 2/21/97 Yes Yes 722 172 1054 C 2 H 4 65 13.35 270 12 4.18E-04 20 -3.03E-06 -4.42E-05 1.54E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 70 13.4 260 18 4.78E-04 20 -1.23E-05 -4.76E-05 2.50E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 75 13.45 250 20 5.57E-04 20 -1.57E-05 -5.46E-05 3.20E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 80 13.5 250 25 4.87E-04 20 -1.38E-05 -4.61E-05 3.50E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 85 13.55 260 31 4.81E-04 20 -1.07E-05 -4.36E-05 4.26E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 90 13.6 290 49 4.91E-04 20 1.42E-05 -3.23E-05 6.39E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 95 13.65 260 58 5.51E-04 20 -4.67E-06 -3.14E-05 8.09E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 100 13.7 250 48 5.48E-04 20 -1.33E-05 -3.71E-05 7.07E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 105 13.75 240 47 5.33E-04 20 -1.64E-05 -3.57E-05 6.73E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 110 13.8 240 43 5.19E-04 20 -1.76E-05 -3.73E-05 6.03E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 115 13.85 250 39 5.53E-04 20 -1.15E-05 -4.51E-05 6.00E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 120 13.9 260 41 5.88E-04 20 -1.14E-05 -4.67E-05 6.67E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 125 13.95 250 43 5.85E-04 20 -1.53E-05 -4.36E-05 6.96E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 130 14 250 45 5.31E-04 20 -1.32E-05 -3.86E-05 6.47E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 135 14.05 260 41 5.52E-04 20 -1.02E-05 -4.37E-05 6.33E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 140 14.1 250 40 5.93E-04 20 -1.73E-05 -4.64E-05 6.53E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 145 14.15 250 36 5.95E-04 20 -1.84E-05 -4.88E-05 6.06E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 4 150 14.2 250 40 3.83E-04 20 -8.30E-06 -3.03E-05 4.28E-05 2/21/97 Yes Yes 722 172 1054 C 2 H 5 0 14.2 230 65 1.05E-04 20 -3.17E-06 -4.19E-06 1.64E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 5 14.25 250 30 3.79E-04 20 -1.44E-05 -3.24E-05 3.26E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 10 14.3 250 22 4.86E-04 20 -1.61E-05 -4.60E-05 3.13E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 15 14.35 250 23 3.80E-04 20 -1.08E-05 -3.62E-05 2.60E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 20 14.4 250 26 3.59E-04 20 -1.17E-05 -3.28E-05 2.75E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 25 14.45 250 26 3.51E-04 20 -1.38E-05 -3.12E-05 2.65E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 30 14.5 240 28 3.26E-04 20 -1.42E-05 -2.76E-05 2.68E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 35 14.55 250 26 3.47E-04 20 -1.26E-05 -3.12E-05 2.67E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 40 14.6 250 27 3.80E-04 20 -9.85E-06 -3.54E-05 2.93E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 45 14.65 250 28 4.61E-04 20 -1.39E-05 -4.21E-05 3.73E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 50 14.7 240 24 4.56E-04 20 -1.87E-05 -4.10E-05 3.22E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 55 14.75 250 25 4.40E-04 20 -1.58E-05 -4.04E-05 3.18E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 60 14.8 240 30 4.18E-04 20 -1.84E-05 -3.48E-05 3.56E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 65 14.85 240 31 3.83E-04 20 -1.66E-05 -3.13E-05 3.45E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 70 14.9 230 31 3.42E-04 20 -1.81E-05 -2.57E-05 3.08E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 75 14.95 240 25 3.38E-04 20 -1.56E-05 -2.92E-05 2.44E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 80 15 260 26 3.51E-04 20 -8.85E-06 -3.31E-05 2.65E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 85 15.05 260 21 3.87E-04 20 -4.86E-06 -3.90E-05 2.38E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 90 15.1 270 23 4.16E-04 20 -1.70E-06 -4.17E-05 2.75E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 95 15.15 260 27 3.70E-04 20 -3.32E-06 -3.56E-05 2.93E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 100 15.2 270 33 3.26E-04 20 -2.35E-06 -2.98E-05 3.04E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 105 15.25 270 31 3.54E-04 20 -2.66E-06 -3.27E-05 3.18E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 110 15.3 270 31 3.60E-04 20 -1.49E-06 -3.35E-05 3.14E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 115 15.35 260 32 3.65E-04 20 -3.15E-06 -3.36E-05 3.32E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 120 15.4 260 32 3.83E-04 20 -3.63E-06 -3.49E-05 3.56E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 125 15.45 260 28 4.22E-04 20 -6.18E-06 -3.98E-05 3.49E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 130 15.5 270 27 4.23E-04 20 -1.67E-06 -4.08E-05 3.31E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 135 15.55 270 29 4.16E-04 20 1.84E-07 -3.95E-05 3.47E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 140 15.6 270 30 4.33E-04 20 -1.48E-06 -4.07E-05 3.74E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 145 15.65 270 27 4.26E-04 20 -1.59E-06 -4.14E-05 3.28E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 5 150 15.7 270 34 2.08E-04 20 -1.05E-06 -1.85E-05 1.98E-05 2/22/97 Yes Yes 728 172 1054 C 2 H 6 0 15.7 19 70 4.35E-05 20 1.26E-06 2.16E-07 7.03E-06 2/22/97 Yes Yes 731 172 1054 C 2 H 6 5 15.75 280 45 2.20E-04 20 2.93E-06 -1.66E-05 2.68E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 10 15.8 270 45 3.26E-04 20 -5.22E-07 -2.50E-05 3.99E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 15 15.85 270 47 4.20E-04 20 -2.39E-06 -3.12E-05 5.28E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 20 15.9 260 48 4.10E-04 20 -4.34E-06 -2.96E-05 5.24E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 25 15.95 270 51 3.31E-04 20 -7.37E-07 -2.28E-05 4.41E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 30 16 270 53 3.20E-04 20 -1.20E-06 -2.08E-05 4.42E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 35 16.05 260 43 3.87E-04 20 -3.05E-06 -3.08E-05 4.54E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 40 16.1 260 35 4.00E-04 20 -5.77E-06 -3.50E-05 3.96E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 45 16.15 260 30 3.35E-04 20 -6.36E-06 -3.09E-05 2.91E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 50 16.2 260 22 2.70E-04 20 -6.19E-06 -2.65E-05 1.76E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 55 16.25 260 11 2.38E-04 20 -4.27E-06 -2.50E-05 8.18E-06 2/22/97 Yes Yes 731 172 1054 C 2 H 6 60 16.3 270 8.8 1.90E-04 20 -5.73E-07 -2.05E-05 4.82E-06 2/22/97 Yes Yes 731 172 1054 C 2 H 6 65 16.35 270 28 1.88E-04 20 -1.09E-06 -1.82E-05 1.51E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 70 16.4 250 28 1.65E-04 20 -4.17E-06 -1.54E-05 1.31E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 75 16.45 270 28 1.52E-04 20 -9.12E-07 -1.44E-05 1.23E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 80 16.5 260 35 1.58E-04 20 -2.11E-06 -1.39E-05 1.56E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 85 16.55 260 36 1.87E-04 20 -1.99E-06 -1.63E-05 1.88E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 90 16.6 260 38 2.40E-04 20 -2.23E-06 -2.04E-05 2.54E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 95 16.65 260 34 2.63E-04 20 -4.70E-06 -2.33E-05 2.49E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 100 16.7 270 29 2.77E-04 20 -2.00E-07 -2.65E-05 2.28E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 105 16.75 270 33 2.50E-04 20 1.63E-06 -2.27E-05 2.38E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 110 16.8 270 36 3.05E-04 20 -2.31E-06 -2.68E-05 3.06E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 115 16.85 260 32 3.40E-04 20 -4.70E-06 -3.10E-05 3.10E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 120 16.9 260 30 3.12E-04 20 -5.11E-06 -2.88E-05 2.75E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 125 16.95 260 24 3.70E-04 20 -4.46E-06 -3.65E-05 2.60E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 130 17 260 24 4.17E-04 20 -8.18E-06 -4.06E-05 2.87E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 135 17.05 250 15 3.87E-04 20 -1.27E-05 -3.85E-05 1.73E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 140 17.1 260 11 4.89E-04 20 -6.22E-06 -5.17E-05 1.65E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 145 17.15 260 14 5.34E-04 20 -8.50E-06 -5.57E-05 2.23E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 6 150 17.2 270 16 4.03E-04 20 -1.72E-06 -4.18E-05 1.85E-05 2/22/97 Yes Yes 731 172 1054 C 2 H 7 0 17.2 230 27 1.22E-04 20 -8.20E-06 -8.83E-06 9.41E-06 2/22/97 Yes Yes 734 172 1054 C 2 H 7 5 17.25 250 13 5.68E-04 20 -1.74E-05 -5.72E-05 2.27E-05 2/22/97 Yes Yes 734 172 1054 C 2 H 7 10 17.3 260 9.7 6.37E-04 20 -1.55E-05 -6.62E-05 1.84E-05 2/22/97 Yes Yes 734 172 1054 C 2 H 7 15 17.35 260 12 6.32E-04 20 -1.49E-05 -6.53E-05 2.30E-05 2/22/97 Yes Yes 734 172 1054 C 2 H 7 20 17.4 260 20 5.30E-04 20 -9.15E-06 -5.34E-05 3.11E-05 2/22/97 Yes Yes 734 172 1054 C 2 H 7 25 17.45 260 27 4.59E-04 20 -8.49E-06 -4.37E-05 3.55E-05 2/22/97 Yes Yes 734 172 1054 C 2 H 7 30 17.5 260 26 4.86E-04 20 -7.68E-06 -4.68E-05 3.65E-05 2/22/97 Yes Yes 734 172 1054 C 2 H 7 35 17.55 260 30 4.40E-04 20 -5.59E-06 -4.08E-05 3.84E-05 2/22/97 Yes Yes 734 172 1054 C 2 H 7 40 17.6 290 39 6.63E-04 20 1.90E-05 -5.21E-05 7.27E-05 2/22/97 Yes Yes 734 172 1054 C 2 H 7 45 17.65 280 59 1.22E-03 20 1.16E-05 -6.74E-05 1.82E-04 2/22/97 Yes Yes 734 172 1054 C 2 H 7 50 17.7 190 53 1.20E-03 20 -7.34E-05 -1.95E-05 1.67E-04 2/22/97 Yes Yes 734 172 1054 C 2 H 7 55 17.75 220 54 7.74E-04 20 -3.83E-05 -3.10E-05 1.08E-04 2/22/97 Yes Yes 734 172 1054 C 2 H 7 60 17.8 290 49 9.18E-04 20 2.52E-05 -6.02E-05 1.20E-04 2/22/97 Yes Yes 734 172 1054 C 3 H 1 0 17.7 230 37 4.80E-04 20 -2.88E-05 -3.02E-05 4.95E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 5 17.75 190 27 9.07E-04 20 -8.43E-05 -1.58E-05 7.16E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 10 17.8 150 24 4.28E-04 20 -3.47E-05 2.33E-05 3.01E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 15 17.85 120 -19 3.62E-04 20 -1.93E-05 3.14E-05 -2.05E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 20 17.9 49 -25 5.61E-04 20 3.54E-05 4.14E-05 -4.18E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 25 17.95 74 29 8.18E-04 20 2.12E-05 7.43E-05 6.89E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 30 18 250 73 4.68E-04 20 -5.22E-06 -1.37E-05 7.77E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 35 18.05 360 42 1.39E-03 20 1.10E-04 -2.69E-06 1.60E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 40 18.1 340 57 1.18E-03 20 6.47E-05 -2.56E-05 1.71E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 45 18.15 310 57 9.12E-04 20 3.28E-05 -4.16E-05 1.33E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 50 18.2 310 60 7.41E-04 20 2.40E-05 -3.22E-05 1.11E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 55 18.25 300 54 8.17E-04 20 2.37E-05 -4.61E-05 1.15E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 60 18.3 300 58 8.93E-04 20 2.58E-05 -4.34E-05 1.32E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 65 18.35 300 53 8.30E-04 20 2.92E-05 -4.49E-05 1.15E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 70 18.4 300 49 7.60E-04 20 3.02E-05 -4.49E-05 9.90E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 75 18.45 340 62 6.23E-04 20 2.86E-05 -1.19E-05 9.54E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 80 18.5 330 61 5.93E-04 20 2.50E-05 -1.76E-05 8.99E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 85 18.55 310 46 6.82E-04 20 3.32E-05 -3.86E-05 8.50E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 90 18.6 310 46 6.93E-04 20 3.58E-05 -3.77E-05 8.57E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 95 18.65 310 55 5.16E-04 20 1.95E-05 -2.49E-05 7.32E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 100 18.7 310 70 3.54E-04 20 7.45E-06 -1.07E-05 5.78E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 105 18.75 310 54 5.22E-04 20 2.10E-05 -2.52E-05 7.35E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 110 18.8 300 50 7.98E-04 20 3.02E-05 -4.64E-05 1.05E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 115 18.85 300 55 7.61E-04 20 2.49E-05 -4.06E-05 1.08E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 120 18.9 290 45 9.04E-04 20 2.34E-05 -6.51E-05 1.11E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 125 18.95 290 46 8.88E-04 20 2.56E-05 -6.19E-05 1.11E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 130 19 290 47 9.22E-04 20 2.67E-05 -6.22E-05 1.17E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 135 19.05 290 48 8.74E-04 20 2.29E-05 -5.95E-05 1.12E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 140 19.1 290 47 8.65E-04 20 2.16E-05 -6.04E-05 1.09E-04 2/22/97 Yes Yes 737 172 1054 C 3 H 1 145 19.15 280 42 8.00E-04 20 1.59E-05 -6.21E-05 9.33E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 1 150 19.2 290 40 4.43E-04 20 1.34E-05 -3.39E-05 4.89E-05 2/22/97 Yes Yes 737 172 1054 C 3 H 2 0 19.2 300 41 1.61E-04 20 6.65E-06 -1.15E-05 1.82E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 5 19.25 290 40 3.51E-04 20 1.16E-05 -2.65E-05 3.93E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 10 19.3 290 48 3.41E-04 20 8.70E-06 -2.31E-05 4.38E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 15 19.35 300 44 3.77E-04 20 1.59E-05 -2.42E-05 4.58E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 20 19.4 300 43 4.29E-04 20 1.55E-05 -3.00E-05 5.07E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 25 19.45 300 44 4.37E-04 20 1.46E-05 -3.04E-05 5.28E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 30 19.5 300 42 4.69E-04 20 1.58E-05 -3.42E-05 5.41E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 35 19.55 290 42 4.53E-04 20 1.36E-05 -3.39E-05 5.21E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 40 19.6 290 46 3.65E-04 20 9.34E-06 -2.57E-05 4.54E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 45 19.65 300 49 3.00E-04 20 1.03E-05 -1.89E-05 3.90E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 50 19.7 300 43 3.19E-04 20 1.25E-05 -2.18E-05 3.79E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 55 19.75 300 45 3.30E-04 20 1.27E-05 -2.14E-05 4.07E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 60 19.8 300 45 3.73E-04 20 1.20E-05 -2.56E-05 4.59E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 65 19.85 290 34 4.85E-04 20 1.75E-05 -3.99E-05 4.69E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 70 19.9 300 35 5.26E-04 20 2.28E-05 -4.07E-05 5.18E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 75 19.95 300 45 4.07E-04 20 1.29E-05 -2.82E-05 4.99E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 80 20 290 51 3.15E-04 20 7.58E-06 -2.02E-05 4.22E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 85 20.05 300 52 3.13E-04 20 1.05E-05 -1.78E-05 4.28E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 90 20.1 310 45 4.36E-04 20 1.92E-05 -2.74E-05 5.29E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 95 20.15 300 46 4.38E-04 20 1.50E-05 -2.95E-05 5.39E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 100 20.2 300 47 3.56E-04 20 1.43E-05 -2.17E-05 4.53E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 105 20.25 290 61 3.27E-04 20 5.84E-06 -1.59E-05 4.98E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 110 20.3 200 41 2.89E-04 20 -2.15E-05 -9.82E-06 3.25E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 115 20.35 180 70 9.15E-05 20 -3.17E-06 -1.23E-07 1.46E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 120 20.4 300 37 1.03E-04 20 4.39E-06 -7.84E-06 1.09E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 125 20.45 310 31 2.82E-04 20 1.46E-05 -2.16E-05 2.51E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 130 20.5 300 47 2.65E-04 20 9.74E-06 -1.67E-05 3.36E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 135 20.55 290 46 2.99E-04 20 6.77E-06 -2.16E-05 3.72E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 140 20.6 290 42 3.76E-04 20 1.13E-05 -2.82E-05 4.33E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 145 20.65 290 39 3.89E-04 20 1.11E-05 -3.08E-05 4.22E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 2 150 20.7 290 50 1.99E-04 20 3.42E-06 -1.30E-05 2.62E-05 2/22/97 Yes Yes 740 172 1054 C 3 H 3 0 20.7 280 50 1.49E-04 20 1.47E-06 -1.07E-05 1.96E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 5 20.75 270 39 3.90E-04 20 -4.98E-07 -3.30E-05 4.21E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 10 20.8 270 46 3.99E-04 20 2.99E-07 -3.03E-05 4.92E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 15 20.85 280 44 4.05E-04 20 2.84E-06 -3.13E-05 4.92E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 20 20.9 270 45 4.18E-04 20 2.64E-06 -3.18E-05 5.14E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 25 20.95 260 45 3.96E-04 20 -3.15E-06 -3.04E-05 4.82E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 30 21 280 45 3.98E-04 20 2.66E-06 -3.03E-05 4.87E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 35 21.05 280 45 3.89E-04 20 4.52E-06 -2.94E-05 4.79E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 40 21.1 280 46 3.45E-04 20 2.64E-06 -2.57E-05 4.31E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 45 21.15 280 52 1.76E-04 20 1.45E-06 -1.20E-05 2.37E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 50 21.2 310 41 2.78E-04 20 1.29E-05 -1.85E-05 3.17E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 55 21.25 280 45 3.37E-04 20 2.81E-06 -2.56E-05 4.14E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 60 21.3 270 46 3.38E-04 20 5.78E-07 -2.58E-05 4.16E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 65 21.35 280 44 3.97E-04 20 6.24E-06 -3.03E-05 4.79E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 70 21.4 280 48 4.39E-04 20 5.98E-06 -3.16E-05 5.62E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 75 21.45 280 45 5.08E-04 20 5.48E-06 -3.88E-05 6.17E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 80 21.5 280 43 5.84E-04 20 5.25E-06 -4.63E-05 6.86E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 85 21.55 270 48 5.48E-04 20 -2.58E-06 -4.01E-05 7.00E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 90 21.6 270 48 4.76E-04 20 2.88E-06 -3.47E-05 6.09E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 95 21.65 270 41 4.76E-04 20 2.63E-06 -3.89E-05 5.41E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 100 21.7 270 39 5.18E-04 20 3.51E-06 -4.36E-05 5.66E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 105 21.75 270 34 5.32E-04 20 4.50E-07 -4.78E-05 5.18E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 110 21.8 280 34 4.94E-04 20 8.94E-06 -4.32E-05 4.80E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 115 21.85 200 48 2.19E-04 20 -1.44E-05 -5.72E-06 2.77E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 120 21.9 82 4.6 1.97E-04 20 2.94E-06 2.10E-05 2.89E-06 2/22/97 Yes Yes 743 172 1054 C 3 H 3 125 21.95 46 -4.8 4.41E-04 20 3.25E-05 3.40E-05 -6.38E-06 2/22/97 Yes Yes 743 172 1054 C 3 H 3 130 22 52 -12 5.95E-04 20 3.82E-05 4.97E-05 -2.10E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 135 22.05 54 -12 5.72E-04 20 3.46E-05 4.91E-05 -2.08E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 140 22.1 51 -12 4.71E-04 20 3.06E-05 3.89E-05 -1.74E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 145 22.15 35 -7.6 6.40E-04 20 5.52E-05 3.93E-05 -1.49E-05 2/22/97 Yes Yes 743 172 1054 C 3 H 3 150 22.2 37 -0.5 4.99E-04 20 4.17E-05 3.32E-05 -1.02E-06 2/22/97 Yes Yes 743 172 1054 C 3 H 4 0 22.2 58 -29 1.53E-04 20 7.31E-06 1.20E-05 -1.30E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 5 22.25 42 -12 6.44E-04 20 4.95E-05 4.60E-05 -2.26E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 10 22.3 37 -11 6.55E-04 20 5.44E-05 4.21E-05 -2.13E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 15 22.35 39 -13 3.28E-04 20 2.62E-05 2.18E-05 -1.32E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 20 22.4 41 -6.8 2.08E-04 20 1.65E-05 1.46E-05 -4.44E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 25 22.45 49 0.5 2.57E-04 20 1.81E-05 2.08E-05 1.47E-07 2/22/97 Yes Yes 746 172 1054 C 3 H 4 30 22.5 46 -11 2.42E-04 20 1.73E-05 1.87E-05 -8.36E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 35 22.55 34 -10 2.63E-04 20 2.26E-05 1.58E-05 -8.25E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 40 22.6 36 -8.2 3.12E-04 20 2.67E-05 1.97E-05 -8.00E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 45 22.65 36 -7.2 2.78E-04 20 2.35E-05 1.75E-05 -6.14E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 50 22.7 36 -9.4 2.56E-04 20 2.18E-05 1.59E-05 -7.32E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 55 22.75 35 -7.3 3.29E-04 20 2.82E-05 2.05E-05 -7.16E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 60 22.8 38 -6 3.44E-04 20 2.83E-05 2.30E-05 -6.39E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 65 22.85 42 -7.7 3.82E-04 20 3.01E-05 2.72E-05 -8.97E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 70 22.9 44 -6.8 4.55E-04 20 3.47E-05 3.38E-05 -9.35E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 75 22.95 45 -7.4 4.31E-04 20 3.22E-05 3.28E-05 -9.66E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 4 80 23 51 -9.5 4.80E-04 20 3.12E-05 4.00E-05 -1.39E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 85 23.05 48 -11 5.15E-04 20 3.59E-05 4.05E-05 -1.80E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 90 23.1 40 -15 4.25E-04 20 3.33E-05 2.85E-05 -1.91E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 95 23.15 44 -16 4.20E-04 20 3.08E-05 3.02E-05 -2.06E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 100 23.2 41 -17 3.94E-04 20 3.04E-05 2.65E-05 -2.01E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 105 23.25 38 -16 4.08E-04 20 3.25E-05 2.64E-05 -1.98E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 110 23.3 44 -15 4.96E-04 20 3.62E-05 3.62E-05 -2.23E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 115 23.35 47 -15 5.80E-04 20 4.04E-05 4.45E-05 -2.71E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 120 23.4 45 -16 5.86E-04 20 4.23E-05 4.32E-05 -2.82E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 125 23.45 45 -17 4.89E-04 20 3.52E-05 3.57E-05 -2.45E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 130 23.5 44 -19 4.31E-04 20 3.12E-05 3.07E-05 -2.40E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 135 23.55 44 -21 4.78E-04 20 3.39E-05 3.38E-05 -2.96E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 140 23.6 35 -22 4.28E-04 20 3.46E-05 2.49E-05 -2.73E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 145 23.65 32 -22 3.07E-04 20 2.56E-05 1.63E-05 -2.01E-05 2/22/97 Yes Yes 746 172 1054 C 3 H 4 150 23.7 20 -15 2.00E-04 20 1.90E-05 7.38E-06 -9.04E-06 2/22/97 Yes Yes 746 172 1054 C 3 H 5 0 23.7 50 -19 7.42E-05 20 4.54E-06 5.54E-06 -4.15E-06 2/22/97 Yes Yes 749 172 1054 C 3 H 5 5 23.75 360 6.1 1.35E-04 20 1.42E-05 5.50E-08 2.44E-06 2/22/97 Yes Yes 749 172 1054 C 3 H 5 10 23.8 290 25 1.64E-04 20 4.23E-06 -1.55E-05 1.19E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 15 23.85 280 41 1.69E-04 20 1.98E-06 -1.36E-05 1.94E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 20 23.9 270 50 1.97E-04 20 9.07E-07 -1.37E-05 2.60E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 25 23.95 280 48 2.41E-04 20 4.31E-06 -1.69E-05 3.10E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 30 24 280 46 2.82E-04 20 3.96E-06 -2.08E-05 3.52E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 35 24.05 280 43 3.32E-04 20 5.96E-06 -2.58E-05 3.88E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 40 24.1 290 43 3.78E-04 20 7.95E-06 -2.88E-05 4.45E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 45 24.15 290 43 4.44E-04 20 9.05E-06 -3.41E-05 5.24E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 50 24.2 290 45 4.66E-04 20 1.04E-05 -3.44E-05 5.68E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 55 24.25 290 45 5.00E-04 20 1.29E-05 -3.62E-05 6.11E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 60 24.3 290 40 6.57E-04 20 1.99E-05 -5.03E-05 7.38E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 65 24.35 290 37 8.70E-04 20 2.79E-05 -7.01E-05 9.03E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 70 24.4 290 40 8.13E-04 20 2.33E-05 -6.37E-05 8.99E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 75 24.45 290 44 6.58E-04 20 1.81E-05 -4.73E-05 7.98E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 80 24.5 290 48 5.60E-04 20 1.36E-05 -3.83E-05 7.20E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 85 24.55 290 43 5.77E-04 20 1.73E-05 -4.20E-05 6.85E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 90 24.6 300 39 6.92E-04 20 2.44E-05 -5.30E-05 7.50E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 95 24.65 290 42 6.78E-04 20 1.81E-05 -5.10E-05 7.92E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 100 24.7 270 44 4.87E-04 20 2.30E-07 -3.79E-05 5.89E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 105 24.75 310 46 2.70E-04 20 1.31E-05 -1.54E-05 3.37E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 110 24.8 300 37 5.22E-04 20 2.47E-05 -3.75E-05 5.39E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 115 24.85 290 36 6.40E-04 20 2.01E-05 -5.25E-05 6.51E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 120 24.9 290 36 7.33E-04 20 2.52E-05 -5.92E-05 7.46E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 125 24.95 290 40 6.93E-04 20 2.26E-05 -5.30E-05 7.68E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 130 25 290 40 6.59E-04 20 2.15E-05 -5.01E-05 7.33E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 135 25.05 290 40 6.83E-04 20 2.07E-05 -5.28E-05 7.60E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 140 25.1 290 38 7.76E-04 20 2.17E-05 -6.22E-05 8.34E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 145 25.15 290 36 8.10E-04 20 2.21E-05 -6.71E-05 8.32E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 5 150 25.2 290 44 4.78E-04 20 9.72E-06 -3.54E-05 5.76E-05 2/22/97 Yes Yes 749 172 1054 C 3 H 6 0 25.2 270 52 1.48E-04 20 3.48E-07 -1.03E-05 2.00E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 5 25.25 280 36 6.99E-04 20 1.26E-05 -6.02E-05 7.05E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 10 25.3 280 44 8.92E-04 20 1.64E-05 -6.81E-05 1.06E-04 2/22/97 Yes Yes 752 172 1054 C 3 H 6 15 25.35 280 51 8.19E-04 20 1.12E-05 -5.49E-05 1.10E-04 2/22/97 Yes Yes 752 172 1054 C 3 H 6 20 25.4 280 51 7.24E-04 20 9.54E-06 -4.80E-05 9.79E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 25 25.45 280 51 6.09E-04 20 6.09E-06 -4.10E-05 8.21E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 30 25.5 280 51 5.19E-04 20 6.33E-06 -3.44E-05 7.02E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 35 25.55 290 51 4.80E-04 20 1.05E-05 -3.13E-05 6.41E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 40 25.6 290 45 5.59E-04 20 1.33E-05 -4.06E-05 6.83E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 45 25.65 280 42 5.75E-04 20 1.16E-05 -4.48E-05 6.69E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 50 25.7 290 42 5.22E-04 20 1.12E-05 -4.03E-05 6.08E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 55 25.75 290 43 4.26E-04 20 8.56E-06 -3.25E-05 5.08E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 60 25.8 280 42 3.50E-04 20 6.99E-06 -2.75E-05 4.03E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 65 25.85 290 37 2.79E-04 20 6.46E-06 -2.33E-05 2.91E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 70 25.9 290 27 2.64E-04 20 7.53E-06 -2.44E-05 2.04E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 75 25.95 290 20 2.85E-04 20 1.00E-05 -2.71E-05 1.69E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 80 26 300 21 3.79E-04 20 1.76E-05 -3.40E-05 2.32E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 85 26.05 290 24 3.94E-04 20 1.60E-05 -3.56E-05 2.73E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 90 26.1 290 28 2.82E-04 20 1.05E-05 -2.49E-05 2.27E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 95 26.15 300 27 2.64E-04 20 1.16E-05 -2.25E-05 2.07E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 100 26.2 310 33 3.45E-04 20 2.15E-05 -2.28E-05 3.20E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 105 26.25 300 50 3.75E-04 20 1.09E-05 -2.39E-05 4.97E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 110 26.3 290 42 3.09E-04 20 7.37E-06 -2.38E-05 3.53E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 115 26.35 300 35 2.78E-04 20 1.31E-05 -2.11E-05 2.75E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 120 26.4 300 31 3.07E-04 20 1.37E-05 -2.51E-05 2.73E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 125 26.45 300 27 4.02E-04 20 1.85E-05 -3.41E-05 3.15E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 130 26.5 300 30 3.74E-04 20 1.67E-05 -3.08E-05 3.20E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 135 26.55 300 36 2.49E-04 20 9.40E-06 -1.95E-05 2.56E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 140 26.6 300 35 2.26E-04 20 9.50E-06 -1.77E-05 2.24E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 145 26.65 300 33 2.16E-04 20 9.79E-06 -1.70E-05 2.02E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 6 150 26.7 300 34 1.48E-04 20 5.73E-06 -1.15E-05 1.41E-05 2/22/97 Yes Yes 752 172 1054 C 3 H 7 0 26.7 310 5.1 8.56E-05 20 5.13E-06 -7.73E-06 1.30E-06 2/22/97 Yes Yes 755 172 1054 C 3 H 7 5 26.75 310 19 1.92E-04 20 1.35E-05 -1.38E-05 1.09E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 10 26.8 300 33 1.62E-04 20 7.83E-06 -1.24E-05 1.51E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 15 26.85 310 50 1.21E-04 20 5.72E-06 -6.00E-06 1.61E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 20 26.9 320 47 9.46E-05 20 5.30E-06 -4.56E-06 1.18E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 25 26.95 320 32 8.56E-05 20 5.54E-06 -5.50E-06 7.64E-06 2/22/97 Yes Yes 755 172 1054 C 3 H 7 30 27 320 24 1.32E-04 20 9.56E-06 -8.51E-06 9.22E-06 2/22/97 Yes Yes 755 172 1054 C 3 H 7 35 27.05 330 33 1.52E-04 20 1.19E-05 -6.54E-06 1.42E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 40 27.1 330 57 1.45E-04 20 7.00E-06 -4.79E-06 2.09E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 45 27.15 300 64 1.14E-04 20 2.39E-06 -5.12E-06 1.76E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 50 27.2 320 44 1.37E-04 20 8.55E-06 -6.40E-06 1.63E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 55 27.25 340 38 3.23E-04 20 2.56E-05 -9.26E-06 3.42E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 60 27.3 210 80 2.82E-04 20 -4.92E-06 -2.48E-06 4.79E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 65 27.35 190 40 1.67E-04 20 -1.34E-05 -3.01E-06 1.85E-05 2/22/97 Yes Yes 755 172 1054 C 3 H 7 70 27.4 160 63 5.34E-05 20 -2.44E-06 6.83E-07 8.20E-06 2/22/97 Yes Yes 755 172 1054 C 3 H 7 75 27.45 8.7 33 5.78E-04 20 5.09E-05 8.10E-06 5.41E-05 2/22/97 Yes Yes 755 172 1054 C 4 H 1 0 27.2 300 30 1.79E-04 20 7.40E-06 -1.52E-05 1.57E-05 2/22/97 Yes Yes 758 172 1054 C 4 H 1 5 27.25 270 69 2.71E-04 20 3.69E-07 -1.07E-05 4.37E-05 2/22/97 Yes Yes 758 172 1054 C 4 H 1 10 27.3 150 51 1.85E-04 20 -1.08E-05 6.31E-06 2.46E-05 2/22/97 Yes Yes 758 172 1054 C 4 H 1 15 27.35 68 29 1.13E-04 20 3.90E-06 9.94E-06 9.37E-06 2/22/97 Yes Yes 758 172 1054 C 4 H 1 20 27.4 55 -13 8.44E-05 20 5.08E-06 7.24E-06 -3.53E-06 2/22/97 Yes Yes 758 172 1054 C 4 H 1 25 27.45 61 -11 1.12E-04 20 5.59E-06 1.04E-05 -4.00E-06 2/22/97 Yes Yes 758 172 1054 C 4 H 1 30 27.5 250 36 1.13E-04 20 -3.24E-06 -9.24E-06 1.15E-05 2/22/97 Yes Yes 758 172 1054 C 4 H 1 35 27.55 290 6.7 1.72E-04 20 6.05E-06 -1.75E-05 3.40E-06 2/22/97 Yes Yes 758 172 1054 C 4 H 1 40 27.6 110 15 4.42E-05 20 -1.31E-06 4.44E-06 1.66E-06 2/22/97 Yes Yes 758 172 1054 C 4 H 1 45 27.65 67 -14 1.60E-04 20 6.36E-06 1.53E-05 -6.99E-06 2/22/97 Yes Yes 758 172 1054 C 4 H 1 50 27.7 360 -18 2.03E-04 20 2.06E-05 -8.26E-07 -1.09E-05 2/22/97 Yes Yes 758 172 1054 C 4 H 1 55 27.75 290 31 3.76E-04 20 1.40E-05 -3.19E-05 3.36E-05 2/22/97 Yes Yes 758 172 1054 C 4 H 1 60 27.8 95 82 4.81E-04 20 -7.05E-07 7.54E-06 8.23E-05 2/22/97 Yes Yes 758 172 1054 C 4 H 1 65 27.85 180 46 2.08E-04 20 -1.54E-05 5.31E-07 2.56E-05 2/22/97 Yes Yes 758 172 1054 C 4 H 1 70 27.9 55 23 9.92E-05 20 5.74E-06 7.99E-06 6.78E-06 2/22/97 Yes Yes 758 172 1054 C 4 H 1 75 27.95 280 58 5.26E-04 20 4.55E-06 -3.02E-05 7.70E-05 2/22/97 Yes Yes 758 172 1054 C 4 H CC 0 27.97 29 -70 1.33E-04 20 4.01E-06 2.10E-06 -2.17E-05 2/22/97 Yes Yes 761 172 1054 C 4 H CC 5 28.02 320 -68 2.40E-04 20 7.68E-06 -5.81E-06 -3.85E-05 2/22/97 Yes Yes 761 172 1054 C 4 H CC 10 28.07 34 -53 1.67E-04 20 8.70E-06 6.10E-06 -2.35E-05 2/22/97 Yes Yes 761 172 1054 C 4 H CC 15 28.12 20 -25 1.65E-04 20 1.48E-05 5.39E-06 -1.20E-05 2/22/97 Yes Yes 761 172 1054 C 4 H CC 20 28.17 1.9 -14 1.51E-04 20 1.56E-05 4.43E-07 -6.72E-06 2/22/97 Yes Yes 761 172 1054 C 5 H 1 0 28.2 310 39 1.33E-04 20 7.28E-06 -8.53E-06 1.43E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 5 28.25 300 57 2.32E-04 20 6.80E-06 -1.17E-05 3.36E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 10 28.3 71 37 1.99E-04 20 5.48E-06 1.63E-05 2.05E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 15 28.35 88 14 1.41E-04 20 4.01E-07 1.48E-05 5.75E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 20 28.4 230 -29 1.23E-04 20 -7.98E-06 -8.40E-06 -1.06E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 25 28.45 230 -28 1.97E-04 20 -1.25E-05 -1.40E-05 -1.63E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 30 28.5 71 -5 1.26E-04 20 4.29E-06 1.29E-05 -2.03E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 35 28.55 320 3.4 1.10E-04 20 9.15E-06 -7.30E-06 9.36E-07 2/22/97 Yes Yes 764 172 1054 C 5 H 1 40 28.6 340 -5.5 2.94E-04 20 2.84E-05 -1.33E-05 -5.29E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 45 28.65 360 31 1.31E-04 20 1.18E-05 -8.90E-07 1.15E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 50 28.7 60 67 1.12E-04 20 2.49E-06 4.06E-06 1.77E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 55 28.75 330 51 1.26E-04 20 7.20E-06 -4.39E-06 1.70E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 60 28.8 290 35 1.12E-04 20 2.71E-06 -9.67E-06 1.09E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 65 28.85 240 -48 1.03E-04 20 -3.78E-06 -6.53E-06 -1.35E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 70 28.9 74 -5.4 1.89E-04 20 5.64E-06 1.96E-05 -3.29E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 75 28.95 320 -6.1 6.39E-05 20 5.54E-06 -3.85E-06 -1.37E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 80 29 310 7.4 7.40E-05 20 4.55E-06 -6.42E-06 1.37E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 85 29.05 350 4.9 6.75E-05 20 7.06E-06 -1.29E-06 5.57E-07 2/22/97 Yes Yes 764 172 1054 C 5 H 1 90 29.1 17 11 9.70E-05 20 9.65E-06 3.04E-06 2.76E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 95 29.15 80 -5.1 1.48E-04 20 2.78E-06 1.57E-05 -2.75E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 100 29.2 4.2 -47 5.41E-05 20 4.14E-06 2.14E-07 -7.17E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 105 29.25 16 -12 8.10E-05 20 8.05E-06 2.45E-06 -2.94E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 110 29.3 360 -30 8.50E-05 20 7.53E-06 -3.08E-07 -7.88E-06 2/22/97 Yes Yes 764 172 1054 C 5 H 1 115 29.35 340 -47 1.01E-04 20 7.47E-06 -2.19E-06 -1.32E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 120 29.4 1.3 -48 1.23E-04 20 9.05E-06 2.29E-07 -1.58E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 125 29.45 360 -39 1.61E-04 20 1.32E-05 -1.10E-06 -1.76E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 130 29.5 7.9 -46 1.58E-04 20 1.17E-05 1.76E-06 -1.98E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 135 29.55 6.4 -47 1.56E-04 20 1.13E-05 1.29E-06 -2.00E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 140 29.6 330 -39 1.72E-04 20 1.28E-05 -6.37E-06 -1.89E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 145 29.65 340 -42 1.45E-04 20 1.09E-05 -3.82E-06 -1.72E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 1 150 29.7 33 -40 1.36E-04 20 9.06E-06 6.37E-06 -1.57E-05 2/22/97 Yes Yes 764 172 1054 C 5 H 2 0 29.7 140 -66 5.32E-05 20 -1.91E-06 1.26E-06 -8.47E-06 2/22/97 Yes Yes 767 172 1054 C 5 H 2 5 29.75 110 -23 2.13E-04 20 -7.70E-06 1.98E-05 -1.44E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 10 29.8 89 -38 1.55E-04 20 1.72E-07 1.32E-05 -1.69E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 15 29.85 24 -45 1.76E-04 20 1.20E-05 5.49E-06 -2.16E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 20 29.9 280 -51 1.44E-04 20 2.11E-06 -9.65E-06 -1.96E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 25 29.95 47 -52 1.38E-04 20 6.13E-06 6.67E-06 -1.91E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 30 30 70 -23 1.41E-04 20 4.68E-06 1.33E-05 -9.45E-06 2/22/97 Yes Yes 767 172 1054 C 5 H 2 35 30.05 100 -57 1.07E-04 20 -1.29E-06 6.12E-06 -1.57E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 40 30.1 330 -68 2.02E-04 20 6.98E-06 -4.29E-06 -3.28E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 45 30.15 60 -43 2.82E-04 20 1.08E-05 1.91E-05 -3.34E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 50 30.2 66 -37 2.84E-04 20 9.69E-06 2.22E-05 -3.00E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 55 30.25 310 -76 1.94E-04 20 3.15E-06 -3.79E-06 -3.28E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 60 30.3 320 -78 2.25E-04 20 3.61E-06 -3.58E-06 -3.83E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 65 30.35 57 -65 3.10E-04 20 7.49E-06 1.17E-05 -4.89E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 70 30.4 66 -53 4.72E-04 20 1.26E-05 2.82E-05 -6.52E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 75 30.45 120 -63 4.83E-04 20 -1.06E-05 2.11E-05 -7.48E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 80 30.5 270 -57 7.81E-04 20 2.88E-06 -4.65E-05 -1.13E-04 2/22/97 Yes Yes 767 172 1054 C 5 H 2 85 30.55 37 -26 6.62E-04 20 5.01E-05 3.91E-05 -5.03E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 90 30.6 60 -53 5.68E-04 20 1.80E-05 3.24E-05 -7.85E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 95 30.65 14 -54 6.70E-04 20 4.07E-05 1.02E-05 -9.39E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 100 30.7 50 -60 6.34E-04 20 2.13E-05 2.61E-05 -9.56E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 105 30.75 61 -60 6.41E-04 20 1.64E-05 3.03E-05 -9.63E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 110 30.8 63 -63 6.52E-04 20 1.40E-05 2.89E-05 -1.01E-04 2/22/97 Yes Yes 767 172 1054 C 5 H 2 115 30.85 54 -67 6.93E-04 20 1.70E-05 2.31E-05 -1.11E-04 2/22/97 Yes Yes 767 172 1054 C 5 H 2 120 30.9 56 -56 7.80E-04 20 2.64E-05 3.93E-05 -1.12E-04 2/22/97 Yes Yes 767 172 1054 C 5 H 2 125 30.95 56 -57 6.76E-04 20 2.16E-05 3.28E-05 -9.85E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 130 31 47 -51 6.89E-04 20 3.14E-05 3.43E-05 -9.28E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 135 31.05 48 -56 5.53E-04 20 2.22E-05 2.50E-05 -7.91E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 140 31.1 59 -54 5.44E-04 20 1.76E-05 2.96E-05 -7.63E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 145 31.15 62 -45 6.31E-04 20 2.21E-05 4.31E-05 -7.71E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 2 150 31.2 53 -42 3.87E-04 20 1.81E-05 2.50E-05 -4.51E-05 2/22/97 Yes Yes 767 172 1054 C 5 H 3 0 31.2 60 -54 2.22E-04 20 6.66E-06 1.22E-05 -3.10E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 5 31.25 48 -40 5.00E-04 20 2.71E-05 3.06E-05 -5.61E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 10 31.3 38 -45 4.36E-04 20 2.56E-05 2.05E-05 -5.37E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 15 31.35 36 -51 3.24E-04 20 1.72E-05 1.28E-05 -4.39E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 20 31.4 50 -50 2.98E-04 20 1.31E-05 1.61E-05 -3.95E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 25 31.45 40 -72 2.82E-04 20 6.91E-06 5.96E-06 -4.69E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 30 31.5 65 -60 3.12E-04 20 6.72E-06 1.52E-05 -4.71E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 35 31.55 34 -48 2.99E-04 20 1.74E-05 1.23E-05 -3.85E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 40 31.6 29 -43 2.30E-04 20 1.56E-05 8.88E-06 -2.77E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 45 31.65 54 -49 1.75E-04 20 7.04E-06 9.88E-06 -2.31E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 50 31.7 21 -60 9.43E-05 20 4.76E-06 1.71E-06 -1.42E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 55 31.75 310 -54 5.58E-05 20 2.22E-06 -2.77E-06 -7.74E-06 2/22/97 Yes Yes 770 172 1054 C 5 H 3 60 31.8 44 -52 6.14E-05 20 2.72E-06 2.74E-06 -8.57E-06 2/22/97 Yes Yes 770 172 1054 C 5 H 3 65 31.85 47 -46 1.18E-04 20 5.81E-06 6.37E-06 -1.49E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 70 31.9 67 -41 1.95E-04 20 6.13E-06 1.46E-05 -2.25E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 75 31.95 44 -53 2.45E-04 20 1.13E-05 1.14E-05 -3.38E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 80 32 38 -49 2.46E-04 20 1.33E-05 1.08E-05 -3.21E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 85 32.05 19 -50 1.86E-04 20 1.19E-05 4.09E-06 -2.49E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 90 32.1 27 -61 1.94E-04 20 8.70E-06 4.45E-06 -2.97E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 95 32.15 50 -53 2.65E-04 20 1.07E-05 1.32E-05 -3.68E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 100 32.2 58 -53 3.15E-04 20 1.06E-05 1.72E-05 -4.40E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 105 32.25 48 -56 3.92E-04 20 1.53E-05 1.77E-05 -5.62E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 110 32.3 35 -54 4.65E-04 20 2.32E-05 1.68E-05 -6.59E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 115 32.35 34 -53 4.85E-04 20 2.60E-05 1.76E-05 -6.71E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 120 32.4 31 -54 4.92E-04 20 2.62E-05 1.63E-05 -6.90E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 125 32.45 32 -54 4.62E-04 20 2.41E-05 1.52E-05 -6.50E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 130 32.5 35 -47 4.89E-04 20 2.91E-05 2.10E-05 -6.16E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 135 32.55 36 -43 4.96E-04 20 3.13E-05 2.32E-05 -5.82E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 140 32.6 41 -39 5.69E-04 20 3.53E-05 3.15E-05 -6.20E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 145 32.65 43 -43 4.26E-04 20 2.43E-05 2.29E-05 -5.04E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 3 150 32.7 31 -52 2.16E-04 20 1.16E-05 7.67E-06 -2.98E-05 2/22/97 Yes Yes 770 172 1054 C 5 H 4 0 32.7 55 -55 1.12E-04 20 3.69E-06 5.43E-06 -1.58E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 5 32.75 34 -32 2.90E-04 20 2.16E-05 1.50E-05 -2.65E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 10 32.8 35 -29 3.14E-04 20 2.37E-05 1.71E-05 -2.68E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 15 32.85 33 -29 3.21E-04 20 2.48E-05 1.67E-05 -2.69E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 20 32.9 30 -30 2.01E-04 20 1.60E-05 9.50E-06 -1.76E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 25 32.95 33 -41 1.30E-04 20 8.79E-06 5.72E-06 -1.49E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 30 33 27 -37 1.66E-04 20 1.24E-05 6.52E-06 -1.74E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 35 33.05 24 -38 1.50E-04 20 1.14E-05 5.09E-06 -1.59E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 40 33.1 41 -37 1.58E-04 20 1.01E-05 9.06E-06 -1.70E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 45 33.15 46 -24 2.62E-04 20 1.75E-05 1.85E-05 -1.87E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 50 33.2 50 -23 3.18E-04 20 1.99E-05 2.43E-05 -2.16E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 55 33.25 29 -36 2.18E-04 20 1.64E-05 9.15E-06 -2.20E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 60 33.3 30 -35 2.09E-04 20 1.55E-05 9.24E-06 -2.12E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 65 33.35 26 -21 2.38E-04 20 2.12E-05 1.04E-05 -1.50E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 70 33.4 36 -22 2.98E-04 20 2.39E-05 1.74E-05 -1.95E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 75 33.45 26 -22 4.40E-04 20 3.88E-05 1.95E-05 -2.86E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 80 33.5 25 -22 4.32E-04 20 3.86E-05 1.80E-05 -2.77E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 85 33.55 28 -25 3.36E-04 20 2.85E-05 1.55E-05 -2.47E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 90 33.6 33 -28 3.08E-04 20 2.40E-05 1.60E-05 -2.56E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 95 33.65 27 -30 2.21E-04 20 1.79E-05 9.32E-06 -1.95E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 100 33.7 25 -31 1.78E-04 20 1.47E-05 6.94E-06 -1.61E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 105 33.75 14 -28 1.54E-04 20 1.39E-05 3.49E-06 -1.24E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 110 33.8 23 -26 1.98E-04 20 1.71E-05 7.58E-06 -1.51E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 115 33.85 13 -29 1.56E-04 20 1.45E-05 3.13E-06 -1.32E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 120 33.9 13 -28 1.90E-04 20 1.74E-05 4.17E-06 -1.55E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 125 33.95 17 -18 3.18E-04 20 3.07E-05 9.53E-06 -1.65E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 130 34 360 -33 1.99E-04 20 1.76E-05 -6.06E-07 -1.89E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 135 34.05 25 -50 1.31E-04 20 7.97E-06 3.76E-06 -1.75E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 140 34.1 20 -32 2.12E-04 20 1.79E-05 6.46E-06 -1.95E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 145 34.15 8.8 -25 1.64E-04 20 1.55E-05 2.35E-06 -1.24E-05 2/22/97 Yes Yes 773 172 1054 C 5 H 4 150 34.2 40 -14 1.29E-04 20 9.78E-06 8.93E-06 -5.77E-06 2/22/97 Yes Yes 773 172 1054 C 5 H 5 0 34.2 51 -68 8.81E-05 20 1.94E-06 2.45E-06 -1.42E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 5 34.25 27 -41 2.40E-04 20 1.70E-05 8.96E-06 -2.73E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 10 34.3 22 -38 2.68E-04 20 2.08E-05 8.81E-06 -2.84E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 15 34.35 13 -41 1.85E-04 20 1.42E-05 3.45E-06 -2.12E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 20 34.4 19 -50 1.47E-04 20 9.45E-06 3.34E-06 -1.98E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 25 34.45 29 -43 1.98E-04 20 1.36E-05 7.53E-06 -2.34E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 30 34.5 24 -44 2.14E-04 20 1.48E-05 6.88E-06 -2.58E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 35 34.55 26 -44 2.33E-04 20 1.58E-05 8.01E-06 -2.83E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 40 34.6 28 -43 2.30E-04 20 1.60E-05 8.66E-06 -2.72E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 45 34.65 26 -57 1.58E-04 20 8.18E-06 4.00E-06 -2.30E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 50 34.7 27 -57 1.62E-04 20 8.27E-06 4.24E-06 -2.38E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 55 34.75 29 -49 1.87E-04 20 1.14E-05 6.48E-06 -2.45E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 60 34.8 26 -50 1.99E-04 20 1.21E-05 6.08E-06 -2.64E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 65 34.85 35 -61 2.26E-04 20 9.54E-06 6.76E-06 -3.43E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 70 34.9 32 -55 3.94E-04 20 2.06E-05 1.32E-05 -5.57E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 75 34.95 26 -50 5.36E-04 20 3.31E-05 1.68E-05 -7.07E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 80 35 25 -50 5.61E-04 20 3.47E-05 1.63E-05 -7.43E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 85 35.05 27 -52 5.25E-04 20 3.06E-05 1.55E-05 -7.20E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 90 35.1 22 -55 5.36E-04 20 2.99E-05 1.24E-05 -7.66E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 95 35.15 22 -50 5.76E-04 20 3.61E-05 1.47E-05 -7.70E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 100 35.2 24 -49 5.36E-04 20 3.44E-05 1.58E-05 -6.98E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 105 35.25 28 -48 4.78E-04 20 2.99E-05 1.62E-05 -6.15E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 110 35.3 26 -47 5.02E-04 20 3.23E-05 1.66E-05 -6.36E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 115 35.35 24 -42 5.01E-04 20 3.61E-05 1.62E-05 -5.87E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 120 35.4 28 -45 4.27E-04 20 2.85E-05 1.53E-05 -5.21E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 125 35.45 29 -44 4.53E-04 20 2.99E-05 1.69E-05 -5.48E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 130 35.5 25 -44 4.50E-04 20 3.11E-05 1.47E-05 -5.41E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 135 35.55 22 -43 4.84E-04 20 3.48E-05 1.45E-05 -5.70E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 140 35.6 25 -37 5.42E-04 20 4.14E-05 2.00E-05 -5.66E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 145 35.65 24 -35 5.14E-04 20 4.10E-05 1.88E-05 -5.07E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 5 150 35.7 17 -34 3.40E-04 20 2.84E-05 9.16E-06 -3.28E-05 2/22/97 Yes Yes 776 172 1054 C 5 H 6 0 35.7 41 -61 1.62E-04 20 6.15E-06 5.28E-06 -2.45E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 5 35.75 24 -38 4.29E-04 20 3.25E-05 1.48E-05 -4.62E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 10 35.8 19 -39 3.86E-04 20 3.00E-05 1.07E-05 -4.24E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 15 35.85 31 -47 3.25E-04 20 2.02E-05 1.23E-05 -4.11E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 20 35.9 30 -51 3.46E-04 20 1.99E-05 1.18E-05 -4.70E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 25 35.95 29 -53 4.12E-04 20 2.33E-05 1.29E-05 -5.69E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 30 36 30 -56 4.72E-04 20 2.41E-05 1.46E-05 -6.77E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 35 36.05 17 -60 5.07E-04 20 2.56E-05 7.76E-06 -7.64E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 40 36.1 21 -52 4.95E-04 20 3.04E-05 1.20E-05 -6.77E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 45 36.15 28 -53 4.20E-04 20 2.33E-05 1.25E-05 -5.86E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 50 36.2 17 -50 3.50E-04 20 2.28E-05 6.90E-06 -4.68E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 55 36.25 9 -32 2.87E-04 20 2.56E-05 4.13E-06 -2.64E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 60 36.3 42 -47 1.70E-04 20 9.07E-06 8.34E-06 -2.16E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 65 36.35 28 -64 1.94E-04 20 7.93E-06 4.20E-06 -3.03E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 70 36.4 28 -57 2.79E-04 20 1.45E-05 7.73E-06 -4.05E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 75 36.45 24 -52 3.42E-04 20 2.05E-05 9.40E-06 -4.67E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 80 36.5 15 -47 3.27E-04 20 2.26E-05 6.04E-06 -4.18E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 85 36.55 19 -51 2.52E-04 20 1.60E-05 5.61E-06 -3.42E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 90 36.6 27 -50 2.44E-04 20 1.50E-05 7.71E-06 -3.24E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 95 36.65 21 -54 2.01E-04 20 1.16E-05 4.39E-06 -2.85E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 100 36.7 24 -56 1.93E-04 20 1.07E-05 4.65E-06 -2.80E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 105 36.75 22 -53 1.96E-04 20 1.16E-05 4.79E-06 -2.70E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 110 36.8 16 -55 1.62E-04 20 9.30E-06 2.84E-06 -2.32E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 115 36.85 3.9 -52 1.48E-04 20 9.96E-06 4.15E-07 -2.05E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 120 36.9 20 -41 1.35E-04 20 1.04E-05 3.67E-06 -1.53E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 125 36.95 20 -43 1.06E-04 20 7.65E-06 2.78E-06 -1.24E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 130 37 8.7 -45 9.16E-05 20 6.85E-06 1.10E-06 -1.12E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 135 37.05 24 -57 9.13E-05 20 4.77E-06 2.13E-06 -1.33E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 140 37.1 40 -43 1.09E-04 20 6.57E-06 5.42E-06 -1.29E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 145 37.15 18 -33 1.09E-04 20 9.33E-06 2.87E-06 -1.06E-05 2/22/97 Yes Yes 779 172 1054 C 5 H 6 150 37.2 360 -38 5.97E-05 20 4.76E-06 -4.09E-08 -6.64E-06 2/22/97 Yes Yes 779 172 1054 C 5 H 7 0 37.2 100 -47 2.63E-05 20 -6.76E-07 1.61E-06 -3.32E-06 2/22/97 Yes Yes 782 172 1054 C 5 H 7 5 37.25 25 -37 4.98E-05 20 3.72E-06 1.90E-06 -5.18E-06 2/22/97 Yes Yes 782 172 1054 C 5 H 7 10 37.3 14 0.8 8.92E-05 20 9.10E-06 2.40E-06 1.26E-07 2/22/97 Yes Yes 782 172 1054 C 5 H 7 15 37.35 22 35 1.41E-04 20 1.12E-05 4.68E-06 1.41E-05 2/22/97 Yes Yes 782 172 1054 C 5 H 7 20 37.4 230 69 7.19E-05 20 -1.85E-06 -2.06E-06 1.15E-05 2/22/97 Yes Yes 782 172 1054 C 5 H 7 25 37.45 74 50 1.94E-05 20 2.78E-07 1.29E-06 2.44E-06 2/22/97 Yes Yes 782 172 1054 C 5 H 7 30 37.5 18 2.2 3.47E-05 20 3.30E-06 1.26E-06 2.76E-07 2/22/97 Yes Yes 782 172 1054 C 5 H 7 35 37.55 350 32 1.22E-05 20 9.29E-07 -2.79E-07 1.15E-06 2/22/97 Yes Yes 782 172 1054 C 6 H 1 0 37.7 360 13 7.90E-05 20 7.89E-06 -9.17E-07 3.06E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 5 37.75 170 -24 4.54E-04 20 -4.37E-05 4.87E-06 -3.24E-05 2/22/97 Yes Yes 785 172 1054 C 6 H 1 10 37.8 190 -46 5.66E-04 20 -4.09E-05 -8.65E-06 -7.06E-05 2/22/97 Yes Yes 785 172 1054 C 6 H 1 15 37.85 1 -34 3.66E-04 20 3.23E-05 5.60E-07 -3.51E-05 2/22/97 Yes Yes 785 172 1054 C 6 H 1 20 37.9 8 -4.7 8.13E-05 20 8.55E-06 1.17E-06 -1.32E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 25 37.95 170 38 3.05E-05 20 -2.49E-06 5.96E-07 3.09E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 30 38 260 7 4.08E-05 20 -1.09E-06 -4.22E-06 8.74E-07 2/22/97 Yes Yes 785 172 1054 C 6 H 1 35 38.05 310 22 4.33E-05 20 2.86E-06 -3.21E-06 2.79E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 40 38.1 150 64 3.37E-05 20 -1.21E-06 9.73E-07 5.05E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 45 38.15 180 15 3.07E-04 20 -3.16E-05 -4.74E-07 1.39E-05 2/22/97 Yes Yes 785 172 1054 C 6 H 1 50 38.2 210 23 1.24E-04 20 -1.08E-05 -5.87E-06 8.37E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 55 38.25 310 16 6.13E-05 20 4.37E-06 -4.55E-06 2.99E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 60 38.3 360 21 7.58E-05 20 7.38E-06 -3.38E-07 4.66E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 65 38.35 230 51 5.32E-05 20 -2.51E-06 -2.74E-06 7.17E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 70 38.4 230 38 3.40E-05 20 -1.91E-06 -2.15E-06 3.67E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 75 38.45 14 69 4.57E-05 20 1.63E-06 5.42E-07 7.48E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 80 38.5 250 35 1.03E-04 20 -3.38E-06 -8.65E-06 1.02E-05 2/22/97 Yes Yes 785 172 1054 C 6 H 1 85 38.55 260 48 7.50E-05 20 -1.10E-06 -5.46E-06 9.53E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 90 38.6 150 30 1.18E-04 20 -9.93E-06 4.66E-06 1.02E-05 2/22/97 Yes Yes 785 172 1054 C 6 H 1 95 38.65 200 6.7 3.40E-05 20 -3.51E-06 -1.47E-06 5.40E-07 2/22/97 Yes Yes 785 172 1054 C 6 H 1 100 38.7 290 2.2 6.01E-05 20 2.54E-06 -6.12E-06 4.15E-07 2/22/97 Yes Yes 785 172 1054 C 6 H 1 105 38.75 190 35 6.85E-06 20 -7.32E-07 -6.84E-08 9.56E-07 2/22/97 Yes Yes 785 172 1054 C 6 H 1 110 38.8 260 8.7 6.45E-05 20 -1.80E-06 -6.72E-06 1.62E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 115 38.85 250 16 2.93E-05 20 -7.96E-07 -3.09E-06 1.31E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 120 38.9 210 28 2.75E-05 20 -2.06E-06 -1.41E-06 2.59E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 125 38.95 230 4.6 4.13E-05 20 -3.17E-06 -3.33E-06 8.47E-07 2/22/97 Yes Yes 785 172 1054 C 6 H 1 130 39 240 7.6 7.62E-05 20 -4.45E-06 -6.78E-06 1.94E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 135 39.05 270 64 1.12E-05 20 -1.23E-07 -5.56E-07 1.98E-06 2/22/97 Yes Yes 785 172 1054 C 6 H 1 140 39.1 210 17 1.36E-05 20 -1.26E-06 -6.93E-07 8.72E-07 2/22/97 Yes Yes 785 172 1054 C 6 H 1 145 39.15 270 -3.5 3.92E-05 20 -2.69E-07 -4.31E-06 -3.81E-07 2/22/97 Yes Yes 785 172 1054 C 6 H 1 150 39.2 300 -5.2 1.47E-05 20 4.59E-07 -1.05E-06 -2.75E-07 2/22/97 Yes Yes 785 172 1054 C 6 H 2 0 39.2 330 -24 2.29E-05 20 1.68E-06 -1.42E-06 -1.67E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 5 39.25 300 3.1 6.17E-05 20 3.24E-06 -5.66E-06 5.34E-07 2/22/97 Yes Yes 788 172 1054 C 6 H 2 10 39.3 160 73 2.01E-05 20 -6.04E-07 2.79E-07 3.17E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 15 39.35 290 49 2.16E-05 20 4.70E-07 -1.41E-06 2.82E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 20 39.4 300 17 5.52E-05 20 2.58E-06 -5.15E-06 2.63E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 25 39.45 73 59 3.55E-05 20 5.19E-07 1.83E-06 5.06E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 30 39.5 96 -2.8 5.66E-05 20 -7.45E-07 6.16E-06 -5.57E-07 2/22/97 Yes Yes 788 172 1054 C 6 H 2 35 39.55 220 -25 1.88E-05 20 -1.40E-06 -1.32E-06 -1.46E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 40 39.6 240 -15 2.10E-05 20 -9.43E-07 -1.88E-06 -1.25E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 45 39.65 350 -6.5 3.27E-05 20 3.28E-06 -8.72E-07 -8.14E-07 2/22/97 Yes Yes 788 172 1054 C 6 H 2 50 39.7 34 5.1 8.59E-05 20 7.52E-06 5.10E-06 1.20E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 55 39.75 260 12 6.52E-04 20 -8.36E-06 -6.86E-05 2.38E-05 2/22/97 Yes Yes 788 172 1054 C 6 H 2 60 39.8 210 24 5.24E-04 20 -4.49E-05 -2.44E-05 3.70E-05 2/22/97 Yes Yes 788 172 1054 C 6 H 2 65 39.85 19 65 8.66E-05 20 3.60E-06 1.12E-06 1.35E-05 2/22/97 Yes Yes 788 172 1054 C 6 H 2 70 39.9 77 32 2.84E-04 20 5.66E-06 2.56E-05 2.57E-05 2/22/97 Yes Yes 788 172 1054 C 6 H 2 75 39.95 98 4.8 1.67E-04 20 -2.66E-06 1.79E-05 2.39E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 80 40 290 5.4 1.21E-04 20 3.90E-06 -1.25E-05 1.83E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 85 40.05 41 63 4.58E-05 20 1.59E-06 1.35E-06 6.75E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 90 40.1 210 -19 8.65E-05 20 -7.47E-06 -4.76E-06 -5.13E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 95 40.15 300 13 1.02E-04 20 5.61E-06 -9.11E-06 3.62E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 100 40.2 60 -0.6 4.39E-05 20 2.46E-06 3.99E-06 -2.53E-07 2/22/97 Yes Yes 788 172 1054 C 6 H 2 105 40.25 300 -29 9.60E-06 20 3.39E-07 -7.78E-07 -7.27E-07 2/22/97 Yes Yes 788 172 1054 C 6 H 2 110 40.3 250 39 4.07E-05 20 -1.57E-06 -3.19E-06 4.14E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 115 40.35 160 33 1.48E-04 20 -1.23E-05 4.15E-06 1.37E-05 2/22/97 Yes Yes 788 172 1054 C 6 H 2 120 40.4 230 4.8 9.37E-05 20 -6.20E-06 -7.82E-06 1.52E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 125 40.45 280 1.7 1.37E-04 20 2.22E-06 -1.47E-05 7.62E-07 2/22/97 Yes Yes 788 172 1054 C 6 H 2 130 40.5 260 46 4.42E-05 20 -8.39E-07 -3.14E-06 5.52E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 135 40.55 250 42 3.19E-05 20 -1.14E-06 -2.39E-06 3.72E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 140 40.6 190 44 5.39E-05 20 -4.04E-06 -1.04E-06 6.43E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 145 40.65 190 31 3.10E-05 20 -2.85E-06 -6.26E-07 2.54E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 2 150 40.7 210 18 5.85E-05 20 -5.41E-06 -2.92E-06 2.79E-06 2/22/97 Yes Yes 788 172 1054 C 6 H 3 0 40.7 250 -8.3 2.17E-05 20 -9.93E-07 -2.50E-06 -5.75E-07 2/22/97 Yes Yes 791 172 1054 C 6 H 3 5 40.75 220 30 1.54E-05 20 -1.22E-06 -7.71E-07 1.28E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 10 40.8 200 40 3.44E-05 20 -2.65E-06 -9.68E-07 3.69E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 15 40.85 250 42 2.37E-05 20 -6.33E-07 -1.84E-06 2.74E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 20 40.9 280 29 2.83E-05 20 3.56E-07 -2.73E-06 2.13E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 25 40.95 170 33 5.32E-05 20 -4.65E-06 8.36E-07 4.81E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 30 41 150 14 5.66E-05 20 -5.30E-06 2.81E-06 2.26E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 35 41.05 82 -5.5 2.91E-05 20 3.77E-07 3.06E-06 -5.97E-07 2/22/97 Yes Yes 791 172 1054 C 6 H 3 40 41.1 320 -28 5.18E-05 20 3.55E-06 -3.44E-06 -4.52E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 45 41.15 290 9.8 6.68E-05 20 2.44E-06 -6.89E-06 1.79E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 50 41.2 21 47 3.67E-05 20 2.52E-06 8.67E-07 4.50E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 55 41.25 320 61 2.05E-05 20 8.01E-07 -6.63E-07 3.12E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 60 41.3 220 34 1.54E-05 20 -1.16E-06 -9.93E-07 1.30E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 65 41.35 320 28 2.87E-05 20 1.97E-06 -1.99E-06 2.14E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 70 41.4 130 5.9 4.30E-05 20 -3.10E-06 3.26E-06 6.53E-07 2/22/97 Yes Yes 791 172 1054 C 6 H 3 75 41.45 190 -81 6.49E-05 20 -1.11E-06 -5.84E-08 -1.12E-05 2/22/97 Yes Yes 791 172 1054 C 6 H 3 80 41.5 300 -9 7.21E-05 20 3.86E-06 -6.59E-06 -2.10E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 85 41.55 270 67 1.56E-05 20 -3.12E-08 -7.98E-07 2.16E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 90 41.6 85 46 2.37E-05 20 8.37E-08 1.68E-06 2.72E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 95 41.65 57 10 3.14E-05 20 1.60E-06 2.73E-06 6.42E-07 2/22/97 Yes Yes 791 172 1054 C 6 H 3 100 41.7 250 23 2.42E-05 20 -5.10E-07 -2.44E-06 1.47E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 105 41.75 250 14 1.16E-05 20 -5.33E-07 -1.16E-06 5.51E-07 2/22/97 Yes Yes 791 172 1054 C 6 H 3 110 41.8 260 35 3.10E-05 20 -6.38E-07 -2.72E-06 2.76E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 115 41.85 87 51 1.92E-05 20 3.14E-07 1.09E-06 2.28E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 120 41.9 150 48 2.05E-05 20 -1.15E-06 6.49E-07 2.77E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 125 41.95 310 72 1.26E-05 20 1.04E-07 -4.30E-07 2.11E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 130 42 31 41 2.09E-05 20 1.37E-06 9.63E-07 2.34E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 135 42.05 230 31 2.03E-05 20 -1.35E-06 -1.45E-06 1.80E-06 2/22/97 Yes Yes 791 172 1054 C 6 H 3 140 42.1 250 -5.4 1.87E-05 20 -7.68E-07 -1.89E-06 -3.96E-07 2/22/97 Yes Yes 791 172 1054 C 6 H 3 145 42.15 78 -5.9 1.35E-05 20 2.46E-07 1.33E-06 -4.77E-07 2/22/97 Yes Yes 791 172 1054 C 6 H 3 150 42.2 93 68 7.24E-06 20 -3.68E-07 5.57E-07 8.48E-07 2/22/97 Yes Yes 791 172 1054 C 6 H 4 0 42.2 140 -29 4.43E-06 20 -5.77E-07 -4.84E-08 -3.97E-07 2/22/97 Yes Yes 794 172 1054 C 6 H 4 5 42.25 110 24 1.31E-05 20 -5.94E-07 1.28E-06 8.97E-07 2/22/97 Yes Yes 794 172 1054 C 6 H 4 10 42.3 260 23 1.73E-05 20 -2.36E-07 -1.69E-06 1.05E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 15 42.35 27 47 4.58E-05 20 2.86E-06 1.54E-06 5.78E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 20 42.4 180 53 4.26E-05 20 -2.67E-06 -2.85E-07 5.68E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 25 42.45 110 43 1.42E-05 20 -3.69E-07 1.02E-06 1.46E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 30 42.5 34 37 2.54E-05 20 1.64E-06 1.32E-06 2.62E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 35 42.55 310 55 2.31E-05 20 8.42E-07 -1.12E-06 3.21E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 40 42.6 140 42 1.90E-05 20 -1.02E-06 1.09E-06 1.93E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 45 42.65 260 -17 1.01E-05 20 -3.22E-07 -1.25E-06 -6.68E-07 2/22/97 Yes Yes 794 172 1054 C 6 H 4 50 42.7 290 -2.5 2.67E-05 20 1.16E-06 -2.75E-06 -3.08E-07 2/22/97 Yes Yes 794 172 1054 C 6 H 4 55 42.75 54 -12 2.97E-05 20 1.78E-06 2.58E-06 -1.02E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 60 42.8 47 -31 1.23E-05 20 6.61E-07 7.46E-07 -1.25E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 65 42.85 280 54 1.27E-05 20 1.65E-07 -9.16E-07 1.64E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 70 42.9 190 41 1.94E-05 20 -1.42E-06 -4.13E-07 2.15E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 75 42.95 190 17 1.04E-05 20 -1.07E-06 -9.59E-08 5.15E-07 2/22/97 Yes Yes 794 172 1054 C 6 H 4 80 43 260 -8 1.77E-05 20 -4.55E-07 -1.95E-06 -5.31E-07 2/22/97 Yes Yes 794 172 1054 C 6 H 4 85 43.05 40 5.5 2.62E-05 20 2.06E-06 1.72E-06 1.63E-07 2/22/97 Yes Yes 794 172 1054 C 6 H 4 90 43.1 4.4 42 3.24E-05 20 2.47E-06 1.38E-07 3.55E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 95 43.15 240 31 3.91E-05 20 -2.13E-06 -3.09E-06 3.22E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 100 43.2 250 24 2.91E-05 20 -7.58E-07 -2.81E-06 1.95E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 105 43.25 280 71 2.54E-05 20 -9.03E-09 -8.57E-07 4.30E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 110 43.3 100 53 3.77E-05 20 -8.51E-07 2.45E-06 5.01E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 115 43.35 270 62 4.86E-05 20 1.26E-07 -2.69E-06 7.17E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 120 43.4 240 64 5.13E-05 20 -1.18E-06 -2.04E-06 8.15E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 125 43.45 280 50 4.80E-05 20 6.86E-07 -3.32E-06 6.44E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 130 43.5 300 64 4.04E-05 20 1.02E-06 -1.50E-06 6.30E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 135 43.55 270 80 4.31E-05 20 -1.12E-07 -8.09E-07 7.42E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 140 43.6 270 72 5.19E-05 20 1.07E-07 -1.71E-06 8.55E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 145 43.65 270 41 4.28E-05 20 -2.27E-07 -3.55E-06 4.71E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 4 150 43.7 55 56 1.36E-05 20 1.15E-07 9.85E-07 1.71E-06 2/22/97 Yes Yes 794 172 1054 C 6 H 5 0 43.7 300 23 2.18E-05 20 7.87E-07 -2.21E-06 1.44E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 5 43.75 310 48 5.57E-05 20 2.69E-06 -2.81E-06 7.11E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 10 43.8 170 51 5.46E-05 20 -3.62E-06 5.92E-07 7.25E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 15 43.85 180 59 2.50E-05 20 -1.49E-06 -8.42E-08 3.70E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 20 43.9 140 47 1.38E-05 20 -6.89E-07 6.33E-07 1.56E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 25 43.95 240 53 9.08E-06 20 -3.30E-07 -5.64E-07 1.06E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 30 44 250 11 3.99E-05 20 -1.48E-06 -3.96E-06 1.28E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 35 44.05 300 40 1.98E-05 20 6.52E-07 -1.50E-06 2.14E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 40 44.1 150 59 2.64E-05 20 -1.18E-06 7.64E-07 3.66E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 45 44.15 170 36 3.07E-05 20 -2.70E-06 3.64E-07 2.99E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 50 44.2 250 41 2.69E-05 20 -7.31E-07 -2.20E-06 2.97E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 55 44.25 240 51 2.50E-05 20 -9.17E-07 -1.47E-06 3.42E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 60 44.3 130 54 2.55E-05 20 -1.20E-06 1.11E-06 3.42E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 65 44.35 61 76 2.28E-05 20 2.12E-07 3.73E-07 3.71E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 70 44.4 210 39 2.97E-05 20 -1.99E-06 -1.47E-06 3.20E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 75 44.45 180 35 2.53E-05 20 -2.26E-06 4.59E-08 2.54E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 80 44.5 0.6 45 2.80E-05 20 1.83E-06 -8.09E-08 3.35E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 85 44.55 300 72 3.23E-05 20 4.52E-07 -1.08E-06 5.07E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 90 44.6 250 63 3.41E-05 20 -6.96E-07 -1.66E-06 5.12E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 95 44.65 93 69 2.88E-05 20 -2.82E-07 9.98E-07 4.42E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 100 44.7 300 40 4.49E-05 20 1.81E-06 -3.41E-06 4.89E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 105 44.75 240 50 3.50E-05 20 -1.50E-06 -2.07E-06 4.78E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 110 44.8 220 50 1.78E-05 20 -1.31E-06 -8.16E-07 2.15E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 115 44.85 250 81 1.40E-05 20 1.10E-07 -4.63E-07 2.19E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 120 44.9 300 62 2.81E-05 20 7.90E-07 -1.27E-06 4.54E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 125 44.95 340 78 2.75E-05 20 3.99E-07 -2.83E-07 4.79E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 130 45 260 42 3.37E-05 20 -4.29E-07 -2.64E-06 3.98E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 135 45.05 290 45 3.62E-05 20 8.74E-07 -2.63E-06 4.50E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 140 45.1 340 52 3.78E-05 20 2.18E-06 -1.11E-06 5.16E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 145 45.15 56 60 2.61E-05 20 6.68E-07 1.07E-06 3.80E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 5 150 45.2 250 25 3.32E-05 20 -1.32E-06 -2.88E-06 2.24E-06 2/22/97 Yes Yes 797 172 1054 C 6 H 6 0 45.2 5.9 11 6.34E-05 20 6.34E-06 3.89E-07 2.03E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 5 45.25 360 43 6.18E-05 20 4.73E-06 -9.17E-09 7.25E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 10 45.3 350 57 6.04E-05 20 3.40E-06 -6.80E-07 8.64E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 15 45.35 340 66 4.54E-05 20 1.68E-06 -8.38E-07 7.18E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 20 45.4 330 64 3.38E-05 20 1.45E-06 -9.16E-07 5.01E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 25 45.45 250 57 2.66E-05 20 -5.08E-07 -1.55E-06 3.61E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 30 45.5 230 62 2.06E-05 20 -7.77E-07 -7.15E-07 3.07E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 35 45.55 360 64 2.17E-05 20 1.00E-06 -1.53E-07 3.25E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 40 45.6 11 52 2.45E-05 20 1.74E-06 3.48E-07 3.01E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 45 45.65 56 78 2.22E-05 20 2.13E-07 1.48E-07 3.58E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 50 45.7 100 83 1.99E-05 20 3.78E-08 1.37E-07 3.26E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 55 45.75 37 68 2.45E-05 20 8.22E-07 5.85E-07 3.91E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 60 45.8 320 64 2.61E-05 20 8.40E-07 -9.62E-07 3.85E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 65 45.85 260 65 2.90E-05 20 -1.14E-07 -1.49E-06 4.37E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 70 45.9 140 45 2.46E-05 20 -1.25E-06 1.17E-06 2.87E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 75 45.95 240 48 1.55E-05 20 -5.95E-07 -8.53E-07 1.89E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 80 46 240 42 1.48E-05 20 -8.04E-07 -1.10E-06 1.54E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 85 46.05 260 41 1.57E-05 20 -1.40E-07 -1.44E-06 1.45E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 90 46.1 180 17 9.85E-06 20 -9.91E-07 -1.14E-07 2.24E-07 2/22/97 Yes Yes 800 172 1054 C 6 H 6 95 46.15 340 13 1.06E-05 20 9.65E-07 -4.50E-07 4.54E-08 2/22/97 Yes Yes 800 172 1054 C 6 H 6 100 46.2 350 42 1.47E-05 20 1.37E-06 -3.11E-07 1.50E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 105 46.25 270 27 2.37E-05 20 1.81E-08 -2.33E-06 1.89E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 110 46.3 250 -0.7 2.28E-05 20 -9.76E-07 -2.36E-06 -3.61E-07 2/22/97 Yes Yes 800 172 1054 C 6 H 6 115 46.35 270 -9.2 4.11E-05 20 5.96E-07 -4.65E-06 -1.48E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 120 46.4 250 19 4.01E-05 20 -1.33E-06 -3.82E-06 2.35E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 125 46.45 230 45 2.58E-05 20 -1.18E-06 -1.72E-06 3.17E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 130 46.5 250 34 3.87E-05 20 -1.02E-06 -3.26E-06 3.68E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 135 46.55 250 54 1.86E-05 20 -4.33E-07 -1.16E-06 2.57E-06 2/22/97 Yes Yes 800 172 1054 C 6 H 6 140 46.6 270 21 1.61E-05 20 1.58E-07 -1.69E-06 8.77E-07 2/22/97 Yes Yes 800 172 1054 C 6 H 6 145 46.65 230 18 2.22E-05 20 -1.23E-06 -1.97E-06 9.09E-07 2/22/97 Yes Yes 800 172 1054 C 6 H 6 150 46.7 230 18 1.59E-05 20 -1.35E-06 -9.27E-07 5.05E-07 2/22/97 Yes Yes 800 172 1054 C 6 H 7 0 46.7 260 2.5 2.11E-05 20 -6.09E-07 -2.55E-06 1.04E-07 2/22/97 Yes Yes 803 172 1054 C 6 H 7 5 46.75 250 23 3.20E-05 20 -1.01E-06 -2.96E-06 2.06E-06 2/22/97 Yes Yes 803 172 1054 C 6 H 7 10 46.8 280 44 2.37E-05 20 1.97E-07 -1.83E-06 2.65E-06 2/22/97 Yes Yes 803 172 1054 C 6 H 7 15 46.85 270 58 2.16E-05 20 1.15E-08 -1.23E-06 3.13E-06 2/22/97 Yes Yes 803 172 1054 C 6 H 7 20 46.9 160 6.3 2.58E-05 20 -2.46E-06 9.26E-07 2.23E-07 2/22/97 Yes Yes 803 172 1054 C 6 H 7 25 46.95 190 8.8 1.05E-05 20 -1.05E-06 -2.85E-07 -9.94E-09 2/22/97 Yes Yes 803 172 1054 C 6 H 7 30 47 250 0.6 2.54E-05 20 -8.44E-07 -2.57E-06 -8.16E-08 2/22/97 Yes Yes 803 172 1054 C 6 H 7 35 47.05 260 7.3 1.74E-05 20 -3.18E-07 -1.89E-06 2.13E-07 2/22/97 Yes Yes 803 172 1054 C 6 H 7 40 47.1 250 12 2.51E-05 20 -6.21E-07 -2.48E-06 5.61E-07 2/22/97 Yes Yes 803 172 1054 C 6 H 7 45 47.15 290 52 3.15E-05 20 5.47E-07 -2.23E-06 4.08E-06 2/22/97 Yes Yes 803 172 1054 C 6 H 7 50 47.2 320 59 6.66E-05 20 3.10E-06 -2.27E-06 9.67E-06 2/22/97 Yes Yes 803 172 1054 C 6 H 7 55 47.25 190 40 9.25E-05 20 -7.44E-06 -9.92E-07 1.02E-05 2/22/97 Yes Yes 803 172 1054 C 6 H 7 60 47.3 160 -2.7 1.07E-04 20 -1.09E-05 3.00E-06 -1.14E-06 2/22/97 Yes Yes 803 172 1054 C 6 H 7 65 47.35 280 15 3.24E-05 20 5.64E-07 -3.50E-06 1.22E-06 2/22/97 Yes Yes 803 172 1054 C 7 H 1 0 47.2 43 -24 1.30E-04 20 8.93E-06 8.49E-06 -9.27E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 5 47.25 160 34 1.06E-04 20 -8.77E-06 3.60E-06 1.02E-05 2/22/97 Yes Yes 806 172 1054 C 7 H 1 10 47.3 25 41 1.87E-04 20 1.37E-05 6.49E-06 2.09E-05 2/22/97 Yes Yes 806 172 1054 C 7 H 1 15 47.35 67 56 3.00E-04 20 7.08E-06 1.68E-05 4.30E-05 2/22/97 Yes Yes 806 172 1054 C 7 H 1 20 47.4 160 52 1.10E-04 20 -6.64E-06 2.74E-06 1.48E-05 2/22/97 Yes Yes 806 172 1054 C 7 H 1 25 47.45 38 26 7.84E-05 20 5.92E-06 4.60E-06 5.78E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 30 47.5 51 27 7.21E-05 20 4.19E-06 5.51E-06 5.49E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 35 47.55 310 32 4.69E-05 20 2.54E-06 -3.52E-06 4.14E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 40 47.6 310 9.6 1.61E-04 20 1.09E-05 -1.32E-05 4.33E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 45 47.65 360 44 9.32E-05 20 7.03E-06 -3.72E-07 1.11E-05 2/22/97 Yes Yes 806 172 1054 C 7 H 1 50 47.7 51 49 6.33E-05 20 2.84E-06 3.36E-06 8.15E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 55 47.75 47 15 6.96E-05 20 4.86E-06 5.34E-06 3.15E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 60 47.8 320 -11 5.04E-05 20 4.23E-06 -3.25E-06 -1.91E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 65 47.85 7.9 3.6 3.92E-05 20 4.15E-06 4.09E-07 2.16E-07 2/22/97 Yes Yes 806 172 1054 C 7 H 1 70 47.9 360 22 3.51E-05 20 3.61E-06 -1.45E-07 2.12E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 75 47.95 300 28 5.26E-05 20 2.78E-06 -4.14E-06 4.11E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 80 48 350 33 6.84E-05 20 5.79E-06 -1.65E-06 6.22E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 85 48.05 4.2 31 1.00E-04 20 9.16E-06 5.30E-07 8.56E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 90 48.1 350 44 6.69E-05 20 5.06E-06 -5.79E-07 7.82E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 95 48.15 38 37 6.94E-05 20 4.59E-06 3.56E-06 6.85E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 100 48.2 350 46 4.86E-05 20 3.78E-06 -7.33E-07 5.81E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 105 48.25 310 26 3.49E-05 20 2.01E-06 -2.73E-06 2.70E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 110 48.3 290 12 1.23E-04 20 3.54E-06 -1.24E-05 4.16E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 115 48.35 310 56 1.20E-04 20 5.26E-06 -5.59E-06 1.69E-05 2/22/97 Yes Yes 806 172 1054 C 7 H 1 120 48.4 74 19 9.27E-05 20 2.89E-06 9.10E-06 5.22E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 125 48.45 30 -1.7 1.71E-05 20 1.54E-06 8.01E-07 -1.01E-07 2/22/97 Yes Yes 806 172 1054 C 7 H 1 130 48.5 46 9.8 4.20E-05 20 3.15E-06 3.25E-06 1.13E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 135 48.55 6.5 52 3.92E-05 20 2.55E-06 2.23E-07 5.30E-06 2/22/97 Yes Yes 806 172 1054 C 7 H 1 140 48.6 310 6 4.71E-05 20 3.16E-06 -4.08E-06 7.08E-07 2/22/97 Yes Yes 806 172 1054 C 7 H 1 145 48.65 26 5.9 1.36E-05 20 1.39E-06 5.22E-07 -5.14E-08 2/22/97 Yes Yes 806 172 1054 C 7 H 1 150 48.7 120 9.4 9.04E-06 20 -6.58E-07 1.08E-06 -1.20E-07 2/22/97 Yes Yes 806 172 1054 C 7 H 2 0 48.7 73 -22 1.08E-05 20 5.58E-08 7.38E-07 -7.16E-07 2/22/97 Yes Yes 809 172 1054 C 7 H 2 5 48.75 60 7.2 1.89E-05 20 9.19E-07 1.84E-06 3.65E-07 2/22/97 Yes Yes 809 172 1054 C 7 H 2 10 48.8 310 43 1.60E-05 20 8.44E-07 -8.94E-07 1.74E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 15 48.85 300 41 2.96E-05 20 1.05E-06 -2.14E-06 3.33E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 20 48.9 79 35 2.24E-05 20 4.29E-07 1.89E-06 1.98E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 25 48.95 89 40 7.65E-06 20 -1.40E-08 5.75E-07 6.30E-07 2/22/97 Yes Yes 809 172 1054 C 7 H 2 30 49 260 12 4.18E-05 20 -6.34E-07 -4.35E-06 1.45E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 35 49.05 220 34 1.99E-05 20 -1.34E-06 -1.29E-06 1.82E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 40 49.1 340 43 2.57E-05 20 2.00E-06 -5.70E-07 2.75E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 45 49.15 260 21 3.84E-05 20 -7.71E-07 -4.08E-06 2.20E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 50 49.2 280 28 2.85E-05 20 3.64E-07 -2.83E-06 2.22E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 55 49.25 330 19 2.26E-05 20 1.99E-06 -1.08E-06 1.30E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 60 49.3 42 13 5.36E-05 20 3.99E-06 3.69E-06 1.89E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 65 49.35 88 35 3.47E-05 20 5.42E-08 2.91E-06 3.31E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 70 49.4 130 48 2.21E-05 20 -9.13E-07 1.20E-06 2.75E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 75 49.45 300 34 2.66E-05 20 1.28E-06 -1.90E-06 2.50E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 80 49.5 94 -2.7 1.23E-04 20 -1.12E-06 1.32E-05 -1.11E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 85 49.55 150 -71 6.13E-05 20 -1.91E-06 8.25E-07 -1.03E-05 2/22/97 Yes Yes 809 172 1054 C 7 H 2 90 49.6 360 -49 5.55E-05 20 3.78E-06 -2.10E-07 -7.47E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 95 49.65 49 -21 7.97E-05 20 4.98E-06 5.99E-06 -5.31E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 100 49.7 87 -38 4.94E-05 20 3.57E-07 4.07E-06 -5.45E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 105 49.75 320 -48 5.85E-05 20 2.84E-06 -3.04E-06 -7.38E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 110 49.8 330 -23 5.17E-05 20 4.01E-06 -2.57E-06 -3.77E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 115 49.85 38 -17 5.57E-05 20 4.69E-06 3.35E-06 -3.01E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 120 49.9 44 -8 2.28E-04 20 1.73E-05 1.71E-05 -5.33E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 125 49.95 54 -3.9 1.41E-04 20 8.60E-06 1.23E-05 -1.59E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 130 50 270 -22 3.32E-04 20 -9.55E-07 -3.33E-05 -2.15E-05 2/22/97 Yes Yes 809 172 1054 C 7 H 2 135 50.05 300 -19 2.98E-04 20 1.57E-05 -2.60E-05 -1.65E-05 2/22/97 Yes Yes 809 172 1054 C 7 H 2 140 50.1 52 -18 1.36E-04 20 8.38E-06 1.11E-05 -7.18E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 2 145 50.15 48 -21 1.69E-04 20 1.11E-05 1.27E-05 -1.06E-05 2/22/97 Yes Yes 809 172 1054 C 7 H 2 150 50.2 46 -32 1.01E-04 20 6.01E-06 6.88E-06 -9.65E-06 2/22/97 Yes Yes 809 172 1054 C 7 H 3 0 50.2 61 -50 5.05E-05 20 1.43E-06 2.80E-06 -6.72E-06 2/22/97 Yes Yes 812 172 1054 C 7 H 3 5 50.25 30 -31 1.16E-04 20 9.06E-06 5.53E-06 -1.04E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 10 50.3 13 -26 1.03E-04 20 9.54E-06 2.34E-06 -7.92E-06 2/22/97 Yes Yes 812 172 1054 C 7 H 3 15 50.35 44 -38 8.96E-05 20 5.27E-06 5.28E-06 -9.69E-06 2/22/97 Yes Yes 812 172 1054 C 7 H 3 20 50.4 32 -37 1.15E-04 20 8.40E-06 5.18E-06 -1.21E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 25 50.45 350 -33 1.07E-04 20 9.36E-06 -1.71E-06 -1.04E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 30 50.5 350 -40 8.15E-05 20 6.40E-06 -1.00E-06 -9.25E-06 2/22/97 Yes Yes 812 172 1054 C 7 H 3 35 50.55 100 -40 1.82E-04 20 -3.09E-06 1.46E-05 -2.05E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 40 50.6 55 -32 3.00E-04 20 1.58E-05 2.26E-05 -2.78E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 45 50.65 360 -44 1.66E-04 20 1.25E-05 -1.05E-06 -2.02E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 50 50.7 350 -46 1.83E-04 20 1.35E-05 -1.92E-06 -2.29E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 55 50.75 350 -42 1.57E-04 20 1.25E-05 -1.21E-06 -1.81E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 60 50.8 15 -61 1.48E-04 20 7.40E-06 1.90E-06 -2.26E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 65 50.85 360 -46 1.69E-04 20 1.25E-05 -9.37E-07 -2.12E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 70 50.9 350 -37 1.16E-04 20 9.66E-06 -2.56E-06 -1.23E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 75 50.95 19 -32 1.02E-04 20 8.63E-06 3.09E-06 -9.49E-06 2/22/97 Yes Yes 812 172 1054 C 7 H 3 80 51 330 -23 8.40E-05 20 7.05E-06 -4.14E-06 -5.82E-06 2/22/97 Yes Yes 812 172 1054 C 7 H 3 85 51.05 330 -23 7.23E-05 20 6.07E-06 -3.83E-06 -5.28E-06 2/22/97 Yes Yes 812 172 1054 C 7 H 3 90 51.1 320 -33 8.32E-05 20 5.84E-06 -4.69E-06 -8.22E-06 2/22/97 Yes Yes 812 172 1054 C 7 H 3 95 51.15 320 -41 8.83E-05 20 5.13E-06 -4.96E-06 -1.04E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 100 51.2 350 -58 8.73E-05 20 4.99E-06 -9.85E-07 -1.31E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 105 51.25 360 -47 9.96E-05 20 7.21E-06 -6.47E-07 -1.25E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 110 51.3 350 -56 7.74E-05 20 4.19E-06 -9.61E-07 -1.15E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 115 51.35 330 -54 8.86E-05 20 5.31E-06 -2.87E-06 -1.27E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 120 51.4 320 -56 8.84E-05 20 4.47E-06 -3.11E-06 -1.26E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 125 51.45 17 -54 8.38E-05 20 4.89E-06 1.46E-06 -1.18E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 130 51.5 13 -55 7.40E-05 20 4.41E-06 1.06E-06 -1.06E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 135 51.55 360 -57 8.61E-05 20 4.90E-06 -4.90E-07 -1.26E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 140 51.6 340 -55 8.33E-05 20 4.96E-06 -1.60E-06 -1.19E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 145 51.65 20 -54 1.24E-04 20 7.40E-06 2.58E-06 -1.75E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 3 150 51.7 360 -57 1.26E-04 20 6.95E-06 5.59E-08 -1.87E-05 2/22/97 Yes Yes 812 172 1054 C 7 H 4 0 51.7 75 -72 4.31E-05 20 1.39E-07 1.08E-06 -7.13E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 5 51.75 13 -41 8.57E-05 20 6.61E-06 1.65E-06 -9.77E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 10 51.8 0.4 -0.6 4.46E-05 20 4.71E-06 4.09E-08 -2.07E-07 2/22/97 Yes Yes 815 172 1054 C 7 H 4 15 51.85 250 44 2.91E-05 20 -7.95E-07 -2.18E-06 3.49E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 20 51.9 57 -5.9 5.09E-05 20 3.03E-06 4.51E-06 -1.11E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 25 51.95 43 -18 4.02E-05 20 2.98E-06 2.77E-06 -2.31E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 30 52 31 -28 4.85E-05 20 3.80E-06 2.43E-06 -3.98E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 35 52.05 30 -31 3.92E-05 20 3.05E-06 1.77E-06 -3.56E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 40 52.1 51 -43 6.41E-05 20 3.29E-06 3.98E-06 -7.82E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 45 52.15 20 -45 1.13E-04 20 7.89E-06 2.69E-06 -1.39E-05 2/22/97 Yes Yes 815 172 1054 C 7 H 4 50 52.2 23 -43 1.43E-04 20 1.03E-05 4.35E-06 -1.68E-05 2/22/97 Yes Yes 815 172 1054 C 7 H 4 55 52.25 36 -45 1.57E-04 20 9.44E-06 7.01E-06 -1.93E-05 2/22/97 Yes Yes 815 172 1054 C 7 H 4 60 52.3 35 -49 1.56E-04 20 8.88E-06 6.18E-06 -2.05E-05 2/22/97 Yes Yes 815 172 1054 C 7 H 4 65 52.35 34 -49 1.72E-04 20 9.82E-06 6.65E-06 -2.28E-05 2/22/97 Yes Yes 815 172 1054 C 7 H 4 70 52.4 33 -49 1.68E-04 20 9.88E-06 6.39E-06 -2.22E-05 2/22/97 Yes Yes 815 172 1054 C 7 H 4 75 52.45 35 -45 1.66E-04 20 1.01E-05 7.38E-06 -2.04E-05 2/22/97 Yes Yes 815 172 1054 C 7 H 4 80 52.5 22 -38 1.22E-04 20 9.24E-06 3.76E-06 -1.33E-05 2/22/97 Yes Yes 815 172 1054 C 7 H 4 85 52.55 330 -53 4.60E-05 20 2.49E-06 -1.72E-06 -6.61E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 90 52.6 65 -43 6.07E-05 20 1.96E-06 4.27E-06 -7.36E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 95 52.65 50 -40 7.36E-05 20 3.71E-06 4.59E-06 -8.46E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 100 52.7 40 -41 6.59E-05 20 4.24E-06 3.33E-06 -7.57E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 105 52.75 33 -54 4.36E-05 20 2.20E-06 1.50E-06 -5.98E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 110 52.8 42 -45 5.61E-05 20 2.83E-06 2.93E-06 -7.05E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 115 52.85 55 -47 7.40E-05 20 3.43E-06 4.27E-06 -9.54E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 120 52.9 57 -49 1.00E-04 20 3.98E-06 5.90E-06 -1.30E-05 2/22/97 Yes Yes 815 172 1054 C 7 H 4 125 52.95 47 -47 1.30E-04 20 6.27E-06 6.89E-06 -1.64E-05 2/22/97 Yes Yes 815 172 1054 C 7 H 4 130 53 26 -47 7.71E-05 20 5.01E-06 2.51E-06 -9.78E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 135 53.05 22 -54 5.48E-05 20 3.08E-06 1.25E-06 -7.64E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 140 53.1 47 -30 7.75E-05 20 4.85E-06 5.29E-06 -6.79E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 145 53.15 29 -26 6.17E-05 20 5.19E-06 2.81E-06 -4.76E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 4 150 53.2 350 -36 2.13E-05 20 1.53E-06 4.75E-08 -2.38E-06 2/22/97 Yes Yes 815 172 1054 C 7 H 5 0 53.2 98 -21 8.19E-05 20 -1.39E-06 7.92E-06 -5.03E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 5 53.25 47 -35 6.72E-05 20 3.86E-06 4.43E-06 -6.78E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 10 53.3 36 -28 6.04E-05 20 4.52E-06 3.41E-06 -5.07E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 15 53.35 31 -23 5.73E-05 20 4.68E-06 2.91E-06 -3.95E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 20 53.4 24 -25 3.70E-05 20 3.28E-06 1.40E-06 -2.97E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 25 53.45 30 -24 4.34E-05 20 3.61E-06 2.06E-06 -3.32E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 30 53.5 38 -10 4.89E-05 20 3.91E-06 3.24E-06 -1.55E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 35 53.55 21 12 3.19E-05 20 3.01E-06 1.14E-06 1.10E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 40 53.6 17 46 2.41E-05 20 1.78E-06 5.62E-07 2.74E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 45 53.65 27 30 2.61E-05 20 2.02E-06 8.63E-07 2.12E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 50 53.7 23 24 1.78E-05 20 1.61E-06 5.50E-07 1.16E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 55 53.75 44 -11 2.44E-05 20 1.78E-06 1.78E-06 -7.92E-07 2/22/97 Yes Yes 818 172 1054 C 7 H 5 60 53.8 28 -3.7 4.22E-05 20 3.83E-06 1.99E-06 -6.30E-07 2/22/97 Yes Yes 818 172 1054 C 7 H 5 65 53.85 39 20 3.43E-05 20 2.58E-06 2.02E-06 1.92E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 70 53.9 65 70 2.07E-05 20 3.76E-07 6.31E-07 3.28E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 75 53.95 78 31 1.96E-05 20 3.20E-07 1.86E-06 1.70E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 80 54 32 37 2.45E-05 20 1.50E-06 1.01E-06 2.47E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 85 54.05 29 55 1.74E-05 20 8.45E-07 3.66E-07 2.19E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 90 54.1 330 69 1.02E-05 20 2.13E-07 -3.34E-07 1.45E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 95 54.15 320 55 9.16E-06 20 2.04E-07 -5.05E-07 1.02E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 100 54.2 360 13 1.32E-05 20 1.46E-06 -2.44E-07 3.87E-07 2/22/97 Yes Yes 818 172 1054 C 7 H 5 105 54.25 61 4 2.44E-05 20 1.10E-06 2.27E-06 4.17E-07 2/22/97 Yes Yes 818 172 1054 C 7 H 5 110 54.3 28 46 1.92E-05 20 8.72E-07 6.60E-07 2.19E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 115 54.35 330 59 3.88E-05 20 2.00E-06 -1.43E-06 5.51E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 120 54.4 340 51 4.14E-05 20 2.75E-06 -8.72E-07 5.78E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 125 54.45 39 72 3.21E-05 20 6.44E-07 5.51E-07 5.39E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 130 54.5 45 76 3.36E-05 20 5.18E-07 6.65E-07 5.68E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 135 54.55 350 62 3.68E-05 20 1.64E-06 -3.52E-07 5.69E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 140 54.6 42 53 4.45E-05 20 2.07E-06 1.90E-06 6.10E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 145 54.65 80 58 3.70E-05 20 2.96E-07 1.99E-06 5.26E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 5 150 54.7 190 62 2.31E-05 20 -1.55E-06 9.09E-08 3.28E-06 2/22/97 Yes Yes 818 172 1054 C 7 H 6 0 54.7 170 -37 2.24E-05 20 -2.10E-06 9.42E-08 -2.33E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 5 54.75 75 19 3.74E-05 20 8.92E-07 3.79E-06 2.12E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 10 54.8 27 30 5.86E-05 20 4.78E-06 2.55E-06 4.93E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 15 54.85 350 39 6.51E-05 20 5.13E-06 -1.41E-06 7.05E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 20 54.9 24 44 3.06E-05 20 2.21E-06 9.12E-07 3.48E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 25 54.95 65 27 3.38E-05 20 1.39E-06 2.91E-06 2.44E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 30 55 61 18 2.29E-05 20 1.02E-06 2.14E-06 1.18E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 35 55.05 37 28 2.48E-05 20 1.84E-06 1.37E-06 1.94E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 40 55.1 49 21 2.58E-05 20 1.83E-06 2.01E-06 1.35E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 45 55.15 47 20 1.84E-05 20 1.19E-06 1.15E-06 9.63E-07 2/22/97 Yes Yes 821 172 1054 C 7 H 6 50 55.2 53 3.1 2.62E-05 20 1.77E-06 2.15E-06 1.50E-07 2/22/97 Yes Yes 821 172 1054 C 7 H 6 55 55.25 74 -17 1.32E-05 20 4.06E-07 1.31E-06 -6.35E-07 2/22/97 Yes Yes 821 172 1054 C 7 H 6 60 55.3 60 -26 2.29E-05 20 1.03E-06 1.83E-06 -1.91E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 65 55.35 21 -1 1.84E-05 20 1.84E-06 5.68E-07 -1.77E-07 2/22/97 Yes Yes 821 172 1054 C 7 H 6 70 55.4 330 22 2.24E-05 20 2.11E-06 -1.02E-06 1.41E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 75 55.45 14 39 2.81E-05 20 2.25E-06 6.90E-07 3.08E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 80 55.5 61 50 3.99E-05 20 1.15E-06 2.36E-06 5.22E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 85 55.55 230 71 1.85E-05 20 -4.15E-07 -6.26E-07 2.77E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 90 55.6 43 26 2.15E-05 20 1.50E-06 1.34E-06 1.48E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 95 55.65 9.9 37 1.58E-05 20 1.21E-06 1.53E-07 1.40E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 100 55.7 300 66 1.39E-05 20 5.16E-07 -6.20E-07 2.09E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 105 55.75 40 62 1.50E-05 20 5.46E-07 5.05E-07 2.44E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 110 55.8 23 11 2.10E-05 20 1.76E-06 9.00E-07 5.01E-07 2/22/97 Yes Yes 821 172 1054 C 7 H 6 115 55.85 280 29 2.23E-05 20 7.11E-07 -2.28E-06 1.67E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 120 55.9 60 46 2.36E-05 20 1.11E-06 1.54E-06 3.17E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 125 55.95 110 25 7.24E-05 20 -2.07E-06 6.73E-06 5.45E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 130 56 64 60 2.31E-05 20 5.86E-07 1.21E-06 3.53E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 135 56.05 330 33 3.07E-05 20 2.36E-06 -1.38E-06 3.00E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 140 56.1 38 17 1.82E-05 20 1.55E-06 1.14E-06 9.40E-07 2/22/97 Yes Yes 821 172 1054 C 7 H 6 145 56.15 50 8.4 5.80E-05 20 4.00E-06 4.67E-06 1.33E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 6 150 56.2 65 30 6.17E-05 20 2.16E-06 5.56E-06 5.07E-06 2/22/97 Yes Yes 821 172 1054 C 7 H 7 0 56.2 330 35 4.25E-06 20 1.03E-07 -4.84E-07 3.83E-07 2/22/97 Yes Yes 824 172 1054 C 7 H 7 5 56.25 6.1 69 1.34E-05 20 4.56E-07 1.42E-07 2.12E-06 2/22/97 Yes Yes 824 172 1054 C 7 H 7 10 56.3 45 74 1.25E-05 20 2.65E-07 2.83E-07 1.91E-06 2/22/97 Yes Yes 824 172 1054 C 7 H 7 15 56.35 69 9.6 2.23E-05 20 7.58E-07 2.22E-06 6.13E-07 2/22/97 Yes Yes 824 172 1054 C 7 H 7 20 56.4 49 5.6 3.56E-05 20 2.57E-06 2.82E-06 3.65E-07 2/22/97 Yes Yes 824 172 1054 C 7 H 7 25 56.45 14 26 5.85E-05 20 5.45E-06 1.34E-06 4.15E-06 2/22/97 Yes Yes 824 172 1054 C 7 H 7 30 56.5 310 32 5.38E-05 20 2.79E-06 -3.96E-06 4.80E-06 2/22/97 Yes Yes 824 172 1054 C 7 H 7 35 56.55 310 58 4.94E-05 20 1.76E-06 -2.24E-06 7.15E-06 2/22/97 Yes Yes 824 172 1054 C 7 H 7 40 56.6 61 82 7.85E-05 20 7.45E-07 1.12E-06 1.32E-05 2/22/97 Yes Yes 824 172 1054 C 7 H 7 45 56.65 140 54 4.69E-05 20 -2.25E-06 1.73E-06 6.38E-06 2/22/97 Yes Yes 824 172 1054 C 7 H 7 50 56.7 150 10 1.87E-05 20 -1.62E-06 8.08E-07 4.23E-07 2/22/97 Yes Yes 824 172 1054 C 7 H 7 55 56.75 150 -29 2.31E-05 20 -1.86E-06 9.54E-07 -1.97E-06 2/22/97 Yes Yes 824 172 1054 C 7 H 7 60 56.8 50 1.4 3.15E-05 20 2.12E-06 2.51E-06 -7.13E-08 2/22/97 Yes Yes 824 172 1054 C 8 H 1 0 56.7 280 -71 3.88E-04 20 2.64E-06 -1.39E-05 -6.35E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 5 56.75 270 -39 3.23E-04 20 1.44E-06 -2.69E-05 -3.57E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 10 56.8 52 -51 1.79E-04 20 7.38E-06 9.55E-06 -2.43E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 15 56.85 230 -12 5.49E-04 20 -3.95E-05 -4.20E-05 -1.99E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 20 56.9 190 -40 3.37E-04 20 -2.69E-05 -4.61E-06 -3.80E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 25 56.95 87 -48 2.31E-04 20 1.01E-06 1.67E-05 -3.01E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 30 57 80 -4 1.24E-04 20 2.22E-06 1.33E-05 -1.57E-06 2/22/97 Yes Yes 827 172 1054 C 8 H 1 35 57.05 240 -0.6 1.32E-04 20 -6.30E-06 -1.28E-05 -3.35E-07 2/22/97 Yes Yes 827 172 1054 C 8 H 1 40 57.1 230 12 2.96E-04 20 -1.80E-05 -2.54E-05 1.02E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 45 57.15 210 -12 2.29E-04 20 -2.08E-05 -1.20E-05 -8.75E-06 2/22/97 Yes Yes 827 172 1054 C 8 H 1 50 57.2 110 -42 1.27E-04 20 -2.97E-06 9.67E-06 -1.49E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 55 57.25 110 -52 1.18E-04 20 -2.60E-06 7.31E-06 -1.62E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 60 57.3 350 -65 8.34E-05 20 3.58E-06 -9.28E-07 -1.33E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 65 57.35 190 -35 1.28E-04 20 -1.09E-05 -2.04E-06 -1.29E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 70 57.4 170 -20 2.47E-04 20 -2.43E-05 3.40E-06 -1.45E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 75 57.45 210 -44 1.70E-04 20 -1.16E-05 -6.06E-06 -2.04E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 80 57.5 270 -69 1.00E-04 20 -3.10E-07 -4.01E-06 -1.64E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 85 57.55 170 -26 3.02E-04 20 -2.87E-05 3.64E-06 -2.30E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 90 57.6 120 -28 2.97E-04 20 -1.50E-05 2.38E-05 -2.45E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 95 57.65 210 -7.5 2.54E-04 20 -2.30E-05 -1.42E-05 -6.09E-06 2/22/97 Yes Yes 827 172 1054 C 8 H 1 100 57.7 210 -38 2.73E-04 20 -1.89E-05 -1.28E-05 -2.94E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 105 57.75 180 -51 2.21E-04 20 -1.47E-05 -3.77E-07 -2.96E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 110 57.8 190 -44 1.78E-04 20 -1.37E-05 -2.16E-06 -2.17E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 115 57.85 170 -36 1.68E-04 20 -1.39E-05 1.21E-06 -1.75E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 120 57.9 170 -42 2.08E-04 20 -1.56E-05 4.26E-06 -2.40E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 125 57.95 180 -53 1.88E-04 20 -1.20E-05 5.69E-07 -2.60E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 130 58 160 -36 2.25E-04 20 -1.78E-05 7.71E-06 -2.29E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 135 58.05 150 -28 2.44E-04 20 -1.87E-05 1.33E-05 -2.01E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 140 58.1 200 -24 1.71E-04 20 -1.59E-05 -4.67E-06 -1.20E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 145 58.15 150 65 1.53E-04 20 -5.76E-06 3.46E-06 2.39E-05 2/22/97 Yes Yes 827 172 1054 C 8 H 1 150 58.2 190 46 2.01E-04 20 -1.48E-05 -2.94E-06 2.47E-05 2/22/97 Yes Yes 827 172 1054 C 9 H 1 0 58.7 300 9.2 3.85E-04 20 1.99E-05 -3.60E-05 1.07E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 5 58.75 290 28 4.44E-04 20 1.09E-05 -4.08E-05 3.64E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 10 58.8 320 -39 1.03E-04 20 6.36E-06 -5.70E-06 -1.13E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 15 58.85 66 -16 2.47E-04 20 1.02E-05 2.35E-05 -1.21E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 20 58.9 170 36 1.07E-04 20 -8.93E-06 1.79E-06 1.06E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 25 58.95 12 3.7 6.48E-05 20 6.71E-06 1.40E-06 4.97E-07 2/22/97 Yes Yes 832 172 1054 C 9 H 1 30 59 330 21 1.01E-03 20 8.65E-05 -5.10E-05 6.31E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 35 59.05 270 30 7.69E-04 20 9.79E-07 -7.26E-05 6.58E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 40 59.1 260 37 1.88E-04 20 -1.79E-06 -1.61E-05 1.95E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 45 59.15 85 26 1.27E-04 20 9.70E-07 1.21E-05 9.54E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 50 59.2 2.7 -1.5 4.49E-05 20 4.82E-06 1.03E-07 -3.18E-07 2/22/97 Yes Yes 832 172 1054 C 9 H 1 55 59.25 230 28 3.01E-05 20 -1.80E-06 -2.24E-06 2.45E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 60 59.3 100 47 3.63E-05 20 -5.84E-07 2.49E-06 4.46E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 65 59.35 280 58 4.02E-05 20 5.23E-07 -2.42E-06 5.75E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 70 59.4 58 80 5.09E-05 20 6.03E-07 7.58E-07 8.61E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 75 59.45 21 63 9.39E-05 20 4.25E-06 1.77E-06 1.44E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 80 59.5 66 21 1.99E-04 20 7.86E-06 1.83E-05 1.21E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 85 59.55 44 44 5.99E-05 20 3.26E-06 3.05E-06 6.97E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 90 59.6 260 8.9 8.69E-04 20 -2.18E-05 -9.06E-05 2.31E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 95 59.65 260 3.1 5.53E-04 20 -7.50E-06 -5.95E-05 4.91E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 100 59.7 60 6.1 4.87E-05 20 2.73E-06 4.42E-06 7.58E-07 2/22/97 Yes Yes 832 172 1054 C 9 H 1 105 59.75 230 -19 6.96E-04 20 -4.07E-05 -5.80E-05 -3.94E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 110 59.8 350 -52 7.34E-04 20 4.67E-05 -1.02E-05 -1.00E-04 2/22/97 Yes Yes 832 172 1054 C 9 H 1 115 59.85 37 -22 2.34E-04 20 1.86E-05 1.41E-05 -1.55E-05 2/22/97 Yes Yes 832 172 1054 C 9 H 1 120 59.9 230 24 6.15E-05 20 -3.62E-06 -4.71E-06 4.52E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 125 59.95 330 64 3.04E-05 20 1.15E-06 -8.34E-07 4.81E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 130 60 40 2 4.89E-05 20 3.96E-06 3.48E-06 3.10E-07 2/22/97 Yes Yes 832 172 1054 C 9 H 1 135 60.05 350 36 4.45E-05 20 3.68E-06 -8.91E-07 4.53E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 140 60.1 72 50 7.44E-05 20 1.57E-06 4.92E-06 9.82E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 145 60.15 320 35 4.05E-05 20 2.62E-06 -2.54E-06 3.81E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 1 150 60.2 350 41 4.19E-05 20 3.04E-06 -2.65E-07 4.48E-06 2/22/97 Yes Yes 832 172 1054 C 9 H 2 0 60.2 260 28 8.28E-05 20 -1.28E-06 -8.15E-06 6.73E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 5 60.25 140 82 4.96E-05 20 -6.58E-07 5.95E-07 8.48E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 10 60.3 250 52 4.68E-05 20 -1.19E-06 -2.86E-06 6.28E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 15 60.35 270 48 5.10E-05 20 1.21E-07 -3.70E-06 6.58E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 20 60.4 2 58 4.92E-05 20 2.76E-06 3.59E-08 7.06E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 25 60.45 88 81 3.53E-05 20 -1.40E-08 5.51E-07 5.84E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 30 60.5 64 24 5.74E-05 20 2.28E-06 5.18E-06 3.99E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 35 60.55 65 44 6.49E-05 20 2.03E-06 4.52E-06 7.76E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 40 60.6 210 78 3.35E-05 20 -6.11E-07 -2.87E-07 5.41E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 45 60.65 120 51 4.58E-05 20 -1.46E-06 2.59E-06 6.02E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 50 60.7 320 76 5.28E-05 20 1.00E-06 -1.07E-06 8.79E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 55 60.75 310 52 3.81E-05 20 1.41E-06 -2.08E-06 5.22E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 60 60.8 330 45 5.28E-05 20 3.25E-06 -2.23E-06 6.30E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 65 60.85 32 58 5.16E-05 20 2.43E-06 1.44E-06 7.43E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 70 60.9 67 54 5.09E-05 20 1.30E-06 2.94E-06 7.08E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 75 60.95 37 62 4.96E-05 20 1.89E-06 1.62E-06 7.59E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 80 61 300 72 4.96E-05 20 5.34E-07 -1.57E-06 8.08E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 85 61.05 300 52 3.51E-05 20 1.13E-06 -2.13E-06 4.53E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 90 61.1 12 47 3.01E-05 20 2.02E-06 3.84E-07 3.64E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 95 61.15 290 46 4.46E-05 20 1.04E-06 -3.18E-06 5.33E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 100 61.2 320 30 3.16E-05 20 2.25E-06 -2.09E-06 2.61E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 105 61.25 250 64 2.39E-05 20 -4.73E-07 -1.10E-06 3.86E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 110 61.3 200 73 2.36E-05 20 -1.08E-06 -1.62E-07 3.71E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 115 61.35 230 43 6.22E-06 20 -8.70E-08 -5.99E-07 5.19E-07 2/22/97 Yes Yes 835 172 1054 C 9 H 2 120 61.4 30 15 2.72E-05 20 2.52E-06 1.41E-06 1.43E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 125 61.45 340 39 2.93E-05 20 2.12E-06 -7.54E-07 3.35E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 130 61.5 340 35 3.65E-05 20 2.83E-06 -1.20E-06 3.65E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 135 61.55 320 -8.4 3.65E-05 20 2.61E-06 -2.72E-06 -8.43E-07 2/22/97 Yes Yes 835 172 1054 C 9 H 2 140 61.6 34 -11 5.62E-05 20 4.77E-06 3.35E-06 -1.80E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 145 61.65 340 11 3.96E-05 20 3.68E-06 -1.74E-06 1.23E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 2 150 61.7 320 14 3.31E-05 20 2.35E-06 -1.78E-06 1.21E-06 2/22/97 Yes Yes 835 172 1054 C 9 H 3 0 61.7 11 7.9 6.86E-05 20 6.81E-06 1.15E-06 1.63E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 5 61.75 51 31 9.29E-05 20 5.20E-06 6.83E-06 8.24E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 10 61.8 210 37 4.42E-05 20 -3.33E-06 -1.84E-06 4.50E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 15 61.85 270 29 4.49E-05 20 -1.19E-07 -4.27E-06 3.74E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 20 61.9 44 34 4.86E-05 20 3.12E-06 2.97E-06 4.50E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 25 61.95 60 28 3.59E-05 20 1.62E-06 2.94E-06 2.75E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 30 62 54 32 2.58E-05 20 1.20E-06 1.99E-06 2.39E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 35 62.05 60 37 1.37E-05 20 4.79E-07 9.92E-07 1.40E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 40 62.1 320 30 9.05E-06 20 7.05E-07 -4.85E-07 5.60E-07 2/22/97 Yes Yes 838 172 1054 C 9 H 3 45 62.15 29 62 1.18E-05 20 3.64E-07 6.84E-08 1.71E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 50 62.2 1.6 69 1.28E-05 20 4.72E-07 -8.92E-08 2.02E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 55 62.25 57 8.2 1.94E-05 20 1.03E-06 1.77E-06 5.61E-07 2/22/97 Yes Yes 838 172 1054 C 9 H 3 60 62.3 15 -1.6 1.97E-05 20 1.87E-06 4.52E-07 -1.91E-07 2/22/97 Yes Yes 838 172 1054 C 9 H 3 65 62.35 340 20 3.25E-05 20 2.93E-06 -1.32E-06 1.89E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 70 62.4 360 24 3.00E-05 20 2.93E-06 -1.24E-07 2.11E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 75 62.45 350 13 1.80E-05 20 1.75E-06 -1.70E-07 7.36E-07 2/22/97 Yes Yes 838 172 1054 C 9 H 3 80 62.5 3.6 -27 3.61E-05 20 3.11E-06 1.48E-07 -2.91E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 85 62.55 7.5 -31 6.87E-05 20 6.05E-06 7.13E-07 -6.41E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 90 62.6 16 -35 6.70E-05 20 5.45E-06 1.59E-06 -6.78E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 95 62.65 350 -39 4.21E-05 20 3.23E-06 -4.30E-07 -4.77E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 100 62.7 340 -42 5.37E-05 20 3.98E-06 -1.75E-06 -6.24E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 105 62.75 6.3 -48 8.48E-05 20 5.76E-06 6.88E-07 -1.08E-05 2/22/97 Yes Yes 838 172 1054 C 9 H 3 110 62.8 3.4 -44 1.38E-04 20 1.01E-05 6.98E-07 -1.67E-05 2/22/97 Yes Yes 838 172 1054 C 9 H 3 115 62.85 0.9 -39 1.73E-04 20 1.45E-05 4.42E-08 -1.89E-05 2/22/97 Yes Yes 838 172 1054 C 9 H 3 120 62.9 32 -23 1.89E-04 20 1.57E-05 1.01E-05 -1.23E-05 2/22/97 Yes Yes 838 172 1054 C 9 H 3 125 62.95 28 10 1.43E-04 20 1.29E-05 7.08E-06 4.53E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 130 63 310 -18 1.20E-04 20 8.13E-06 -8.96E-06 -6.15E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 135 63.05 8.7 -22 7.39E-05 20 7.00E-06 1.12E-06 -4.57E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 140 63.1 4.2 -21 1.03E-04 20 1.00E-05 7.71E-07 -6.40E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 145 63.15 7.3 -25 1.32E-04 20 1.24E-05 1.59E-06 -9.78E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 3 150 63.2 340 -23 8.58E-05 20 7.60E-06 -2.05E-06 -5.99E-06 2/22/97 Yes Yes 838 172 1054 C 9 H 4 0 63.2 46 -56 9.86E-05 20 3.77E-06 4.02E-06 -1.42E-05 2/22/97 Yes Yes 841 172 1054 C 9 H 4 5 63.25 8 -22 1.48E-04 20 1.43E-05 2.15E-06 -9.76E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 10 63.3 350 -24 8.36E-05 20 8.03E-06 -9.74E-07 -5.92E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 15 63.35 350 -23 3.86E-05 20 3.60E-06 -7.71E-07 -2.57E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 20 63.4 360 -21 2.86E-05 20 2.86E-06 -6.59E-08 -1.99E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 25 63.45 360 -6.2 3.06E-05 20 3.19E-06 -1.88E-07 -7.80E-07 2/22/97 Yes Yes 841 172 1054 C 9 H 4 30 63.5 360 7.4 1.78E-05 20 1.73E-06 3.25E-08 3.56E-07 2/22/97 Yes Yes 841 172 1054 C 9 H 4 35 63.55 360 24 1.55E-05 20 1.42E-06 -9.84E-08 1.02E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 40 63.6 28 27 1.55E-05 20 1.39E-06 7.42E-07 9.45E-07 2/22/97 Yes Yes 841 172 1054 C 9 H 4 45 63.65 290 52 9.93E-06 20 8.70E-08 -8.57E-07 1.23E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 50 63.7 310 25 1.55E-05 20 9.14E-07 -1.33E-06 1.04E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 55 63.75 340 41 1.75E-05 20 1.30E-06 -3.95E-07 2.05E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 60 63.8 38 38 4.55E-05 20 2.86E-06 2.28E-06 4.74E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 65 63.85 2.1 56 3.07E-05 20 1.77E-06 -8.51E-08 4.28E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 70 63.9 300 28 2.83E-05 20 1.50E-06 -2.32E-06 2.25E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 75 63.95 320 57 1.99E-05 20 8.15E-07 -6.76E-07 2.88E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 80 64 97 80 1.79E-05 20 -2.87E-07 2.52E-07 2.97E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 85 64.05 280 70 2.22E-05 20 6.32E-08 -9.62E-07 3.35E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 90 64.1 350 63 2.61E-05 20 1.12E-06 -2.87E-07 3.87E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 95 64.15 270 82 2.41E-05 20 -2.08E-07 -4.39E-07 3.89E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 100 64.2 140 50 2.69E-05 20 -1.38E-06 1.02E-06 3.45E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 105 64.25 130 45 2.12E-05 20 -1.27E-06 1.15E-06 2.74E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 110 64.3 99 80 2.08E-05 20 -4.36E-07 4.16E-07 3.36E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 115 64.35 150 73 1.92E-05 20 -3.04E-07 9.51E-08 2.95E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 120 64.4 270 67 2.07E-05 20 1.86E-07 -8.92E-07 3.52E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 125 64.45 330 47 4.67E-05 20 2.64E-06 -2.03E-06 6.03E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 130 64.5 250 46 4.25E-05 20 -1.22E-06 -2.89E-06 5.37E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 135 64.55 140 13 2.98E-05 20 -2.62E-06 1.85E-06 1.27E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 140 64.6 150 7.5 7.88E-06 20 -7.68E-07 4.09E-07 1.92E-07 2/22/97 Yes Yes 841 172 1054 C 9 H 4 145 64.65 80 47 6.67E-05 20 7.20E-07 4.82E-06 8.29E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 4 150 64.7 170 44 5.72E-05 20 -4.70E-06 8.97E-07 6.70E-06 2/22/97 Yes Yes 841 172 1054 C 9 H 5 0 64.7 190 -50 7.99E-05 20 -5.62E-06 -9.08E-07 -1.07E-05 2/22/97 Yes Yes 844 172 1054 C 9 H 5 5 64.75 14 -17 5.96E-05 20 5.83E-06 1.59E-06 -3.01E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 10 64.8 160 76 1.56E-05 20 -3.66E-07 1.56E-07 2.46E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 15 64.85 300 81 1.95E-05 20 8.62E-08 -2.99E-07 3.30E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 20 64.9 26 78 2.44E-05 20 5.89E-07 1.81E-07 3.89E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 25 64.95 120 59 2.47E-05 20 -5.90E-07 1.17E-06 3.42E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 30 65 57 79 1.75E-05 20 1.30E-07 3.74E-07 2.88E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 35 65.05 19 60 1.96E-05 20 9.70E-07 2.91E-07 2.82E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 40 65.1 27 76 1.80E-05 20 5.73E-07 2.59E-07 2.72E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 45 65.15 140 49 2.11E-05 20 -1.10E-06 8.04E-07 2.56E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 50 65.2 170 67 1.71E-05 20 -5.74E-07 4.34E-08 2.57E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 55 65.25 340 71 2.00E-05 20 7.18E-07 -1.93E-07 3.25E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 60 65.3 6.7 79 1.91E-05 20 3.53E-07 -6.00E-08 3.04E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 65 65.35 46 67 2.16E-05 20 6.76E-07 4.95E-07 3.26E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 70 65.4 52 73 1.58E-05 20 4.77E-07 3.48E-07 2.48E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 75 65.45 240 15 2.68E-05 20 -1.48E-06 -2.22E-06 1.14E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 80 65.5 260 -35 2.62E-05 20 -3.42E-07 -2.40E-06 -2.80E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 85 65.55 58 28 1.86E-05 20 9.64E-07 1.37E-06 1.17E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 90 65.6 160 54 1.61E-05 20 -8.82E-07 2.87E-07 1.99E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 95 65.65 93 47 2.19E-05 20 -1.45E-07 1.52E-06 2.41E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 100 65.7 80 86 1.95E-05 20 2.77E-07 3.92E-08 3.16E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 105 65.75 240 72 1.76E-05 20 -2.84E-07 -5.30E-07 2.94E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 110 65.8 340 73 1.74E-05 20 2.95E-07 -1.53E-07 2.57E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 115 65.85 300 52 2.28E-05 20 1.03E-06 -1.61E-06 2.75E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 120 65.9 260 65 1.96E-05 20 9.61E-08 -8.89E-07 3.17E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 125 65.95 57 78 1.91E-05 20 2.27E-07 2.59E-07 3.25E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 130 66 160 74 1.86E-05 20 -3.95E-07 2.74E-07 3.03E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 135 66.05 230 74 1.77E-05 20 -3.13E-07 -4.42E-07 2.90E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 140 66.1 320 75 1.78E-05 20 5.09E-07 -3.79E-07 2.86E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 145 66.15 46 64 2.09E-05 20 7.97E-07 6.36E-07 2.98E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 5 150 66.2 230 22 2.86E-05 20 -1.86E-06 -2.04E-06 1.51E-06 2/22/97 Yes Yes 844 172 1054 C 9 H 6 0 66.2 250 77 1.84E-05 20 -4.09E-07 -7.21E-07 3.10E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 5 66.25 140 29 5.47E-05 20 -3.71E-06 3.71E-06 4.64E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 10 66.3 140 64 2.05E-05 20 -7.36E-07 6.84E-07 3.09E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 15 66.35 73 61 1.89E-05 20 1.44E-07 9.45E-07 2.89E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 20 66.4 74 55 2.22E-05 20 3.78E-07 1.25E-06 2.99E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 25 66.45 72 57 2.09E-05 20 3.24E-07 1.14E-06 2.84E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 30 66.5 86 55 2.03E-05 20 -9.11E-08 1.34E-06 2.86E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 35 66.55 97 64 2.05E-05 20 -2.32E-07 9.25E-07 3.15E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 40 66.6 130 70 2.01E-05 20 -4.61E-07 6.01E-07 3.04E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 45 66.65 150 59 1.77E-05 20 -9.91E-07 2.65E-07 2.52E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 50 66.7 100 75 1.69E-05 20 -1.05E-07 3.61E-07 2.77E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 55 66.75 200 73 1.78E-05 20 -5.94E-07 -2.26E-07 3.03E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 60 66.8 94 68 1.38E-05 20 -2.15E-07 4.60E-07 2.12E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 65 66.85 70 47 1.91E-05 20 3.51E-07 1.18E-06 2.33E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 70 66.9 330 79 1.64E-05 20 2.80E-07 -2.12E-07 2.78E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 75 66.95 240 67 1.68E-05 20 -4.96E-07 -4.84E-07 2.73E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 80 67 170 76 1.51E-05 20 -6.93E-07 -1.17E-08 2.50E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 85 67.05 99 74 2.02E-05 20 -2.40E-07 4.71E-07 3.17E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 90 67.1 8.1 68 2.88E-05 20 9.61E-07 8.34E-08 4.51E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 95 67.15 280 54 3.30E-05 20 -5.50E-08 -2.18E-06 4.41E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 100 67.2 37 49 4.40E-05 20 2.47E-06 1.76E-06 5.74E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 105 67.25 89 39 2.15E-05 20 -1.88E-07 1.82E-06 2.53E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 110 67.3 200 49 1.40E-05 20 -1.37E-06 -2.39E-07 1.70E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 115 67.35 260 39 2.26E-05 20 -8.21E-08 -2.11E-06 2.31E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 120 67.4 270 56 2.59E-05 20 1.31E-07 -1.55E-06 4.03E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 125 67.45 300 37 3.68E-05 20 1.43E-06 -2.77E-06 3.99E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 130 67.5 250 75 3.66E-05 20 -5.41E-07 -8.45E-07 6.26E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 135 67.55 110 72 3.22E-05 20 -6.82E-07 9.56E-07 5.46E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 140 67.6 1.7 61 3.07E-05 20 1.42E-06 3.75E-08 4.77E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 145 67.65 320 42 5.60E-05 20 3.00E-06 -3.24E-06 6.38E-06 2/22/97 Yes Yes 847 172 1054 C 9 H 6 150 67.7 310 78 4.16E-05 20 1.30E-07 -3.90E-07 6.93E-06 2/22/97 Yes Yes 847 172 1054 C 10 H 1 0 68.2 220 -36 1.12E-04 20 -7.10E-06 -7.17E-06 -1.13E-05 2/22/97 Yes Yes 850 172 1054 C 10 H 1 5 68.25 120 -36 5.64E-04 20 -2.06E-05 4.48E-05 -5.77E-05 2/22/97 Yes Yes 850 172 1054 C 10 H 1 10 68.3 51 -13 7.01E-04 20 4.61E-05 5.74E-05 -2.68E-05 2/22/97 Yes Yes 850 172 1054 C 10 H 1 15 68.35 350 14 1.07E-04 20 1.08E-05 -1.68E-06 4.57E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 20 68.4 310 17 2.57E-04 20 1.62E-05 -2.10E-05 1.27E-05 2/22/97 Yes Yes 850 172 1054 C 10 H 1 25 68.45 290 25 1.76E-04 20 6.88E-06 -1.59E-05 1.26E-05 2/22/97 Yes Yes 850 172 1054 C 10 H 1 30 68.5 8.4 34 1.76E-04 20 1.52E-05 2.37E-06 1.71E-05 2/22/97 Yes Yes 850 172 1054 C 10 H 1 35 68.55 130 19 1.38E-04 20 -8.10E-06 1.15E-05 7.69E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 40 68.6 130 9.8 1.60E-04 20 -1.15E-05 1.23E-05 4.44E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 45 68.65 170 73 1.61E-04 20 -4.92E-06 7.61E-07 2.65E-05 2/22/97 Yes Yes 850 172 1054 C 10 H 1 50 68.7 220 27 1.24E-04 20 -9.30E-06 -7.28E-06 9.69E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 55 68.75 330 25 1.17E-04 20 9.67E-06 -5.94E-06 8.54E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 60 68.8 320 61 6.10E-05 20 2.19E-06 -2.29E-06 9.10E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 65 68.85 320 43 6.33E-05 20 3.81E-06 -3.31E-06 7.36E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 70 68.9 280 55 5.74E-05 20 5.66E-07 -3.53E-06 8.11E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 75 68.95 330 85 3.31E-05 20 3.00E-07 -5.09E-08 5.66E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 80 69 180 18 9.06E-05 20 -9.28E-06 9.17E-09 4.69E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 85 69.05 200 17 3.05E-04 20 -2.89E-05 -1.10E-05 1.56E-05 2/22/97 Yes Yes 850 172 1054 C 10 H 1 90 69.1 320 22 1.23E-03 20 8.61E-05 -8.76E-05 7.95E-05 2/22/97 Yes Yes 850 172 1054 C 10 H 1 95 69.15 30 38 3.24E-03 20 2.36E-04 1.38E-04 3.45E-04 2/22/97 Yes Yes 850 172 1054 C 10 H 1 100 69.2 110 19 2.17E-03 20 -6.56E-05 2.12E-04 1.21E-04 2/22/97 Yes Yes 850 172 1054 C 10 H 1 105 69.25 240 16 2.59E-04 20 -1.27E-05 -2.36E-05 1.26E-05 2/22/97 Yes Yes 850 172 1054 C 10 H 1 110 69.3 280 0 1.81E-04 20 1.89E-06 -1.94E-05 -2.41E-07 2/22/97 Yes Yes 850 172 1054 C 10 H 1 115 69.35 290 6.5 1.28E-04 20 4.56E-06 -1.33E-05 2.23E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 120 69.4 350 21 6.10E-05 20 6.17E-06 -1.24E-06 3.97E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 125 69.45 37 -1.3 7.04E-05 20 5.96E-06 4.49E-06 -2.03E-07 2/22/97 Yes Yes 850 172 1054 C 10 H 1 130 69.5 5.1 -3.4 5.47E-05 20 5.83E-06 6.37E-07 -5.62E-07 2/22/97 Yes Yes 850 172 1054 C 10 H 1 135 69.55 240 4.2 3.63E-05 20 -1.91E-06 -3.41E-06 4.89E-07 2/22/97 Yes Yes 850 172 1054 C 10 H 1 140 69.6 17 16 4.33E-05 20 4.33E-06 1.34E-06 1.97E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 145 69.65 75 73 4.18E-05 20 4.23E-07 1.24E-06 6.74E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 1 150 69.7 190 33 4.22E-05 20 -3.91E-06 -2.91E-07 3.76E-06 2/22/97 Yes Yes 850 172 1054 C 10 H 2 0 69.7 310 -10 1.11E-05 20 4.04E-07 -1.26E-06 -3.41E-07 2/22/97 Yes Yes 853 172 1054 C 10 H 2 5 69.75 98 -1.7 3.87E-05 20 -6.37E-07 4.24E-06 -2.21E-07 2/22/97 Yes Yes 853 172 1054 C 10 H 2 10 69.8 50 26 3.82E-05 20 2.28E-06 2.85E-06 2.83E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 15 69.85 10 26 4.62E-05 20 4.23E-06 7.78E-07 3.47E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 20 69.9 210 64 3.22E-05 20 -1.31E-06 -7.50E-07 4.85E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 25 69.95 220 35 4.24E-05 20 -2.93E-06 -2.37E-06 4.05E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 30 70 45 -10 2.98E-05 20 2.06E-06 2.31E-06 -9.28E-07 2/22/97 Yes Yes 853 172 1054 C 10 H 2 35 70.05 28 -6.6 4.39E-05 20 3.98E-06 2.20E-06 -9.29E-07 2/22/97 Yes Yes 853 172 1054 C 10 H 2 40 70.1 12 5.5 4.49E-05 20 4.70E-06 1.05E-06 5.25E-07 2/22/97 Yes Yes 853 172 1054 C 10 H 2 45 70.15 360 11 7.05E-05 20 7.20E-06 -6.24E-07 2.14E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 50 70.2 350 17 1.41E-04 20 1.39E-05 -3.72E-06 7.11E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 55 70.25 280 15 1.65E-04 20 1.48E-06 -1.72E-05 7.26E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 60 70.3 290 13 1.72E-04 20 5.37E-06 -1.74E-05 6.58E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 65 70.35 340 23 1.21E-04 20 1.10E-05 -4.26E-06 7.95E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 70 70.4 350 34 1.22E-04 20 1.06E-05 -1.76E-06 1.16E-05 2/22/97 Yes Yes 853 172 1054 C 10 H 2 75 70.45 33 49 8.59E-05 20 4.92E-06 3.42E-06 1.13E-05 2/22/97 Yes Yes 853 172 1054 C 10 H 2 80 70.5 73 30 4.43E-05 20 9.17E-07 3.90E-06 3.81E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 85 70.55 280 8.6 5.11E-05 20 6.54E-07 -5.55E-06 1.12E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 90 70.6 290 3.3 2.62E-05 20 9.39E-07 -2.69E-06 1.30E-07 2/22/97 Yes Yes 853 172 1054 C 10 H 2 95 70.65 300 -23 3.90E-05 20 1.94E-06 -3.29E-06 -2.79E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 100 70.7 340 -31 7.00E-05 20 5.97E-06 -2.41E-06 -6.38E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 105 70.75 46 0 5.71E-05 20 3.98E-06 4.49E-06 2.11E-07 2/22/97 Yes Yes 853 172 1054 C 10 H 2 110 70.8 120 11 1.45E-05 20 -1.22E-06 1.35E-06 3.25E-07 2/22/97 Yes Yes 853 172 1054 C 10 H 2 115 70.85 150 -10 4.82E-05 20 -4.08E-06 2.53E-06 -1.66E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 120 70.9 240 -3.8 8.40E-05 20 -5.02E-06 -7.45E-06 -6.86E-07 2/22/97 Yes Yes 853 172 1054 C 10 H 2 125 70.95 300 -22 3.82E-05 20 1.67E-06 -3.37E-06 -2.33E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 130 71 350 29 4.57E-05 20 3.96E-06 -1.01E-06 3.98E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 135 71.05 330 46 4.39E-05 20 2.67E-06 -1.53E-06 5.63E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 140 71.1 340 69 4.15E-05 20 1.39E-06 -5.28E-07 6.81E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 145 71.15 320 70 3.78E-05 20 9.81E-07 -8.84E-07 6.11E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 2 150 71.2 300 46 3.28E-05 20 5.99E-07 -1.93E-06 3.98E-06 2/22/97 Yes Yes 853 172 1054 C 10 H 3 0 71.2 26 39 1.01E-05 20 4.70E-07 8.09E-08 1.12E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 5 71.25 94 41 3.36E-05 20 -3.17E-07 2.84E-06 3.81E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 10 71.3 80 60 4.25E-05 20 3.18E-07 2.32E-06 6.24E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 15 71.35 120 74 2.28E-05 20 -5.20E-07 5.96E-07 3.82E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 20 71.4 220 18 1.10E-04 20 -8.10E-06 -7.79E-06 5.73E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 25 71.45 130 48 4.80E-05 20 -2.23E-06 2.70E-06 5.96E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 30 71.5 79 14 3.79E-05 20 5.64E-07 3.99E-06 1.59E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 35 71.55 220 6.1 6.66E-05 20 -5.59E-06 -4.56E-06 1.19E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 40 71.6 200 -7.2 5.43E-05 20 -5.16E-06 -2.37E-06 -1.39E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 45 71.65 330 -6.4 1.17E-04 20 1.05E-05 -6.59E-06 -2.35E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 50 71.7 330 16 7.89E-05 20 6.71E-06 -4.55E-06 3.69E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 55 71.75 120 25 6.41E-05 20 -3.39E-06 5.35E-06 4.84E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 60 71.8 220 53 2.59E-05 20 -1.55E-06 -1.07E-06 3.52E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 65 71.85 300 66 1.70E-05 20 1.64E-07 -8.05E-07 2.63E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 70 71.9 270 79 1.84E-05 20 -7.14E-08 -3.90E-07 3.15E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 75 71.95 56 75 1.28E-05 20 2.96E-08 4.14E-07 2.21E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 80 72 310 8.5 2.97E-05 20 1.62E-06 -2.53E-06 7.49E-07 2/22/97 Yes Yes 856 172 1054 C 10 H 3 85 72.05 300 4.8 6.17E-05 20 3.52E-06 -5.58E-06 7.28E-07 2/22/97 Yes Yes 856 172 1054 C 10 H 3 90 72.1 120 -2.8 8.61E-05 20 -4.97E-06 7.90E-06 -8.37E-07 2/22/97 Yes Yes 856 172 1054 C 10 H 3 95 72.15 150 -34 1.27E-04 20 -1.02E-05 5.26E-06 -1.25E-05 2/22/97 Yes Yes 856 172 1054 C 10 H 3 100 72.2 240 8.6 3.47E-05 20 -1.63E-06 -3.42E-06 8.81E-07 2/22/97 Yes Yes 856 172 1054 C 10 H 3 105 72.25 220 40 1.88E-04 20 -1.25E-05 -9.35E-06 2.12E-05 2/22/97 Yes Yes 856 172 1054 C 10 H 3 110 72.3 230 47 1.14E-04 20 -6.11E-06 -6.16E-06 1.43E-05 2/22/97 Yes Yes 856 172 1054 C 10 H 3 115 72.35 350 41 3.97E-05 20 3.22E-06 -7.20E-07 4.40E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 120 72.4 340 42 2.83E-05 20 2.06E-06 -7.64E-07 3.62E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 125 72.45 250 62 2.05E-05 20 -6.32E-07 -1.03E-06 3.40E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 130 72.5 49 44 4.13E-05 20 1.80E-06 2.56E-06 5.15E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 135 72.55 240 84 3.79E-05 20 -5.30E-07 -3.80E-07 6.74E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 140 72.6 240 65 3.67E-05 20 -1.01E-06 -1.45E-06 5.89E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 145 72.65 180 12 6.74E-05 20 -7.25E-06 2.13E-07 2.34E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 3 150 72.7 160 -69 3.41E-05 20 -1.79E-06 7.77E-07 -5.59E-06 2/22/97 Yes Yes 856 172 1054 C 10 H 4 0 72.7 37 29 3.17E-05 20 2.12E-06 1.49E-06 2.65E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 5 72.75 210 61 3.40E-05 20 -1.65E-06 -7.46E-07 5.09E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 10 72.8 58 32 3.93E-05 20 1.85E-06 3.10E-06 3.43E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 15 72.85 83 32 9.29E-05 20 9.17E-07 8.47E-06 8.53E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 20 72.9 170 65 6.29E-05 20 -2.72E-06 5.79E-07 9.63E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 25 72.95 240 47 3.74E-05 20 -1.53E-06 -2.34E-06 4.50E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 30 73 66 62 2.86E-05 20 4.52E-07 1.40E-06 4.30E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 35 73.05 320 68 2.60E-05 20 7.76E-07 -6.47E-07 4.08E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 40 73.1 300 33 5.22E-05 20 2.66E-06 -3.91E-06 4.65E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 45 73.15 270 34 3.46E-05 20 -1.67E-07 -3.34E-06 3.19E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 50 73.2 320 0 1.45E-05 20 1.20E-06 -1.16E-06 -1.35E-07 2/22/97 Yes Yes 859 172 1054 C 10 H 4 55 73.25 94 9 5.69E-06 20 -4.35E-08 6.04E-07 1.49E-07 2/22/97 Yes Yes 859 172 1054 C 10 H 4 60 73.3 140 40 1.56E-05 20 -1.05E-06 7.64E-07 1.55E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 65 73.35 280 48 1.42E-05 20 7.64E-08 -1.17E-06 1.68E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 70 73.4 93 65 2.41E-05 20 2.87E-08 1.03E-06 3.70E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 75 73.45 74 65 1.87E-05 20 2.16E-07 9.37E-07 2.87E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 80 73.5 34 51 3.35E-05 20 1.65E-06 1.19E-06 4.38E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 85 73.55 36 78 7.90E-05 20 1.33E-06 8.71E-07 1.31E-05 2/22/97 Yes Yes 859 172 1054 C 10 H 4 90 73.6 230 32 1.06E-04 20 -6.85E-06 -7.05E-06 9.43E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 95 73.65 180 62 4.63E-05 20 -2.43E-06 1.33E-08 6.78E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 100 73.7 130 52 3.03E-05 20 -1.15E-06 1.44E-06 3.94E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 105 73.75 120 54 4.10E-05 20 -1.36E-06 2.29E-06 5.82E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 110 73.8 170 49 3.93E-05 20 -3.00E-06 6.56E-07 4.84E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 115 73.85 110 72 2.67E-05 20 -4.76E-08 6.05E-07 4.11E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 120 73.9 49 51 3.41E-05 20 1.67E-06 1.73E-06 4.74E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 125 73.95 300 32 5.63E-05 20 2.60E-06 -4.46E-06 5.21E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 130 74 290 2.2 3.55E-05 20 1.44E-06 -3.46E-06 2.03E-07 2/22/97 Yes Yes 859 172 1054 C 10 H 4 135 74.05 330 -12 5.39E-05 20 4.60E-06 -3.15E-06 -1.92E-06 2/22/97 Yes Yes 859 172 1054 C 10 H 4 140 74.1 330 0.5 5.13E-05 20 4.61E-06 -2.99E-06 2.16E-09 2/22/97 Yes Yes 859 172 1054 C 10 H 4 145 74.15 270 8.4 3.52E-05 20 -2.52E-07 -3.84E-06 6.73E-07 2/22/97 Yes Yes 859 172 1054 C 10 H 4 150 74.2 210 2.5 2.49E-05 20 -2.53E-06 -1.20E-06 -1.08E-07 2/22/97 Yes Yes 859 172 1054 C 10 H 5 0 74.2 280 9.2 1.68E-05 20 9.28E-08 -2.05E-06 4.54E-07 2/22/97 Yes Yes 862 172 1054 C 10 H 5 5 74.25 300 11 6.37E-05 20 3.01E-06 -5.90E-06 2.07E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 10 74.3 340 42 3.92E-05 20 2.91E-06 -9.38E-07 4.40E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 15 74.35 77 41 5.50E-05 20 8.65E-07 4.39E-06 6.27E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 20 74.4 270 66 3.09E-05 20 3.20E-08 -1.41E-06 4.69E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 25 74.45 180 23 4.47E-05 20 -4.40E-06 9.26E-08 2.78E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 30 74.5 140 16 2.31E-05 20 -2.03E-06 1.53E-06 1.05E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 35 74.55 43 51 2.85E-05 20 1.33E-06 1.31E-06 3.75E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 40 74.6 290 24 2.96E-05 20 9.88E-07 -2.71E-06 1.85E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 45 74.65 330 5.9 4.83E-05 20 4.30E-06 -2.81E-06 7.36E-07 2/22/97 Yes Yes 862 172 1054 C 10 H 5 50 74.7 32 16 2.91E-05 20 2.54E-06 1.52E-06 1.33E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 55 74.75 310 23 1.76E-05 20 1.12E-06 -1.29E-06 1.23E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 60 74.8 300 35 2.43E-05 20 9.02E-07 -1.95E-06 2.30E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 65 74.85 100 54 1.60E-05 20 -2.30E-07 8.77E-07 2.14E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 70 74.9 170 49 2.63E-05 20 -1.75E-06 1.63E-07 3.42E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 75 74.95 230 55 2.29E-05 20 -8.74E-07 -1.01E-06 3.27E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 80 75 250 67 3.13E-05 20 -7.51E-07 -1.28E-06 4.91E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 85 75.05 210 78 2.44E-05 20 -5.21E-07 -3.72E-07 3.90E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 90 75.1 71 42 1.37E-05 20 2.50E-07 1.01E-06 1.41E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 95 75.15 310 18 3.37E-05 20 1.95E-06 -2.75E-06 1.54E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 100 75.2 280 85 2.32E-05 20 1.36E-07 -2.61E-07 3.91E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 105 75.25 230 45 1.93E-05 20 -1.07E-06 -1.08E-06 2.55E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 110 75.3 320 -1.8 5.10E-05 20 3.55E-06 -3.73E-06 -4.63E-07 2/22/97 Yes Yes 862 172 1054 C 10 H 5 115 75.35 320 6.5 6.18E-05 20 5.51E-06 -4.07E-06 1.00E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 120 75.4 290 63 2.24E-05 20 4.29E-07 -1.03E-06 3.69E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 125 75.45 73 65 3.18E-05 20 2.47E-07 1.38E-06 5.13E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 130 75.5 37 67 5.69E-05 20 1.78E-06 1.56E-06 9.17E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 135 75.55 240 85 5.44E-05 20 -3.97E-07 -4.39E-07 9.50E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 140 75.6 210 71 5.44E-05 20 -1.69E-06 -9.27E-07 8.94E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 145 75.65 290 78 5.67E-05 20 3.78E-07 -1.25E-06 9.49E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 5 150 75.7 150 61 4.03E-05 20 -2.16E-06 1.36E-06 5.94E-06 2/22/97 Yes Yes 862 172 1054 C 10 H 6 0 75.7 300 18 1.36E-06 20 -1.77E-07 -4.24E-07 4.92E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 5 75.75 120 12 7.60E-07 20 -1.33E-07 1.47E-07 -1.47E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 10 75.8 110 25 2.07E-06 20 -9.69E-08 2.02E-07 7.78E-09 2/22/97 Yes Yes 865 172 1054 C 10 H 6 15 75.85 10 17 1.66E-06 20 5.75E-08 1.58E-08 7.47E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 20 75.9 200 56 2.33E-06 20 -9.36E-08 -1.08E-07 1.22E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 25 75.95 130 40 1.44E-06 20 -9.44E-08 3.50E-08 -6.26E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 30 76 170 46 1.12E-06 20 -2.13E-07 7.42E-08 8.16E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 35 76.05 120 26 7.46E-07 20 -1.08E-07 2.50E-09 -3.54E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 40 76.1 98 64 9.73E-07 20 8.87E-08 8.42E-08 -1.21E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 45 76.15 110 37 1.74E-06 20 -1.63E-07 -1.08E-07 2.46E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 50 76.2 200 19 1.36E-06 20 -9.85E-08 -1.88E-07 -3.63E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 55 76.25 89 -0.4 1.30E-06 20 -2.96E-08 1.18E-07 1.77E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 60 76.3 360 -5 1.73E-06 20 6.24E-08 -1.24E-07 -1.89E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 65 76.35 340 58 8.75E-07 20 -6.57E-09 -1.88E-07 -1.51E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 70 76.4 150 9.8 3.50E-06 20 -2.53E-07 1.20E-07 2.76E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 75 76.45 38 -17 9.40E-07 20 1.97E-08 1.37E-07 -8.08E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 80 76.5 17 31 9.89E-07 20 -1.48E-07 -8.26E-08 -2.46E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 85 76.55 140 34 1.31E-06 20 -1.66E-07 -8.42E-08 -1.56E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 90 76.6 110 39 7.31E-07 20 -1.17E-07 -5.34E-08 -1.27E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 95 76.65 350 8.9 1.15E-06 20 -6.90E-08 -1.45E-07 -2.58E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 100 76.7 150 38 1.25E-06 20 1.89E-08 -7.84E-08 -4.75E-09 2/22/97 Yes Yes 865 172 1054 C 10 H 6 105 76.75 160 9.7 1.08E-06 20 -2.34E-07 1.33E-08 1.48E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 110 76.8 350 -7.3 2.49E-06 20 -9.85E-08 -1.92E-08 -2.89E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 115 76.85 160 29 2.23E-06 20 4.19E-08 -1.82E-07 -7.08E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 120 76.9 140 7.3 2.72E-06 20 -9.85E-08 1.38E-07 2.43E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 125 76.95 56 -17 1.39E-06 20 -8.78E-08 1.67E-09 2.59E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 130 77 130 -7.7 1.39E-06 20 -1.72E-07 1.58E-07 -1.77E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 135 77.05 93 -78 2.07E-06 20 -1.39E-07 -2.00E-08 -3.07E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 140 77.1 340 -1.5 3.52E-06 20 3.14E-07 -1.82E-07 -4.10E-08 2/22/97 Yes Yes 865 172 1054 C 10 H 6 145 77.15 360 42 2.69E-06 20 1.46E-07 -1.16E-07 1.44E-07 2/22/97 Yes Yes 865 172 1054 C 10 H 6 150 77.2 42 26 3.64E-06 20 -1.13E-07 4.74E-07 2.89E-08 2/22/97 Yes Yes 865 172 1054 C 11 H 1 0 77.7 0.8 12 2.73E-04 20 2.81E-05 1.28E-07 9.68E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 5 77.75 50 30 1.17E-04 20 6.86E-06 8.56E-06 1.01E-05 2/22/97 Yes Yes 868 172 1054 C 11 H 1 10 77.8 330 20 1.81E-04 20 1.54E-05 -9.68E-06 1.08E-05 2/22/97 Yes Yes 868 172 1054 C 11 H 1 15 77.85 330 48 5.42E-05 20 3.19E-06 -2.06E-06 6.97E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 20 77.9 57 53 4.42E-05 20 1.60E-06 2.40E-06 5.90E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 25 77.95 260 67 5.90E-05 20 -3.24E-07 -2.55E-06 9.18E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 30 78 91 45 1.76E-04 20 -3.33E-07 1.35E-05 2.15E-05 2/22/97 Yes Yes 868 172 1054 C 11 H 1 35 78.05 150 44 1.85E-04 20 -1.22E-05 7.39E-06 2.21E-05 2/22/97 Yes Yes 868 172 1054 C 11 H 1 40 78.1 170 73 5.33E-05 20 -1.46E-06 2.23E-07 8.59E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 45 78.15 250 69 4.83E-05 20 -6.38E-07 -1.96E-06 7.69E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 50 78.2 210 11 6.07E-05 20 -5.58E-06 -2.99E-06 1.84E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 55 78.25 170 -1.1 5.54E-05 20 -5.72E-06 1.26E-06 -1.56E-07 2/22/97 Yes Yes 868 172 1054 C 11 H 1 60 78.3 200 -3.9 2.62E-04 20 -2.55E-05 -1.13E-05 -3.26E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 65 78.35 210 5.7 7.86E-04 20 -7.44E-05 -3.76E-05 1.34E-05 2/22/97 Yes Yes 868 172 1054 C 11 H 1 70 78.4 230 57 1.41E-04 20 -5.37E-06 -6.04E-06 2.06E-05 2/22/97 Yes Yes 868 172 1054 C 11 H 1 75 78.45 75 48 1.87E-04 20 3.47E-06 1.31E-05 2.42E-05 2/22/97 Yes Yes 868 172 1054 C 11 H 1 80 78.5 93 55 5.81E-05 20 -3.74E-07 3.57E-06 8.14E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 85 78.55 230 6.6 1.70E-04 20 -1.19E-05 -1.37E-05 3.12E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 90 78.6 250 53 4.56E-05 20 -1.02E-06 -2.86E-06 6.10E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 95 78.65 350 53 5.62E-05 20 3.51E-06 -4.42E-07 7.47E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 100 78.7 250 36 9.24E-05 20 -2.34E-06 -7.75E-06 9.28E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 105 78.75 250 48 5.48E-05 20 -1.32E-06 -3.69E-06 7.23E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 110 78.8 350 51 3.99E-05 20 2.29E-06 -5.70E-07 5.19E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 115 78.85 58 27 4.01E-05 20 2.37E-06 3.10E-06 2.89E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 120 78.9 250 15 3.08E-05 20 -6.22E-07 -3.07E-06 1.55E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 125 78.95 340 60 2.58E-05 20 1.21E-06 -5.12E-07 4.00E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 130 79 350 62 4.04E-05 20 2.03E-06 -1.88E-07 6.21E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 135 79.05 7.5 35 5.74E-05 20 4.91E-06 6.88E-07 5.79E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 140 79.1 75 61 3.95E-05 20 6.12E-07 2.02E-06 6.01E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 145 79.15 74 67 4.96E-05 20 6.17E-07 2.01E-06 7.77E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 1 150 79.2 120 78 3.25E-05 20 -5.59E-07 9.98E-07 5.29E-06 2/22/97 Yes Yes 868 172 1054 C 11 H 2 0 79.2 330 47 2.04E-05 20 1.02E-06 -1.08E-06 2.57E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 5 79.25 66 28 5.87E-05 20 2.17E-06 5.23E-06 4.71E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 10 79.3 230 27 3.83E-05 20 -2.25E-06 -2.90E-06 2.92E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 15 79.35 280 40 5.24E-05 20 3.71E-07 -4.31E-06 5.86E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 20 79.4 28 70 4.65E-05 20 1.55E-06 7.84E-07 7.36E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 25 79.45 54 49 5.76E-05 20 2.33E-06 3.30E-06 7.32E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 30 79.5 57 76 4.46E-05 20 4.80E-07 1.05E-06 7.47E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 35 79.55 240 40 8.19E-05 20 -3.05E-06 -6.10E-06 9.09E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 40 79.6 180 63 7.38E-05 20 -3.48E-06 -1.75E-07 1.11E-05 2/22/97 Yes Yes 870 172 1054 C 11 H 2 45 79.65 280 55 1.53E-05 20 1.08E-07 -1.15E-06 2.04E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 50 79.7 320 -15 1.19E-05 20 9.30E-07 -9.33E-07 -5.93E-07 2/22/97 Yes Yes 870 172 1054 C 11 H 2 55 79.75 100 29 2.86E-05 20 -5.28E-07 2.68E-06 2.44E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 60 79.8 150 82 3.74E-05 20 -5.99E-07 1.60E-07 6.30E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 65 79.85 340 67 5.57E-05 20 2.04E-06 -1.05E-06 8.81E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 70 79.9 330 68 5.97E-05 20 2.05E-06 -1.43E-06 9.53E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 75 79.95 260 73 4.18E-05 20 -2.78E-07 -1.18E-06 6.95E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 80 80 250 45 5.81E-05 20 -1.46E-06 -4.35E-06 7.04E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 85 80.05 270 40 8.24E-05 20 -3.55E-07 -6.94E-06 8.97E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 90 80.1 250 78 7.18E-05 20 -5.30E-07 -1.57E-06 1.20E-05 2/22/97 Yes Yes 870 172 1054 C 11 H 2 95 80.15 100 69 7.27E-05 20 -8.26E-07 2.69E-06 1.15E-05 2/22/97 Yes Yes 870 172 1054 C 11 H 2 100 80.2 180 57 3.86E-05 20 -2.13E-06 -1.68E-07 5.53E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 105 80.25 260 22 3.59E-05 20 -9.04E-07 -3.50E-06 2.48E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 110 80.3 280 62 2.98E-05 20 -5.66E-08 -1.43E-06 4.39E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 115 80.35 180 75 2.83E-05 20 -5.38E-07 -2.05E-07 4.55E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 120 80.4 35 83 4.17E-05 20 5.62E-07 3.38E-07 7.44E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 125 80.45 84 20 6.32E-05 20 5.25E-07 6.34E-06 3.96E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 130 80.5 300 39 4.29E-05 20 1.43E-06 -3.14E-06 4.78E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 135 80.55 190 76 5.07E-05 20 -1.41E-06 -2.04E-07 8.66E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 140 80.6 220 44 7.17E-05 20 -4.26E-06 -3.55E-06 8.68E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 2 145 80.65 14 58 9.67E-05 20 5.17E-06 1.27E-06 1.42E-05 2/22/97 Yes Yes 870 172 1054 C 11 H 2 150 80.7 77 45 6.51E-05 20 7.56E-07 5.19E-06 7.79E-06 2/22/97 Yes Yes 870 172 1054 C 11 H 3 0 80.7 31 50 5.30E-05 20 2.87E-06 1.61E-06 6.97E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 5 80.75 210 9.8 2.52E-04 20 -2.37E-05 -1.19E-05 7.36E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 10 80.8 210 45 5.59E-05 20 -3.64E-06 -2.13E-06 6.75E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 15 80.85 13 41 2.52E-05 20 1.87E-06 4.43E-07 2.83E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 20 80.9 150 31 3.34E-05 20 -2.54E-06 1.53E-06 2.80E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 25 80.95 150 41 3.16E-05 20 -2.26E-06 1.12E-06 3.38E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 30 81 280 46 3.09E-05 20 1.40E-07 -2.28E-06 3.78E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 35 81.05 170 49 2.94E-05 20 -2.10E-06 1.23E-07 3.77E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 40 81.1 130 7.4 1.23E-04 20 -7.65E-06 1.07E-05 2.47E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 45 81.15 140 57 4.76E-05 20 -2.35E-06 1.36E-06 6.77E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 50 81.2 310 62 3.33E-05 20 1.05E-06 -1.48E-06 4.98E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 55 81.25 49 57 2.86E-05 20 1.05E-06 1.22E-06 4.20E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 60 81.3 240 26 2.59E-05 20 -1.34E-06 -2.32E-06 1.82E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 65 81.35 240 46 1.80E-05 20 -7.81E-07 -1.32E-06 2.10E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 70 81.4 220 47 2.78E-05 20 -1.42E-06 -1.48E-06 3.43E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 75 81.45 150 59 3.94E-05 20 -1.97E-06 1.07E-06 5.81E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 80 81.5 170 69 3.95E-05 20 -1.72E-06 1.93E-07 6.26E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 85 81.55 63 70 4.33E-05 20 6.46E-07 1.27E-06 6.75E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 90 81.6 230 69 4.70E-05 20 -1.17E-06 -1.55E-06 7.41E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 95 81.65 290 67 3.58E-05 20 3.47E-07 -1.55E-06 5.42E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 100 81.7 88 76 3.69E-05 20 1.42E-07 7.85E-07 6.08E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 105 81.75 240 52 3.83E-05 20 -1.37E-06 -2.30E-06 5.32E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 110 81.8 330 68 2.34E-05 20 4.44E-07 -5.14E-07 3.52E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 115 81.85 190 53 3.77E-05 20 -2.09E-06 -7.63E-07 4.99E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 120 81.9 170 25 2.88E-05 20 -2.57E-06 5.88E-07 2.25E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 125 81.95 5.7 82 2.05E-05 20 1.31E-07 -1.13E-07 3.61E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 130 82 100 82 3.72E-05 20 -1.86E-07 5.67E-07 6.39E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 135 82.05 250 71 3.41E-05 20 -4.87E-07 -1.27E-06 5.61E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 140 82.1 220 42 3.10E-05 20 -1.81E-06 -1.78E-06 3.57E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 145 82.15 110 33 2.22E-05 20 -7.82E-07 1.75E-06 1.91E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 3 150 82.2 71 58 1.26E-05 20 -1.41E-07 8.97E-07 1.59E-06 2/22/97 Yes Yes 872 172 1054 C 11 H 4 0 82.2 72 43 1.77E-05 20 1.76E-07 1.04E-06 2.06E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 5 82.25 20 60 3.91E-05 20 1.88E-06 8.14E-07 5.81E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 10 82.3 130 68 5.08E-05 20 -1.28E-06 1.65E-06 8.02E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 15 82.35 170 26 5.86E-05 20 -5.58E-06 1.10E-06 4.49E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 20 82.4 160 49 5.74E-05 20 -3.65E-06 1.60E-06 7.28E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 25 82.45 200 71 4.63E-05 20 -1.48E-06 -7.31E-07 7.39E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 30 82.5 170 62 3.85E-05 20 -2.03E-06 4.35E-07 5.86E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 35 82.55 16 58 5.41E-05 20 2.86E-06 8.02E-07 7.84E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 40 82.6 310 61 5.10E-05 20 1.61E-06 -2.11E-06 7.49E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 45 82.65 360 62 3.07E-05 20 1.37E-06 -3.05E-07 4.57E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 50 82.7 350 52 3.92E-05 20 2.55E-06 -5.72E-07 5.24E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 55 82.75 360 65 3.33E-05 20 1.41E-06 -6.76E-08 5.29E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 60 82.8 330 65 3.56E-05 20 1.30E-06 -8.67E-07 5.43E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 65 82.85 120 75 3.04E-05 20 -4.46E-07 6.05E-07 4.97E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 70 82.9 130 44 2.93E-05 20 -1.56E-06 1.57E-06 3.44E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 75 82.95 78 50 3.24E-05 20 3.69E-07 2.31E-06 4.26E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 80 83 260 77 3.13E-05 20 -4.22E-07 -8.66E-07 5.19E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 85 83.05 330 49 4.21E-05 20 2.35E-06 -1.79E-06 5.25E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 90 83.1 20 47 6.21E-05 20 4.12E-06 1.49E-06 7.63E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 95 83.15 330 56 9.88E-05 20 4.87E-06 -3.20E-06 1.39E-05 2/22/97 Yes Yes 874 172 1054 C 11 H 4 100 83.2 300 84 5.76E-05 20 3.57E-07 -7.39E-07 9.82E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 105 83.25 140 74 2.97E-05 20 -8.74E-07 5.03E-07 5.10E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 110 83.3 11 67 2.43E-05 20 5.72E-07 1.99E-07 3.69E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 115 83.35 320 59 2.73E-05 20 1.27E-06 -1.31E-06 3.82E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 120 83.4 300 67 2.51E-05 20 6.75E-07 -9.14E-07 4.21E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 125 83.45 290 81 2.73E-05 20 -6.73E-08 -5.70E-07 4.81E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 130 83.5 34 80 4.01E-05 20 5.02E-07 4.85E-07 6.89E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 4 135 83.55 300 79 6.14E-05 20 3.62E-07 -1.24E-06 1.05E-05 2/22/97 Yes Yes 874 172 1054 C 11 H 4 140 83.6 270 73 6.85E-05 20 -9.36E-08 -2.23E-06 1.14E-05 2/22/97 Yes Yes 874 172 1054 C 11 H 4 145 83.65 310 51 7.81E-05 20 3.23E-06 -4.23E-06 1.03E-05 2/22/97 Yes Yes 874 172 1054 C 11 H 4 150 83.7 11 58 5.19E-05 20 2.43E-06 8.01E-07 7.43E-06 2/22/97 Yes Yes 874 172 1054 C 11 H 5 0 83.7 310 56 1.63E-05 20 4.66E-07 -1.01E-06 2.30E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 5 83.75 320 66 3.48E-05 20 1.10E-06 -9.12E-07 5.44E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 10 83.8 110 63 3.16E-05 20 -4.33E-07 1.49E-06 4.73E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 15 83.85 140 41 2.79E-05 20 -1.75E-06 1.49E-06 3.13E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 20 83.9 130 9.5 5.16E-05 20 -3.54E-06 4.02E-06 1.23E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 25 83.95 120 11 4.40E-05 20 -2.58E-06 3.79E-06 1.14E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 30 84 79 77 2.31E-05 20 3.04E-08 6.15E-07 3.81E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 35 84.05 49 64 4.66E-05 20 1.42E-06 1.64E-06 7.12E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 40 84.1 150 66 3.74E-05 20 -1.23E-06 8.37E-07 5.62E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 45 84.15 350 72 2.80E-05 20 8.97E-07 -3.54E-07 4.40E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 50 84.2 350 67 3.02E-05 20 1.35E-06 -2.62E-07 4.67E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 55 84.25 14 50 4.55E-05 20 3.09E-06 7.31E-07 6.00E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 60 84.3 150 62 6.66E-05 20 -2.97E-06 1.51E-06 9.95E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 65 84.35 170 55 4.59E-05 20 -2.66E-06 5.01E-07 6.33E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 70 84.4 320 71 3.79E-05 20 1.21E-06 -8.54E-07 6.09E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 75 84.45 330 73 3.86E-05 20 1.10E-06 -5.25E-07 6.30E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 80 84.5 250 70 3.32E-05 20 -4.74E-07 -1.28E-06 5.23E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 85 84.55 110 36 2.55E-05 20 -6.64E-07 1.96E-06 2.25E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 90 84.6 320 57 1.98E-05 20 9.12E-07 -8.81E-07 2.58E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 95 84.65 7.5 75 2.51E-05 20 6.38E-07 -1.58E-08 3.83E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 100 84.7 230 71 2.77E-05 20 -3.64E-07 -8.71E-07 4.33E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 105 84.75 270 83 3.95E-05 20 3.94E-08 -5.27E-07 6.84E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 110 84.8 90 46 3.96E-05 20 -1.88E-07 3.02E-06 4.59E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 115 84.85 230 55 2.41E-05 20 -4.85E-07 -1.46E-06 3.06E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 120 84.9 47 17 4.82E-05 20 3.62E-06 3.65E-06 2.49E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 125 84.95 27 47 4.69E-05 20 3.04E-06 1.47E-06 5.95E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 130 85 250 52 4.23E-05 20 -8.28E-07 -2.58E-06 5.73E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 135 85.05 200 69 2.32E-05 20 -7.47E-07 -4.34E-07 3.70E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 140 85.1 42 61 2.95E-05 20 1.28E-06 1.00E-06 4.35E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 145 85.15 65 75 3.99E-05 20 6.08E-07 9.42E-07 6.39E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 5 150 85.2 350 76 2.22E-05 20 3.78E-07 1.11E-07 3.37E-06 2/22/97 Yes Yes 876 172 1054 C 11 H 6 0 85.2 45 46 1.12E-05 20 3.52E-07 2.90E-07 1.38E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 5 85.25 96 72 2.49E-05 20 -1.53E-07 9.04E-07 4.06E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 10 85.3 350 24 5.71E-05 20 5.41E-06 -1.21E-06 3.81E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 15 85.35 9.1 13 1.11E-04 20 1.12E-05 1.85E-06 4.34E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 20 85.4 260 2.4 7.86E-05 20 -1.50E-06 -8.44E-06 3.48E-07 2/22/97 Yes Yes 878 172 1054 C 11 H 6 25 85.45 110 -38 3.67E-05 20 -8.08E-07 2.97E-06 -4.15E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 30 85.5 8.8 28 9.69E-05 20 8.88E-06 1.48E-06 7.77E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 35 85.55 51 46 2.07E-04 20 9.61E-06 1.20E-05 2.56E-05 2/22/97 Yes Yes 878 172 1054 C 11 H 6 40 85.6 150 42 1.83E-04 20 -1.21E-05 7.83E-06 2.10E-05 2/22/97 Yes Yes 878 172 1054 C 11 H 6 45 85.65 110 14 2.63E-05 20 -1.11E-06 2.31E-06 9.41E-07 2/22/97 Yes Yes 878 172 1054 C 11 H 6 50 85.7 330 20 4.64E-05 20 4.17E-06 -2.33E-06 2.61E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 55 85.75 53 31 5.03E-05 20 2.76E-06 3.72E-06 4.50E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 60 85.8 250 -4.9 6.45E-05 20 -2.71E-06 -6.53E-06 -1.14E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 65 85.85 250 9.9 1.91E-04 20 -7.00E-06 -1.92E-05 5.53E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 70 85.9 97 26 7.10E-05 20 -7.52E-07 6.80E-06 5.30E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 75 85.95 84 28 2.07E-05 20 2.01E-07 2.06E-06 1.62E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 80 86 330 22 4.01E-05 20 3.38E-06 -1.83E-06 2.52E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 85 86.05 250 5.7 3.57E-05 20 -1.23E-06 -3.78E-06 3.09E-07 2/22/97 Yes Yes 878 172 1054 C 11 H 6 90 86.1 99 -7.4 1.00E-04 20 -1.66E-06 1.06E-05 -2.49E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 95 86.15 330 65 5.33E-05 20 2.03E-06 -1.18E-06 8.07E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 100 86.2 130 78 5.45E-05 20 -6.03E-07 7.87E-07 9.09E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 105 86.25 230 25 5.65E-05 20 -3.43E-06 -4.37E-06 4.20E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 110 86.3 17 50 3.50E-05 20 2.02E-06 7.39E-07 4.38E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 115 86.35 170 44 5.75E-05 20 -3.92E-06 8.99E-07 6.64E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 120 86.4 210 47 4.98E-05 20 -2.76E-06 -2.06E-06 6.48E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 125 86.45 300 80 4.68E-05 20 3.48E-07 -9.11E-07 8.04E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 130 86.5 270 66 5.71E-05 20 4.02E-08 -2.41E-06 9.06E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 135 86.55 140 67 5.97E-05 20 -1.91E-06 1.56E-06 9.56E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 140 86.6 63 78 5.35E-05 20 6.17E-07 1.04E-06 9.02E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 145 86.65 320 45 8.20E-05 20 4.44E-06 -4.42E-06 9.94E-06 2/22/97 Yes Yes 878 172 1054 C 11 H 6 150 86.7 300 66 6.99E-05 20 1.30E-06 -2.39E-06 1.08E-05 2/22/97 Yes Yes 878 172 1054 C 12 H 1 0 87.2 190 -22 1.07E-03 20 -1.05E-04 -1.20E-05 -7.02E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 5 87.25 220 -38 4.62E-04 20 -2.82E-05 -2.72E-05 -4.90E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 10 87.3 130 -44 8.47E-05 20 -4.38E-06 4.82E-06 -1.04E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 15 87.35 56 9.8 3.03E-04 20 1.76E-05 2.68E-05 8.86E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 20 87.4 160 33 2.09E-04 20 -1.69E-05 7.33E-06 1.97E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 25 87.45 170 76 2.19E-04 20 -5.40E-06 1.27E-06 3.67E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 30 87.5 88 43 3.94E-04 20 7.56E-07 3.11E-05 4.69E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 35 87.55 180 42 2.09E-04 20 -1.64E-05 -1.37E-06 2.43E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 40 87.6 270 65 8.58E-05 20 -1.27E-07 -3.90E-06 1.32E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 45 87.65 38 69 5.32E-05 20 1.55E-06 1.03E-06 8.40E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 50 87.7 120 39 1.09E-04 20 -4.44E-06 7.82E-06 1.16E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 55 87.75 180 61 5.63E-05 20 -2.89E-06 -8.92E-08 8.49E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 60 87.8 280 79 3.67E-05 20 8.37E-08 -9.17E-07 6.04E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 65 87.85 43 59 3.58E-05 20 1.46E-06 1.19E-06 5.11E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 70 87.9 77 24 4.35E-05 20 1.07E-06 4.10E-06 2.99E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 75 87.95 270 -20 5.15E-05 20 3.33E-07 -5.17E-06 -3.17E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 80 88 28 11 9.94E-05 20 9.02E-06 4.79E-06 3.15E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 85 88.05 120 -6.6 6.39E-05 20 -2.95E-06 6.00E-06 -1.61E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 90 88.1 96 -56 4.60E-05 20 -2.87E-07 2.66E-06 -6.84E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 95 88.15 56 11 2.46E-05 20 1.37E-06 2.02E-06 4.54E-07 2/22/97 Yes Yes 880 172 1054 C 12 H 1 100 88.2 160 2.1 2.70E-05 20 -2.54E-06 6.25E-07 -2.42E-08 2/22/97 Yes Yes 880 172 1054 C 12 H 1 105 88.25 81 15 4.67E-05 20 7.64E-07 4.76E-06 2.17E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 110 88.3 270 66 3.73E-05 20 -1.27E-07 -1.69E-06 5.58E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 115 88.35 300 13 5.50E-05 20 3.03E-06 -5.41E-06 1.82E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 120 88.4 18 57 4.06E-05 20 2.48E-06 6.61E-07 6.02E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 125 88.45 170 66 2.28E-05 20 -9.75E-07 9.09E-08 3.65E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 130 88.5 3.8 68 3.99E-05 20 1.62E-06 1.21E-07 6.37E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 135 88.55 62 67 9.77E-05 20 1.96E-06 3.60E-06 1.55E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 140 88.6 220 38 1.02E-04 20 -6.63E-06 -5.50E-06 1.07E-05 2/22/97 Yes Yes 880 172 1054 C 12 H 1 145 88.65 73 83 4.91E-05 20 2.55E-07 4.45E-07 8.19E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 1 150 88.7 230 85 1.38E-05 20 -3.13E-07 8.92E-08 2.04E-06 2/22/97 Yes Yes 880 172 1054 C 12 H 2 0 88.7 57 37 4.16E-05 20 1.66E-06 2.70E-06 4.36E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 5 88.75 190 66 4.86E-05 20 -2.16E-06 -2.82E-07 7.65E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 10 88.8 250 21 1.24E-04 20 -4.61E-06 -1.16E-05 7.66E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 15 88.85 270 48 1.20E-04 20 3.00E-07 -8.72E-06 1.54E-05 2/22/97 Yes Yes 882 172 1054 C 12 H 2 20 88.9 360 35 2.66E-04 20 2.29E-05 -1.96E-06 2.65E-05 2/22/97 Yes Yes 882 172 1054 C 12 H 2 25 88.95 110 40 1.70E-04 20 -4.82E-06 1.32E-05 1.86E-05 2/22/97 Yes Yes 882 172 1054 C 12 H 2 30 89 200 30 3.32E-05 20 -2.99E-06 -1.02E-06 2.79E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 35 89.05 160 -5.6 6.29E-05 20 -6.47E-06 1.70E-06 -1.18E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 40 89.1 180 -27 1.58E-04 20 -1.48E-05 -4.59E-08 -1.29E-05 2/22/97 Yes Yes 882 172 1054 C 12 H 2 45 89.15 290 -35 6.20E-05 20 1.89E-06 -5.34E-06 -6.39E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 50 89.2 330 5.9 5.16E-05 20 4.61E-06 -3.17E-06 7.93E-07 2/22/97 Yes Yes 882 172 1054 C 12 H 2 55 89.25 320 41 6.02E-05 20 3.46E-06 -3.48E-06 6.79E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 60 89.3 77 48 5.73E-05 20 8.23E-07 3.92E-06 7.24E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 65 89.35 230 19 4.33E-04 20 -2.81E-05 -3.40E-05 2.44E-05 2/22/97 Yes Yes 882 172 1054 C 12 H 2 70 89.4 170 39 3.51E-04 20 -2.86E-05 4.99E-06 3.80E-05 2/22/97 Yes Yes 882 172 1054 C 12 H 2 75 89.45 66 73 2.02E-04 20 2.49E-06 6.02E-06 3.34E-05 2/22/97 Yes Yes 882 172 1054 C 12 H 2 80 89.5 110 42 2.32E-04 20 -6.20E-06 1.75E-05 2.69E-05 2/22/97 Yes Yes 882 172 1054 C 12 H 2 85 89.55 210 29 1.17E-04 20 -9.05E-06 -6.39E-06 9.56E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 90 89.6 210 37 8.14E-05 20 -5.88E-06 -3.86E-06 8.31E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 95 89.65 110 43 7.34E-05 20 -1.86E-06 5.42E-06 8.42E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 100 89.7 260 40 3.67E-05 20 -5.57E-07 -3.11E-06 3.89E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 105 89.75 190 22 4.98E-05 20 -4.94E-06 -7.67E-07 3.35E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 110 89.8 130 6.3 2.85E-05 20 -2.42E-06 2.23E-06 2.85E-07 2/22/97 Yes Yes 882 172 1054 C 12 H 2 115 89.85 350 67 2.04E-05 20 1.11E-06 -3.85E-07 2.97E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 120 89.9 280 60 3.30E-05 20 5.45E-07 -1.77E-06 5.11E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 125 89.95 120 69 2.39E-05 20 -5.80E-07 6.74E-07 3.95E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 130 90 310 66 2.38E-05 20 6.31E-07 -7.31E-07 3.76E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 135 90.05 280 34 6.52E-05 20 9.09E-07 -5.81E-06 6.39E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 140 90.1 66 51 4.75E-05 20 1.28E-06 2.93E-06 6.32E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 145 90.15 100 34 3.09E-05 20 -6.58E-07 2.60E-06 2.80E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 2 150 90.2 200 58 1.63E-05 20 -1.22E-06 -2.50E-08 2.10E-06 2/22/97 Yes Yes 882 172 1054 C 12 H 3 0 90.2 56 22 3.21E-04 20 1.76E-05 2.62E-05 2.13E-05 2/22/97 Yes Yes 884 172 1054 C 12 H 3 5 90.25 100 54 3.49E-04 20 -4.63E-06 2.20E-05 4.87E-05 2/22/97 Yes Yes 884 172 1054 C 12 H 3 10 90.3 170 52 1.86E-04 20 -1.20E-05 1.08E-06 2.54E-05 2/22/97 Yes Yes 884 172 1054 C 12 H 3 15 90.35 130 46 9.75E-05 20 -5.10E-06 5.28E-06 1.21E-05 2/22/97 Yes Yes 884 172 1054 C 12 H 3 20 90.4 210 4.3 1.66E-04 20 -1.47E-05 -9.65E-06 1.92E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 25 90.45 250 9.6 1.08E-04 20 -4.72E-06 -1.06E-05 2.87E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 30 90.5 140 0.2 1.61E-04 20 -1.39E-05 1.03E-05 2.81E-08 2/22/97 Yes Yes 884 172 1054 C 12 H 3 35 90.55 200 -14 6.46E-05 20 -6.09E-06 -2.91E-06 -2.77E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 40 90.6 59 -17 6.09E-05 20 3.31E-06 5.44E-06 -3.41E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 45 90.65 95 0.1 5.15E-05 20 -5.85E-07 5.29E-06 -1.82E-07 2/22/97 Yes Yes 884 172 1054 C 12 H 3 50 90.7 39 1 3.84E-05 20 3.24E-06 2.48E-06 -4.36E-08 2/22/97 Yes Yes 884 172 1054 C 12 H 3 55 90.75 330 13 9.01E-05 20 8.20E-06 -4.59E-06 3.51E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 60 90.8 250 -1.7 2.39E-05 20 -1.03E-06 -2.53E-06 -3.36E-07 2/22/97 Yes Yes 884 172 1054 C 12 H 3 65 90.85 320 -7.5 4.75E-05 20 4.06E-06 -3.18E-06 -1.26E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 70 90.9 240 -45 8.43E-05 20 -3.44E-06 -5.43E-06 -1.05E-05 2/22/97 Yes Yes 884 172 1054 C 12 H 3 75 90.95 61 -60 1.60E-04 20 4.09E-06 7.67E-06 -2.41E-05 2/22/97 Yes Yes 884 172 1054 C 12 H 3 80 91 34 -18 1.05E-04 20 8.55E-06 5.99E-06 -5.91E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 85 91.05 190 25 3.09E-05 20 -2.88E-06 -9.19E-07 1.90E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 90 91.1 180 22 2.90E-05 20 -2.87E-06 -5.34E-08 1.59E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 95 91.15 260 16 5.30E-05 20 -7.83E-07 -5.63E-06 2.19E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 100 91.2 310 15 2.27E-04 20 1.41E-05 -1.91E-05 1.02E-05 2/22/97 Yes Yes 884 172 1054 C 12 H 3 105 91.25 300 48 6.58E-05 20 2.46E-06 -4.06E-06 8.55E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 110 91.3 120 71 2.60E-05 20 -7.02E-07 7.55E-07 3.97E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 115 91.35 160 39 3.53E-05 20 -2.36E-06 7.94E-07 3.55E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 120 91.4 170 1.4 2.24E-05 20 -2.11E-06 3.80E-07 1.93E-07 2/22/97 Yes Yes 884 172 1054 C 12 H 3 125 91.45 140 -28 2.94E-05 20 -2.29E-06 1.49E-06 -2.41E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 130 91.5 29 4.9 6.42E-05 20 5.96E-06 3.39E-06 8.70E-07 2/22/97 Yes Yes 884 172 1054 C 12 H 3 135 91.55 330 77 7.84E-05 20 1.63E-06 -1.05E-06 1.32E-05 2/22/97 Yes Yes 884 172 1054 C 12 H 3 140 91.6 200 20 6.72E-05 20 -6.13E-06 -2.68E-06 3.82E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 3 145 91.65 130 12 3.51E-05 20 -2.30E-06 2.70E-06 9.54E-07 2/22/97 Yes Yes 884 172 1054 C 12 H 3 150 91.7 290 13 6.29E-05 20 2.25E-06 -5.93E-06 2.12E-06 2/22/97 Yes Yes 884 172 1054 C 12 H 4 0 91.7 61 16 5.29E-05 20 2.40E-06 4.51E-06 2.52E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 5 91.75 130 65 2.67E-05 20 -8.46E-07 1.01E-06 4.18E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 10 91.8 140 85 3.12E-05 20 -2.21E-07 2.19E-07 5.24E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 15 91.85 97 19 1.52E-05 20 -2.65E-07 1.55E-06 8.61E-07 2/22/97 Yes Yes 886 172 1054 C 12 H 4 20 91.9 360 23 2.22E-05 20 2.23E-06 -9.42E-08 1.30E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 25 91.95 88 26 2.06E-05 20 5.50E-08 1.98E-06 1.34E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 30 92 310 60 1.48E-05 20 3.98E-07 -5.26E-07 2.18E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 35 92.05 190 74 2.06E-05 20 -6.33E-07 -9.84E-08 3.36E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 40 92.1 180 46 2.70E-05 20 -1.84E-06 2.06E-07 3.13E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 45 92.15 180 54 2.83E-05 20 -1.84E-06 -2.14E-07 3.82E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 50 92.2 240 63 1.85E-05 20 -3.54E-07 -8.94E-07 2.75E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 55 92.25 230 31 2.91E-05 20 -1.77E-06 -1.98E-06 2.65E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 60 92.3 140 -17 3.51E-05 20 -2.80E-06 2.28E-06 -1.89E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 65 92.35 300 70 1.59E-05 20 2.93E-07 -6.37E-07 2.45E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 70 92.4 220 52 4.04E-05 20 -1.90E-06 -1.79E-06 5.44E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 75 92.45 180 64 3.15E-05 20 -1.50E-06 1.51E-07 4.87E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 80 92.5 110 16 5.67E-05 20 -1.93E-06 5.57E-06 2.63E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 85 92.55 2.5 54 4.09E-05 20 2.53E-06 1.08E-08 5.46E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 90 92.6 210 65 6.23E-05 20 -2.53E-06 -1.25E-06 9.62E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 95 92.65 95 62 5.63E-05 20 -3.69E-07 2.79E-06 8.35E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 100 92.7 230 29 5.56E-05 20 -3.16E-06 -4.08E-06 4.60E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 105 92.75 210 -51 1.21E-04 20 -7.41E-06 -3.61E-06 -1.61E-05 2/22/97 Yes Yes 886 172 1054 C 12 H 4 110 92.8 350 -33 1.70E-04 20 1.47E-05 -2.21E-06 -1.62E-05 2/22/97 Yes Yes 886 172 1054 C 12 H 4 115 92.85 310 19 5.43E-05 20 3.56E-06 -4.65E-06 2.78E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 120 92.9 140 28 6.24E-05 20 -4.11E-06 4.05E-06 5.30E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 125 92.95 170 -47 3.85E-05 20 -2.79E-06 6.61E-07 -4.78E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 130 93 300 0.2 4.12E-04 20 1.88E-05 -4.03E-05 2.76E-07 2/22/97 Yes Yes 886 172 1054 C 12 H 4 135 93.05 290 52 6.06E-05 20 1.42E-06 -3.76E-06 8.31E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 140 93.1 330 72 5.81E-05 20 1.65E-06 -1.08E-06 9.55E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 145 93.15 39 54 4.68E-05 20 2.30E-06 1.88E-06 6.38E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 4 150 93.2 310 44 2.23E-05 20 9.06E-07 -9.22E-07 2.46E-06 2/22/97 Yes Yes 886 172 1054 C 12 H 5 0 93.2 170 18 2.59E-05 20 -2.85E-06 -4.67E-08 1.41E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 5 93.25 42 80 3.60E-05 20 3.94E-07 5.27E-07 6.13E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 10 93.3 27 40 6.85E-05 20 4.89E-06 2.60E-06 7.54E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 15 93.35 37 36 9.19E-05 20 6.19E-06 4.80E-06 9.42E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 20 93.4 85 78 8.49E-05 20 1.85E-07 1.83E-06 1.42E-05 2/22/97 Yes Yes 888 172 1054 C 12 H 5 25 93.45 330 30 2.74E-04 20 2.23E-05 -1.19E-05 2.35E-05 2/22/97 Yes Yes 888 172 1054 C 12 H 5 30 93.5 95 62 2.29E-04 20 -1.23E-06 1.17E-05 3.49E-05 2/22/97 Yes Yes 888 172 1054 C 12 H 5 35 93.55 120 61 6.63E-05 20 -1.76E-06 2.97E-06 1.00E-05 2/22/97 Yes Yes 888 172 1054 C 12 H 5 40 93.6 320 31 1.22E-04 20 8.06E-06 -7.88E-06 1.07E-05 2/22/97 Yes Yes 888 172 1054 C 12 H 5 45 93.65 77 54 1.09E-04 20 1.37E-06 6.49E-06 1.52E-05 2/22/97 Yes Yes 888 172 1054 C 12 H 5 50 93.7 150 60 2.19E-05 20 -9.48E-07 5.27E-07 3.21E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 55 93.75 350 7.9 3.78E-05 20 3.85E-06 -8.45E-07 9.46E-07 2/22/97 Yes Yes 888 172 1054 C 12 H 5 60 93.8 60 60 2.24E-05 20 4.75E-07 9.48E-07 3.24E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 65 93.85 250 45 3.01E-05 20 -7.64E-07 -2.37E-06 3.56E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 70 93.9 35 72 2.30E-05 20 6.72E-07 3.94E-07 3.75E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 75 93.95 350 53 2.14E-05 20 1.29E-06 -1.01E-07 2.96E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 80 94 290 27 1.55E-05 20 3.42E-07 -1.46E-06 1.16E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 85 94.05 320 -1.2 3.15E-05 20 2.60E-06 -2.17E-06 -3.56E-07 2/22/97 Yes Yes 888 172 1054 C 12 H 5 90 94.1 330 0.9 2.79E-05 20 2.32E-06 -1.81E-06 -8.99E-08 2/22/97 Yes Yes 888 172 1054 C 12 H 5 95 94.15 300 32 3.17E-05 20 1.41E-06 -2.49E-06 2.67E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 100 94.2 350 53 3.94E-05 20 2.60E-06 -6.08E-07 5.33E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 105 94.25 280 79 2.26E-05 20 -1.01E-07 -4.55E-07 4.02E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 110 94.3 18 16 2.35E-05 20 1.90E-06 8.04E-07 9.55E-07 2/22/97 Yes Yes 888 172 1054 C 12 H 5 115 94.35 3.3 47 3.35E-05 20 2.62E-06 -7.67E-08 4.06E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 120 94.4 350 49 4.65E-05 20 3.30E-06 -3.53E-07 6.36E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 125 94.45 23 49 5.94E-05 20 3.62E-06 1.58E-06 7.91E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 130 94.5 140 70 4.51E-05 20 -1.44E-06 1.08E-06 7.40E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 135 94.55 210 1.2 1.21E-04 20 -1.12E-05 -6.65E-06 5.49E-07 2/22/97 Yes Yes 888 172 1054 C 12 H 5 140 94.6 350 2.6 2.02E-04 20 2.09E-05 -4.60E-06 1.63E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 5 145 94.65 340 13 3.09E-04 20 3.00E-05 -1.09E-05 1.23E-05 2/22/97 Yes Yes 888 172 1054 C 12 H 5 150 94.7 260 27 3.67E-05 20 -9.05E-07 -3.22E-06 2.74E-06 2/22/97 Yes Yes 888 172 1054 C 12 H 6 0 94.7 51 -1.7 2.35E-05 20 1.34E-06 1.69E-06 -1.57E-07 2/22/97 Yes Yes 890 172 1054 C 12 H 6 5 94.75 110 77 3.76E-05 20 -2.84E-07 9.56E-07 6.29E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 10 94.8 260 53 3.00E-05 20 -1.98E-07 -1.95E-06 3.96E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 15 94.85 29 54 3.09E-05 20 1.63E-06 9.57E-07 4.27E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 20 94.9 40 64 4.40E-05 20 1.66E-06 1.26E-06 6.62E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 25 94.95 340 73 2.81E-05 20 8.86E-07 -3.46E-07 4.39E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 30 95 340 39 4.50E-05 20 3.45E-06 -1.06E-06 4.87E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 35 95.05 240 48 2.63E-05 20 -9.80E-07 -1.66E-06 3.28E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 40 95.1 150 -0.2 9.29E-06 20 -6.44E-07 6.07E-07 -3.18E-07 2/22/97 Yes Yes 890 172 1054 C 12 H 6 45 95.15 6 -28 2.89E-05 20 2.65E-06 4.84E-08 -2.59E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 50 95.2 340 1.3 5.35E-05 20 5.57E-06 -1.72E-06 5.14E-08 2/22/97 Yes Yes 890 172 1054 C 12 H 6 55 95.25 300 11 3.23E-05 20 1.75E-06 -3.00E-06 1.04E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 60 95.3 11 54 2.34E-05 20 1.40E-06 1.63E-07 3.09E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 65 95.35 310 28 4.76E-05 20 2.88E-06 -3.71E-06 3.64E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 70 95.4 330 19 4.81E-05 20 4.52E-06 -2.18E-06 2.60E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 75 95.45 7.6 41 2.75E-05 20 2.26E-06 3.88E-07 3.00E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 80 95.5 110 75 2.26E-05 20 -3.59E-07 4.65E-07 3.61E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 85 95.55 250 80 2.20E-05 20 -8.46E-08 -5.35E-07 3.40E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 90 95.6 280 52 1.45E-05 20 1.64E-07 -1.05E-06 1.71E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 95 95.65 93 54 9.79E-06 20 -6.98E-08 5.29E-07 1.00E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 100 95.7 310 74 1.58E-05 20 5.71E-07 -4.57E-07 2.43E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 105 95.75 310 62 1.89E-05 20 5.86E-07 -7.78E-07 2.93E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 110 95.8 74 68 1.68E-05 20 -7.39E-09 6.78E-07 2.38E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 115 95.85 280 35 2.39E-05 20 6.99E-07 -2.32E-06 2.06E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 120 95.9 290 31 3.18E-05 20 1.23E-06 -2.83E-06 2.91E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 125 95.95 320 54 3.03E-05 20 1.35E-06 -1.46E-06 4.26E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 130 96 310 72 3.73E-05 20 9.21E-07 -9.07E-07 6.06E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 135 96.05 290 77 4.85E-05 20 4.66E-07 -1.19E-06 8.13E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 140 96.1 230 61 2.84E-05 20 -8.51E-07 -1.09E-06 4.19E-06 2/22/97 Yes Yes 890 172 1054 C 12 H 6 145 96.15 360 2.9 1.63E-05 20 1.87E-06 -1.48E-07 -1.33E-07 2/22/97 Yes Yes 890 172 1054 C 13 H 1 0 96.7 84 2.5 1.35E-04 20 1.26E-06 1.42E-05 1.03E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 5 96.75 250 9.1 3.95E-04 20 -1.54E-05 -3.92E-05 1.08E-05 2/22/97 Yes Yes 892 172 1054 C 13 H 1 10 96.8 210 27 2.36E-04 20 -1.87E-05 -1.24E-05 1.85E-05 2/22/97 Yes Yes 892 172 1054 C 13 H 1 15 96.85 160 -0.4 2.72E-04 20 -2.72E-05 9.90E-06 -2.69E-07 2/22/97 Yes Yes 892 172 1054 C 13 H 1 20 96.9 140 12 1.35E-04 20 -1.08E-05 9.04E-06 4.60E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 25 96.95 350 26 2.80E-05 20 2.59E-06 -4.78E-07 1.95E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 30 97 320 35 5.20E-05 20 3.31E-06 -2.88E-06 5.19E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 35 97.05 300 65 2.61E-05 20 4.29E-07 -1.11E-06 4.05E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 40 97.1 340 36 7.79E-05 20 6.55E-06 -1.84E-06 7.62E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 45 97.15 65 46 8.86E-05 20 2.68E-06 5.79E-06 1.09E-05 2/22/97 Yes Yes 892 172 1054 C 13 H 1 50 97.2 190 30 5.07E-05 20 -4.62E-06 -6.31E-07 4.33E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 55 97.25 220 1 1.16E-04 20 -8.75E-06 -8.87E-06 4.29E-07 2/22/97 Yes Yes 892 172 1054 C 13 H 1 60 97.3 270 20 7.00E-05 20 -6.63E-07 -7.21E-06 4.05E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 65 97.35 310 81 3.44E-05 20 2.59E-07 -5.95E-07 5.81E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 70 97.4 180 29 4.68E-05 20 -4.29E-06 -4.06E-07 3.89E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 75 97.45 260 67 4.29E-05 20 -3.55E-07 -1.69E-06 6.89E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 80 97.5 300 68 4.16E-05 20 5.10E-07 -1.62E-06 6.63E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 85 97.55 260 25 3.29E-05 20 -7.30E-07 -3.30E-06 2.20E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 90 97.6 110 52 2.27E-05 20 -6.82E-07 1.31E-06 2.98E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 95 97.65 100 16 3.02E-05 20 -9.22E-07 2.98E-06 1.21E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 100 97.7 59 -8.8 5.36E-05 20 2.99E-06 4.81E-06 -1.48E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 105 97.75 290 0.9 4.19E-05 20 1.54E-06 -4.20E-06 3.11E-07 2/22/97 Yes Yes 892 172 1054 C 13 H 1 110 97.8 260 -13 1.18E-04 20 -3.48E-06 -1.21E-05 -4.75E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 115 97.85 67 -17 7.48E-05 20 3.14E-06 6.93E-06 -3.98E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 120 97.9 160 61 9.48E-05 20 -4.33E-06 2.05E-06 1.47E-05 2/22/97 Yes Yes 892 172 1054 C 13 H 1 125 97.95 130 23 8.69E-05 20 -5.58E-06 6.57E-06 6.20E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 130 98 150 56 2.93E-05 20 -1.57E-06 1.05E-06 4.32E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 135 98.05 260 16 3.41E-05 20 -5.48E-07 -3.56E-06 1.82E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 1 140 98.1 190 77 2.20E-06 20 -1.24E-07 -2.50E-08 4.55E-07 2/22/97 Yes Yes 892 172 1054 C 13 H 1 145 98.15 73 14 1.38E-05 20 3.05E-07 1.32E-06 5.20E-07 2/22/97 Yes Yes 892 172 1054 C 13 H 1 150 98.2 190 64 1.17E-05 20 -9.56E-07 2.20E-07 1.68E-06 2/22/97 Yes Yes 892 172 1054 C 13 H 2 0 98.2 350 17 2.06E-04 20 2.03E-05 -3.83E-06 1.07E-05 2/22/97 Yes Yes 894 172 1054 C 13 H 2 5 98.25 53 32 2.66E-04 20 1.45E-05 1.96E-05 2.42E-05 2/22/97 Yes Yes 894 172 1054 C 13 H 2 10 98.3 150 34 6.51E-05 20 -4.89E-06 3.18E-06 6.14E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 15 98.35 260 34 3.20E-05 20 -8.17E-07 -2.77E-06 3.11E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 20 98.4 85 65 2.60E-05 20 1.50E-07 1.15E-06 3.91E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 25 98.45 320 77 3.42E-05 20 6.68E-07 -5.31E-07 5.58E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 30 98.5 260 57 2.30E-05 20 -4.20E-07 -1.23E-06 3.32E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 35 98.55 53 32 3.57E-05 20 1.88E-06 2.59E-06 3.27E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 40 98.6 69 45 5.19E-05 20 1.49E-06 3.77E-06 6.18E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 45 98.65 200 70 2.78E-05 20 -1.03E-06 -5.70E-07 4.43E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 50 98.7 170 85 1.81E-05 20 -1.28E-07 -5.25E-08 3.05E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 55 98.75 74 59 2.11E-05 20 2.99E-07 1.17E-06 3.22E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 60 98.8 260 67 2.35E-05 20 -2.71E-07 -1.03E-06 3.63E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 65 98.85 270 78 2.08E-05 20 -6.16E-08 -5.88E-07 3.44E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 70 98.9 97 72 1.98E-05 20 4.93E-09 6.48E-07 3.26E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 75 98.95 110 84 2.53E-05 20 -1.54E-07 4.17E-07 4.39E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 80 99 280 37 6.81E-05 20 9.63E-07 -5.79E-06 7.08E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 85 99.05 260 53 5.69E-05 20 -4.64E-07 -3.79E-06 7.64E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 90 99.1 140 77 4.71E-05 20 -9.18E-07 7.38E-07 7.82E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 95 99.15 260 68 4.43E-05 20 -5.00E-07 -1.75E-06 6.93E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 100 99.2 91 64 3.60E-05 20 1.09E-07 1.69E-06 5.54E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 105 99.25 95 15 8.42E-05 20 -8.63E-07 8.86E-06 3.99E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 110 99.3 300 58 6.77E-05 20 1.64E-06 -3.28E-06 9.75E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 115 99.35 270 40 3.77E-05 20 5.05E-07 -3.27E-06 4.03E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 120 99.4 64 63 3.60E-05 20 8.96E-07 1.65E-06 5.86E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 125 99.45 20 62 2.61E-05 20 1.08E-06 4.58E-07 4.19E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 130 99.5 310 41 2.45E-05 20 1.19E-06 -1.38E-06 2.93E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 135 99.55 200 41 5.83E-05 20 -4.47E-06 -1.59E-06 6.80E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 140 99.6 150 65 4.25E-05 20 -1.71E-06 8.95E-07 6.78E-06 2/22/97 Yes Yes 894 172 1054 C 13 H 2 145 99.65 42 27 1.90E-04 20 1.33E-05 1.23E-05 1.51E-05 2/22/97 Yes Yes 894 172 1054 C 13 H 2 150 99.7 330 25 2.05E-04 20 1.70E-05 -9.12E-06 1.49E-05 2/22/97 Yes Yes 894 172 1054 C 13 H 3 0 99.7 230 -27 6.47E-05 20 -3.73E-06 -5.43E-06 -5.10E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 5 99.75 190 -38 9.67E-05 20 -7.88E-06 -1.88E-06 -1.04E-05 2/22/97 Yes Yes 896 172 1054 C 13 H 3 10 99.8 73 -27 3.06E-04 20 8.70E-06 2.83E-05 -2.41E-05 2/22/97 Yes Yes 896 172 1054 C 13 H 3 15 99.85 7.6 -7 1.21E-04 20 1.26E-05 1.72E-06 -2.57E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 20 99.9 250 26 4.96E-05 20 -1.70E-06 -4.53E-06 3.59E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 25 99.95 130 77 2.11E-05 20 -2.73E-07 3.54E-07 3.34E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 30 100 340 62 1.94E-05 20 8.71E-07 -2.01E-07 2.89E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 35 100.05 330 31 6.23E-05 20 4.79E-06 -3.11E-06 5.49E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 40 100.1 120 62 4.14E-05 20 -8.71E-07 1.88E-06 6.03E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 45 100.15 180 32 4.24E-05 20 -3.84E-06 -4.46E-07 3.74E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 50 100.2 190 -21 2.56E-05 20 -2.35E-06 -7.08E-07 -1.74E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 55 100.25 300 6.9 1.38E-05 20 6.74E-07 -1.35E-06 2.86E-07 2/22/97 Yes Yes 896 172 1054 C 13 H 3 60 100.3 2.3 60 2.19E-05 20 1.14E-06 -5.67E-08 3.11E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 65 100.35 140 41 2.37E-05 20 -1.43E-06 1.06E-06 2.53E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 70 100.4 260 60 1.76E-05 20 -3.53E-08 -9.87E-07 2.55E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 75 100.45 96 72 4.39E-05 20 -8.05E-08 1.55E-06 7.19E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 80 100.5 110 46 3.33E-05 20 -1.13E-06 2.20E-06 4.01E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 85 100.55 280 38 4.41E-05 20 5.49E-07 -3.87E-06 4.40E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 90 100.6 180 4.8 3.39E-04 20 -3.57E-05 -8.92E-07 4.72E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 95 100.65 190 -20 3.09E-04 20 -2.99E-05 -7.83E-06 -1.87E-05 2/22/97 Yes Yes 896 172 1054 C 13 H 3 100 100.7 270 -14 5.52E-05 20 1.57E-07 -5.93E-06 -2.47E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 105 100.75 14 1.9 3.90E-05 20 4.03E-06 1.00E-06 3.05E-07 2/22/97 Yes Yes 896 172 1054 C 13 H 3 110 100.8 360 5.8 1.01E-05 20 8.60E-07 -4.59E-08 -8.81E-08 2/22/97 Yes Yes 896 172 1054 C 13 H 3 115 100.85 140 34 1.95E-05 20 -8.40E-07 9.81E-07 1.63E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 120 100.9 160 43 3.35E-05 20 -2.09E-06 1.01E-06 4.14E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 125 100.95 210 66 2.31E-05 20 -8.44E-07 -6.17E-07 3.72E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 130 101 310 55 4.73E-05 20 1.90E-06 -2.20E-06 6.71E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 135 101.05 330 14 6.68E-05 20 5.97E-06 -3.62E-06 2.76E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 140 101.1 59 22 6.10E-05 20 3.25E-06 5.21E-06 3.92E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 145 101.15 280 14 1.47E-04 20 2.03E-06 -1.54E-05 5.97E-06 2/22/97 Yes Yes 896 172 1054 C 13 H 3 150 101.2 280 40 1.52E-04 20 2.73E-06 -1.20E-05 1.66E-05 2/22/97 Yes Yes 896