Table 8A. Continuous split-core remanent measurements for Hole 1060C before demagnetization (NRM results). Leg Site Hole Core Type Section Interval Depth Declination Inclination Intensity (A/m) Demagnetization level Mx (A*m^2) My (A*m^2) Mz (A*m^2) Date Drift corrected Tray corrected Run # 172 1060 C 1 H 1 0 0 327.57 80.99 1.29E-03 0 3.63E-08 -2.36E-08 4.43E-07 03/08/97 Yes Yes 769 172 1060 C 1 H 1 5 0.05 65.96 88.71 5.27E-03 0 1.03E-08 2.36E-08 1.83E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 10 0.1 211.61 78.69 9.82E-03 0 -3.48E-07 -2.19E-07 3.34E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 15 0.15 169.3 70.08 1.24E-02 0 -8.80E-07 1.70E-07 4.04E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 20 0.2 157.17 72.52 1.21E-02 0 -7.09E-07 3.05E-07 3.99E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 25 0.25 161.9 73.15 1.27E-02 0 -7.43E-07 2.48E-07 4.22E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 30 0.3 150.73 75.94 1.34E-02 0 -6.04E-07 3.46E-07 4.52E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 35 0.35 158.72 77.38 1.44E-02 0 -6.23E-07 2.48E-07 4.88E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 40 0.4 156.03 77.73 1.43E-02 0 -5.89E-07 2.68E-07 4.84E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 45 0.45 176.61 80.21 1.46E-02 0 -5.27E-07 3.19E-08 5.00E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 50 0.5 151.5 82.5 1.70E-02 0 -4.13E-07 2.29E-07 5.83E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 55 0.55 174.68 85.47 2.27E-02 0 -3.80E-07 3.61E-08 7.86E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 60 0.6 180.43 84.02 2.96E-02 0 -6.55E-07 -5.06E-09 1.02E-05 03/08/97 Yes Yes 769 172 1060 C 1 H 1 65 0.65 172.82 79.93 3.37E-02 0 -1.24E-06 1.60E-07 1.15E-05 03/08/97 Yes Yes 769 172 1060 C 1 H 1 70 0.7 162.13 77.15 3.33E-02 0 -1.49E-06 4.92E-07 1.12E-05 03/08/97 Yes Yes 769 172 1060 C 1 H 1 75 0.75 131.77 83.01 2.99E-02 0 -5.15E-07 5.89E-07 1.03E-05 03/08/97 Yes Yes 769 172 1060 C 1 H 1 80 0.8 147.15 80.6 2.78E-02 0 -8.09E-07 5.34E-07 9.51E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 85 0.85 155.48 76.68 2.42E-02 0 -1.08E-06 5.02E-07 8.16E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 90 0.9 160.35 75.65 2.42E-02 0 -1.20E-06 4.38E-07 8.13E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 95 0.95 159.61 74.37 2.62E-02 0 -1.40E-06 5.33E-07 8.74E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 100 1 155.57 75.36 2.75E-02 0 -1.34E-06 6.23E-07 9.22E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 105 1.05 149.08 76.52 2.70E-02 0 -1.14E-06 7.00E-07 9.09E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 110 1.1 148.26 79.2 2.54E-02 0 -8.60E-07 5.44E-07 8.67E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 115 1.15 147.4 79.69 2.38E-02 0 -7.62E-07 4.99E-07 8.13E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 120 1.2 150.36 79.92 2.26E-02 0 -7.30E-07 4.25E-07 7.71E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 125 1.25 142.99 78.47 2.23E-02 0 -7.56E-07 5.83E-07 7.58E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 130 1.3 155.06 76.33 2.18E-02 0 -9.90E-07 4.71E-07 7.34E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 135 1.35 168.87 78.02 2.00E-02 0 -8.62E-07 1.73E-07 6.77E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 140 1.4 170.2 75.27 1.93E-02 0 -1.03E-06 1.81E-07 6.47E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 145 1.45 170.02 65.36 1.74E-02 0 -1.51E-06 2.72E-07 5.48E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 1 150 1.5 176.49 53.34 9.28E-03 0 -1.17E-06 7.36E-08 2.58E-06 03/08/97 Yes Yes 769 172 1060 C 1 H 2 0 1.5 355.72 86.68 6.05E-03 0 7.42E-08 -5.68E-09 2.09E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 5 1.55 186.26 71.13 1.45E-02 0 -9.88E-07 -1.11E-07 4.75E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 10 1.6 182.44 68.61 1.73E-02 0 -1.34E-06 -5.84E-08 5.58E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 15 1.65 176.11 71.37 1.77E-02 0 -1.20E-06 8.32E-08 5.82E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 20 1.7 162.44 75.45 1.89E-02 0 -9.62E-07 3.11E-07 6.35E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 25 1.75 157.93 67.95 2.04E-02 0 -1.50E-06 6.23E-07 6.54E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 30 1.8 148.48 62.6 1.99E-02 0 -1.65E-06 1.04E-06 6.12E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 35 1.85 140.69 61.43 1.92E-02 0 -1.51E-06 1.26E-06 5.84E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 40 1.9 137.75 59.17 1.98E-02 0 -1.59E-06 1.48E-06 5.89E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 45 1.95 141.21 57.61 2.00E-02 0 -1.78E-06 1.46E-06 5.87E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 50 2 148.38 61.73 1.88E-02 0 -1.61E-06 1.01E-06 5.75E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 55 2.05 147 66.6 1.82E-02 0 -1.28E-06 8.53E-07 5.78E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 60 2.1 145.31 67.07 1.80E-02 0 -1.22E-06 8.65E-07 5.74E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 65 2.15 147.82 67 1.76E-02 0 -1.24E-06 7.95E-07 5.62E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 70 2.2 147.53 66.03 1.74E-02 0 -1.27E-06 8.25E-07 5.53E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 75 2.25 145.84 63.77 1.72E-02 0 -1.34E-06 9.27E-07 5.35E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 80 2.3 141.39 64.38 1.66E-02 0 -1.19E-06 9.74E-07 5.20E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 85 2.35 136.79 63.67 1.69E-02 0 -1.16E-06 1.12E-06 5.26E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 90 2.4 134.71 63.82 1.70E-02 0 -1.12E-06 1.16E-06 5.30E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 95 2.45 137.21 64.69 1.69E-02 0 -1.13E-06 1.07E-06 5.30E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 100 2.5 126.72 60.84 1.75E-02 0 -1.08E-06 1.48E-06 5.28E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 105 2.55 90.6 68.75 1.94E-02 0 -1.55E-08 1.52E-06 6.26E-06 03/08/97 Yes Yes 771 172 1060 C 1 H 2 110 2.6 70.15 79.28 3.13E-02 0 4.19E-07 1.19E-06 1.07E-05 03/08/97 Yes Yes 771 172 1060 C 1 H 2 115 2.65 161.55 65.67 3.41E-02 0 -2.83E-06 9.65E-07 1.08E-05 03/08/97 Yes Yes 771 172 1060 C 1 H 2 120 2.7 152.5 64.94 2.29E-02 0 -1.83E-06 9.72E-07 7.19E-06 03/08/97 Yes Yes 771 172 1060 C 2 H 1 0 3 270.93 68.14 4.74E-03 0 6.04E-09 -3.83E-07 1.52E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 5 3.05 349.51 65.01 1.17E-02 0 1.03E-06 -1.95E-07 3.66E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 10 3.1 22.46 49.99 1.92E-02 0 2.42E-06 1.02E-06 5.09E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 15 3.15 24.34 51.77 2.19E-02 0 2.62E-06 1.21E-06 5.96E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 20 3.2 18.91 56.58 2.29E-02 0 2.53E-06 8.88E-07 6.63E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 25 3.25 12.95 60.85 2.41E-02 0 2.42E-06 5.70E-07 7.29E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 30 3.3 10.51 64.74 2.49E-02 0 2.21E-06 4.20E-07 7.79E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 35 3.35 9.26 64.62 2.50E-02 0 2.24E-06 3.74E-07 7.83E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 40 3.4 9.69 64.71 2.49E-02 0 2.23E-06 3.89E-07 7.82E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 45 3.45 6.61 66.31 2.44E-02 0 2.07E-06 2.45E-07 7.75E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 50 3.5 6.06 66.41 2.39E-02 0 2.01E-06 2.19E-07 7.58E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 55 3.55 359.9 60.26 2.39E-02 0 2.52E-06 -4.68E-09 7.21E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 60 3.6 357.04 56.2 2.46E-02 0 2.90E-06 -1.53E-07 7.08E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 65 3.65 0.82 56.28 2.44E-02 0 2.87E-06 4.18E-08 7.04E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 70 3.7 1.68 56.64 2.37E-02 0 2.76E-06 8.29E-08 6.86E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 75 3.75 358.1 58.49 2.22E-02 0 2.46E-06 -8.32E-08 6.55E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 80 3.8 357.73 55.15 2.18E-02 0 2.64E-06 -1.07E-07 6.20E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 85 3.85 357.23 52.15 2.26E-02 0 2.94E-06 -1.45E-07 6.18E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 90 3.9 356.07 50.29 2.37E-02 0 3.21E-06 -2.25E-07 6.33E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 95 3.95 357.69 48.85 2.42E-02 0 3.38E-06 -1.39E-07 6.33E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 100 4 357.55 50.47 2.42E-02 0 3.26E-06 -1.43E-07 6.47E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 105 4.05 357.26 51.42 2.46E-02 0 3.25E-06 -1.59E-07 6.67E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 110 4.1 356.04 49.75 2.57E-02 0 3.52E-06 -2.49E-07 6.81E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 115 4.15 353.84 51.09 2.41E-02 0 3.19E-06 -3.51E-07 6.49E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 120 4.2 350.4 51.33 2.22E-02 0 2.90E-06 -5.01E-07 6.01E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 125 4.25 352.02 53.24 1.96E-02 0 2.46E-06 -3.52E-07 5.44E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 130 4.3 353.65 52.67 1.81E-02 0 2.31E-06 -2.63E-07 4.99E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 135 4.35 354.43 52.01 1.73E-02 0 2.25E-06 -2.25E-07 4.74E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 140 4.4 359 51.1 1.60E-02 0 2.13E-06 -3.81E-08 4.32E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 145 4.45 6.86 48.22 1.39E-02 0 1.95E-06 2.40E-07 3.59E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 150 4.5 27.26 62.76 6.79E-03 0 5.86E-07 3.09E-07 2.09E-06 03/08/97 Yes Yes 773 172 1060 C 2 H 1 0 3 16.87 41.67 6.05E-03 0 9.17E-07 2.84E-07 1.39E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 5 3.05 17.42 45.29 1.45E-02 0 2.07E-06 6.64E-07 3.58E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 10 3.1 7.47 52.17 1.71E-02 0 2.21E-06 2.96E-07 4.68E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 15 3.15 8.64 55.94 1.77E-02 0 2.08E-06 3.23E-07 5.09E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 20 3.2 5.02 59.75 1.76E-02 0 1.87E-06 1.68E-07 5.27E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 25 3.25 347.78 63.62 1.85E-02 0 1.70E-06 -3.78E-07 5.75E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 30 3.3 343.24 62.71 1.93E-02 0 1.80E-06 -5.53E-07 5.94E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 35 3.35 354.92 61.46 1.92E-02 0 1.94E-06 -1.76E-07 5.85E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 40 3.4 355.24 60.75 1.78E-02 0 1.84E-06 -1.56E-07 5.38E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 45 3.45 350.17 58.13 1.69E-02 0 1.86E-06 -3.30E-07 4.96E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 50 3.5 333.09 47.19 1.74E-02 0 2.24E-06 -1.16E-06 4.43E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 55 3.55 336.92 45.38 1.85E-02 0 2.53E-06 -1.10E-06 4.56E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 60 3.6 336.95 48.98 1.90E-02 0 2.44E-06 -1.06E-06 4.98E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 65 3.65 337.53 49.41 1.93E-02 0 2.46E-06 -1.04E-06 5.08E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 70 3.7 340.02 49.46 1.85E-02 0 2.40E-06 -8.93E-07 4.88E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 75 3.75 338.53 49.75 1.69E-02 0 2.16E-06 -8.67E-07 4.47E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 80 3.8 342.02 48.8 1.66E-02 0 2.21E-06 -7.32E-07 4.33E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 85 3.85 347.88 48.69 1.72E-02 0 2.35E-06 -5.17E-07 4.48E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 90 3.9 345.7 52.47 1.63E-02 0 2.04E-06 -5.33E-07 4.49E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 95 3.95 342.09 51.76 1.62E-02 0 2.02E-06 -6.68E-07 4.41E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 100 4 345.62 54.86 1.49E-02 0 1.76E-06 -4.62E-07 4.22E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 105 4.05 342.88 54.37 1.35E-02 0 1.60E-06 -5.04E-07 3.82E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 110 4.1 342.57 47.08 1.42E-02 0 1.96E-06 -6.28E-07 3.60E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 115 4.15 341.14 41.84 1.57E-02 0 2.35E-06 -8.20E-07 3.63E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 120 4.2 346.8 41.01 1.60E-02 0 2.49E-06 -5.98E-07 3.64E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 125 4.25 352.06 42.32 1.54E-02 0 2.39E-06 -3.40E-07 3.59E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 130 4.3 359.47 49.06 1.39E-02 0 1.93E-06 -1.83E-08 3.64E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 135 4.35 358.99 50.1 1.38E-02 0 1.87E-06 -3.38E-08 3.66E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 140 4.4 354.79 46.19 1.59E-02 0 2.32E-06 -2.16E-07 3.97E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 1 145 4.45 347.33 48.58 1.57E-02 0 2.15E-06 -4.94E-07 4.08E-06 03/08/97 Yes Yes 775 172 1060 C 2 H 3 0 6 335.76 44.46 5.42E-03 0 7.48E-07 -3.44E-07 1.32E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 5 6.05 325.35 40.18 1.43E-02 0 1.91E-06 -1.35E-06 3.21E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 10 6.1 321.92 43.92 1.71E-02 0 2.06E-06 -1.65E-06 4.11E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 15 6.15 318.9 48.8 1.76E-02 0 1.85E-06 -1.65E-06 4.59E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 20 6.2 315.67 50.19 1.66E-02 0 1.61E-06 -1.61E-06 4.42E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 25 6.25 314.28 51.39 1.64E-02 0 1.51E-06 -1.58E-06 4.43E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 30 6.3 312.22 50.81 1.68E-02 0 1.51E-06 -1.70E-06 4.50E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 35 6.35 310.34 50.46 1.70E-02 0 1.49E-06 -1.79E-06 4.55E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 40 6.4 312.24 50.67 1.74E-02 0 1.57E-06 -1.77E-06 4.67E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 45 6.45 310.8 47.5 1.96E-02 0 1.84E-06 -2.17E-06 5.01E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 50 6.5 312.06 47.36 2.02E-02 0 1.95E-06 -2.21E-06 5.16E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 55 6.55 316.05 49.39 2.05E-02 0 2.03E-06 -2.01E-06 5.39E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 60 6.6 318.64 48.11 2.20E-02 0 2.34E-06 -2.11E-06 5.69E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 65 6.65 317.62 47.48 2.35E-02 0 2.49E-06 -2.33E-06 6.02E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 70 6.7 316.68 52.2 2.11E-02 0 1.99E-06 -1.92E-06 5.77E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 75 6.75 322.81 54.41 1.85E-02 0 1.82E-06 -1.41E-06 5.21E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 80 6.8 323.93 53.93 1.64E-02 0 1.65E-06 -1.23E-06 4.59E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 85 6.85 331.17 50.41 1.49E-02 0 1.77E-06 -9.95E-07 3.99E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 90 6.9 334.58 48.21 1.47E-02 0 1.87E-06 -9.11E-07 3.79E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 95 6.95 330.52 46.54 1.41E-02 0 1.80E-06 -1.04E-06 3.56E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 100 7 327.07 46.73 1.36E-02 0 1.65E-06 -1.10E-06 3.42E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 105 7.05 324.81 46.18 1.35E-02 0 1.62E-06 -1.17E-06 3.37E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 110 7.1 324.87 50.11 1.29E-02 0 1.43E-06 -1.03E-06 3.42E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 115 7.15 322.57 55.99 1.23E-02 0 1.16E-06 -9.04E-07 3.53E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 120 7.2 321.54 56.01 1.21E-02 0 1.12E-06 -9.13E-07 3.48E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 125 7.25 325.95 55.05 1.33E-02 0 1.34E-06 -9.26E-07 3.78E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 130 7.3 332.31 52.37 1.54E-02 0 1.76E-06 -9.46E-07 4.22E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 135 7.35 334.66 56.74 1.75E-02 0 1.84E-06 -8.92E-07 5.08E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 140 7.4 328.64 60.65 1.77E-02 0 1.58E-06 -9.82E-07 5.36E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 3 145 7.45 316.79 63.01 1.53E-02 0 1.07E-06 -1.03E-06 4.72E-06 03/08/97 Yes Yes 777 172 1060 C 2 H 4 0 7.5 316.39 40.22 6.50E-03 0 7.62E-07 -7.42E-07 1.45E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 5 7.55 315.23 44.24 1.49E-02 0 1.61E-06 -1.64E-06 3.62E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 10 7.6 321.07 54.18 1.54E-02 0 1.48E-06 -1.22E-06 4.32E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 15 7.65 325.33 55.69 1.54E-02 0 1.52E-06 -1.07E-06 4.42E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 20 7.7 323.59 52.13 1.83E-02 0 1.92E-06 -1.45E-06 5.01E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 25 7.75 319.88 54.5 1.80E-02 0 1.69E-06 -1.46E-06 5.08E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 30 7.8 318.87 54.42 1.69E-02 0 1.57E-06 -1.40E-06 4.76E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 35 7.85 317.61 55.62 1.64E-02 0 1.45E-06 -1.36E-06 4.70E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 40 7.9 312.67 53.01 1.80E-02 0 1.56E-06 -1.73E-06 4.99E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 45 7.95 312.06 53.88 2.00E-02 0 1.67E-06 -1.90E-06 5.59E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 50 8 315.92 56.93 2.09E-02 0 1.74E-06 -1.72E-06 6.08E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 55 8.05 322.5 62.72 2.16E-02 0 1.67E-06 -1.31E-06 6.66E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 60 8.1 339.76 65.91 2.23E-02 0 1.81E-06 -6.83E-07 7.06E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 65 8.15 332.41 65.82 2.22E-02 0 1.71E-06 -9.14E-07 7.03E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 70 8.2 320.77 60.86 2.13E-02 0 1.71E-06 -1.42E-06 6.46E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 75 8.25 319.98 60.26 1.89E-02 0 1.52E-06 -1.31E-06 5.68E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 80 8.3 316.72 60.6 1.61E-02 0 1.22E-06 -1.17E-06 4.85E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 85 8.35 323.89 60.57 1.56E-02 0 1.32E-06 -9.83E-07 4.73E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 90 8.4 333.99 66.32 1.57E-02 0 1.20E-06 -6.01E-07 4.99E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 95 8.45 314.78 69.96 1.53E-02 0 7.83E-07 -8.07E-07 4.98E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 100 8.5 298.98 62.99 1.50E-02 0 6.99E-07 -1.29E-06 4.63E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 105 8.55 294.85 57.31 1.51E-02 0 7.29E-07 -1.61E-06 4.42E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 110 8.6 294.93 54.84 1.52E-02 0 7.85E-07 -1.73E-06 4.32E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 115 8.65 296.05 47.32 1.68E-02 0 1.06E-06 -2.21E-06 4.27E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 120 8.7 293.33 44.72 1.84E-02 0 1.10E-06 -2.60E-06 4.49E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 125 8.75 288.18 47.35 1.72E-02 0 7.70E-07 -2.40E-06 4.38E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 130 8.8 283.56 51.06 1.56E-02 0 4.87E-07 -2.07E-06 4.20E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 135 8.85 279.5 52.46 1.40E-02 0 2.99E-07 -1.82E-06 3.85E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 140 8.9 286.24 52.07 1.30E-02 0 4.73E-07 -1.66E-06 3.55E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 145 8.95 306.52 63.52 1.02E-02 0 5.74E-07 -7.92E-07 3.16E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 4 150 9 226.07 82.14 6.09E-03 0 -1.23E-07 -1.30E-07 2.09E-06 03/08/97 Yes Yes 779 172 1060 C 2 H 5 0 9 312.16 50.89 4.45E-03 0 4.00E-07 -4.51E-07 1.20E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 5 9.05 297.81 62.03 8.17E-03 0 3.79E-07 -7.35E-07 2.50E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 10 9.1 314.52 62.72 9.30E-03 0 6.34E-07 -6.59E-07 2.87E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 15 9.15 323.2 63.27 1.03E-02 0 7.83E-07 -5.99E-07 3.17E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 20 9.2 311.17 65.15 1.02E-02 0 6.00E-07 -7.02E-07 3.22E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 25 9.25 312.1 60.24 1.11E-02 0 7.86E-07 -8.89E-07 3.35E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 30 9.3 313.65 58.02 1.25E-02 0 9.71E-07 -1.04E-06 3.68E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 35 9.35 319.13 61.09 1.29E-02 0 9.98E-07 -8.83E-07 3.90E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 40 9.4 317.94 57.35 1.40E-02 0 1.19E-06 -1.10E-06 4.08E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 45 9.45 323.23 57.08 1.46E-02 0 1.35E-06 -1.03E-06 4.24E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 50 9.5 324.84 57.27 1.52E-02 0 1.42E-06 -1.03E-06 4.43E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 55 9.55 321.89 58.07 1.55E-02 0 1.37E-06 -1.10E-06 4.57E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 60 9.6 318.7 58.26 1.50E-02 0 1.25E-06 -1.13E-06 4.41E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 65 9.65 314.93 55.16 1.53E-02 0 1.31E-06 -1.35E-06 4.36E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 70 9.7 312.89 53.63 1.55E-02 0 1.32E-06 -1.46E-06 4.32E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 75 9.75 320.29 56.72 1.45E-02 0 1.30E-06 -1.11E-06 4.21E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 80 9.8 329.46 58.28 1.40E-02 0 1.34E-06 -8.11E-07 4.13E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 85 9.85 327.12 53.41 1.49E-02 0 1.59E-06 -1.05E-06 4.16E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 90 9.9 327.54 54.66 1.56E-02 0 1.62E-06 -1.05E-06 4.42E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 95 9.95 332.93 62.09 1.44E-02 0 1.27E-06 -6.64E-07 4.40E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 100 10 331.66 59.8 1.48E-02 0 1.39E-06 -7.66E-07 4.43E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 105 10.05 332.38 64.43 1.50E-02 0 1.22E-06 -6.52E-07 4.70E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 110 10.1 332.88 61.97 1.49E-02 0 1.32E-06 -6.91E-07 4.55E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 115 10.15 331.43 58.12 1.58E-02 0 1.56E-06 -8.66E-07 4.65E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 120 10.2 344.84 54.26 1.79E-02 0 2.15E-06 -5.95E-07 5.05E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 125 10.25 347.41 54.55 1.91E-02 0 2.29E-06 -5.24E-07 5.40E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 130 10.3 343.64 57.94 1.96E-02 0 2.11E-06 -6.35E-07 5.75E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 135 10.35 337.13 61.59 2.15E-02 0 2.00E-06 -8.64E-07 6.57E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 140 10.4 318.28 66.45 2.24E-02 0 1.42E-06 -1.29E-06 7.11E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 145 10.45 300.33 66.36 2.05E-02 0 8.81E-07 -1.54E-06 6.51E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 5 150 10.5 236.27 73.45 1.06E-02 0 -3.57E-07 -5.47E-07 3.54E-06 03/08/97 Yes Yes 781 172 1060 C 2 H 6 0 10.5 306.64 52.01 9.12E-03 0 7.11E-07 -9.77E-07 2.49E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 5 10.55 282.32 53.14 2.02E-02 0 5.48E-07 -2.56E-06 5.59E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 10 10.6 276.83 54.69 2.22E-02 0 3.24E-07 -2.76E-06 6.28E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 15 10.65 277.7 58.31 2.26E-02 0 3.38E-07 -2.55E-06 6.67E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 20 10.7 284.65 66.45 2.29E-02 0 4.91E-07 -1.92E-06 7.28E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 25 10.75 266.09 73.83 2.20E-02 0 -8.89E-08 -1.33E-06 7.34E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 30 10.8 286.58 70.16 2.06E-02 0 4.24E-07 -1.46E-06 6.73E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 35 10.85 303.65 68.38 2.02E-02 0 8.74E-07 -1.34E-06 6.50E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 40 10.9 299 60.12 2.27E-02 0 1.16E-06 -2.15E-06 6.83E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 45 10.95 281.24 56.75 2.40E-02 0 5.43E-07 -2.80E-06 6.95E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 50 11 270.28 53.65 2.36E-02 0 1.43E-08 -3.04E-06 6.60E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 55 11.05 271.4 53.23 2.33E-02 0 7.22E-08 -3.03E-06 6.48E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 6 60 11.1 260.75 56.71 1.95E-02 0 -3.65E-07 -2.29E-06 5.66E-06 03/08/97 Yes Yes 783 172 1060 C 2 H 7 0 11.14 322.86 49.47 6.90E-03 0 7.58E-07 -5.87E-07 1.82E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 5 11.19 307.71 53.26 1.39E-02 0 1.08E-06 -1.43E-06 3.87E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 10 11.24 302.67 54.32 1.53E-02 0 1.02E-06 -1.63E-06 4.31E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 15 11.29 277.15 50.1 1.78E-02 0 3.02E-07 -2.46E-06 4.73E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 20 11.34 305.42 60.32 1.54E-02 0 9.39E-07 -1.35E-06 4.65E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 25 11.39 18.36 55.54 1.40E-02 0 1.59E-06 5.41E-07 4.00E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 30 11.44 32.04 56.75 1.12E-02 0 1.10E-06 7.06E-07 3.24E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 35 11.49 355.98 62.59 1.09E-02 0 1.06E-06 -7.65E-08 3.36E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 40 11.54 352.56 76.23 1.13E-02 0 5.68E-07 -7.59E-08 3.82E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 45 11.59 169.82 77.23 9.75E-03 0 -4.50E-07 8.26E-08 3.30E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 50 11.64 297.13 79.15 1.11E-02 0 2.03E-07 -4.05E-07 3.79E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 55 11.69 347.43 58.63 2.34E-02 0 2.52E-06 -5.75E-07 6.92E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 60 11.74 127.7 84.19 3.59E-02 0 -4.71E-07 6.24E-07 1.24E-05 03/08/97 Yes Yes 785 172 1060 C 2 H 7 65 11.79 149.37 50.83 3.06E-02 0 -3.53E-06 2.14E-06 8.23E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 70 11.84 152.91 54.7 1.92E-02 0 -2.10E-06 1.10E-06 5.44E-06 03/08/97 Yes Yes 785 172 1060 C 2 H 7 75 11.89 145.84 58.71 1.34E-02 0 -1.22E-06 8.45E-07 3.96E-06 03/08/97 Yes Yes 785 172 1060 C 3 H 1 0 12.5 318.19 72.86 1.05E-02 0 4.92E-07 -4.50E-07 3.50E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 5 12.55 229.4 74.77 1.97E-02 0 -7.13E-07 -8.50E-07 6.58E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 10 12.6 177.68 85.13 1.66E-02 0 -2.98E-07 1.24E-08 5.72E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 15 12.65 2.18 65.88 2.42E-02 0 2.09E-06 8.14E-08 7.64E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 20 12.7 14.52 81.29 2.29E-02 0 7.13E-07 1.89E-07 7.86E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 25 12.75 28.13 83.94 2.02E-02 0 3.99E-07 2.18E-07 6.97E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 30 12.8 0.35 82.26 2.07E-02 0 5.92E-07 3.64E-09 7.11E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 35 12.85 23.23 85.48 1.93E-02 0 2.96E-07 1.30E-07 6.67E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 40 12.9 40.34 82.54 1.71E-02 0 3.59E-07 3.12E-07 5.88E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 45 12.95 16.62 84.34 1.71E-02 0 3.44E-07 1.05E-07 5.91E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 50 13 30.97 85.73 1.96E-02 0 2.65E-07 1.63E-07 6.78E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 55 13.05 59.08 84.77 2.18E-02 0 2.16E-07 3.69E-07 7.51E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 60 13.1 81.87 84.13 2.39E-02 0 7.34E-08 5.25E-07 8.26E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 65 13.15 112.8 84.06 2.44E-02 0 -2.08E-07 5.05E-07 8.41E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 70 13.2 121.74 85.72 2.47E-02 0 -2.06E-07 3.41E-07 8.55E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 75 13.25 128.99 86.4 2.59E-02 0 -2.17E-07 2.74E-07 8.96E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 80 13.3 154.13 85.54 2.72E-02 0 -4.04E-07 2.00E-07 9.41E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 85 13.35 153.2 84.77 2.61E-02 0 -4.50E-07 2.33E-07 9.02E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 90 13.4 142.82 86.58 2.53E-02 0 -2.55E-07 1.98E-07 8.76E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 95 13.45 106.45 87.18 2.49E-02 0 -7.35E-08 2.55E-07 8.61E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 100 13.5 59.63 85.89 2.42E-02 0 1.86E-07 3.25E-07 8.38E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 105 13.55 57.06 89.18 2.41E-02 0 3.99E-08 6.29E-08 8.37E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 110 13.6 224.79 84.46 2.13E-02 0 -3.09E-07 -3.14E-07 7.34E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 115 13.65 54.11 87 1.88E-02 0 1.23E-07 1.73E-07 6.52E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 120 13.7 54.25 84.99 1.84E-02 0 1.99E-07 2.83E-07 6.35E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 125 13.75 95.63 85.39 1.91E-02 0 -3.19E-08 3.31E-07 6.60E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 130 13.8 131.73 84.03 1.84E-02 0 -2.70E-07 3.10E-07 6.35E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 135 13.85 165.74 85.37 1.62E-02 0 -2.69E-07 6.99E-08 5.60E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 140 13.9 59.77 88.82 1.39E-02 0 3.06E-08 5.37E-08 4.82E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 145 13.95 310.42 89.18 1.05E-02 0 2.05E-08 -2.46E-08 3.63E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 1 150 14 180.5 73.73 5.41E-03 0 -3.22E-07 -2.90E-09 1.80E-06 03/08/97 Yes Yes 787 172 1060 C 3 H 2 0 14 1.18 62.75 4.89E-03 0 4.75E-07 9.98E-09 1.51E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 5 14.05 7.61 85.13 8.14E-03 0 1.45E-07 1.99E-08 2.81E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 10 14.1 29.72 76.12 1.03E-02 0 4.54E-07 2.65E-07 3.46E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 15 14.15 23.68 78.63 1.61E-02 0 6.18E-07 2.77E-07 5.49E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 20 14.2 85.43 85.63 2.03E-02 0 2.62E-08 3.35E-07 7.02E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 25 14.25 168.4 79.07 2.28E-02 0 -8.97E-07 1.88E-07 7.75E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 30 14.3 172.29 76.08 2.36E-02 0 -1.19E-06 1.65E-07 7.93E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 35 14.35 170.81 77.33 2.42E-02 0 -1.11E-06 1.84E-07 8.18E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 40 14.4 168.31 76.81 2.58E-02 0 -1.22E-06 2.59E-07 8.72E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 45 14.45 168.89 77.92 2.66E-02 0 -1.16E-06 2.33E-07 9.01E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 50 14.5 168.49 78.65 2.65E-02 0 -1.08E-06 2.26E-07 9.01E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 55 14.55 155.08 80.6 2.67E-02 0 -8.38E-07 3.98E-07 9.12E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 60 14.6 147.12 81.15 2.65E-02 0 -7.25E-07 4.79E-07 9.07E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 65 14.65 150.85 82.93 2.50E-02 0 -5.69E-07 3.25E-07 8.59E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 70 14.7 153.13 80.36 2.36E-02 0 -7.49E-07 3.88E-07 8.08E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 75 14.75 158.57 78.05 2.40E-02 0 -9.83E-07 3.94E-07 8.15E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 80 14.8 170.95 78.62 2.52E-02 0 -1.04E-06 1.70E-07 8.58E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 85 14.85 170.22 81.63 2.63E-02 0 -8.00E-07 1.41E-07 9.01E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 90 14.9 142.38 84.16 2.86E-02 0 -4.89E-07 3.85E-07 9.86E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 95 14.95 193.53 79.1 3.03E-02 0 -1.18E-06 -2.91E-07 1.03E-05 03/08/97 Yes Yes 789 172 1060 C 3 H 2 100 15 180.38 79.17 2.97E-02 0 -1.18E-06 -8.09E-09 1.01E-05 03/08/97 Yes Yes 789 172 1060 C 3 H 2 105 15.05 173.75 78.17 2.96E-02 0 -1.28E-06 1.43E-07 1.01E-05 03/08/97 Yes Yes 789 172 1060 C 3 H 2 110 15.1 173.07 75.63 2.96E-02 0 -1.55E-06 1.92E-07 9.94E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 115 15.15 168.75 73.44 2.90E-02 0 -1.72E-06 3.49E-07 9.63E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 120 15.2 168.21 74.97 2.70E-02 0 -1.45E-06 3.10E-07 9.04E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 125 15.25 157.93 74.83 2.59E-02 0 -1.33E-06 5.53E-07 8.68E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 130 15.3 159.02 75.03 2.41E-02 0 -1.23E-06 4.84E-07 8.08E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 135 15.35 167.78 79.89 2.27E-02 0 -8.25E-07 1.83E-07 7.74E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 140 15.4 169.54 83.86 2.23E-02 0 -4.98E-07 9.39E-08 7.69E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 145 15.45 145.59 85.9 2.09E-02 0 -2.62E-07 1.83E-07 7.23E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 2 150 15.5 178.71 71.47 1.45E-02 0 -9.79E-07 2.25E-08 4.77E-06 03/08/97 Yes Yes 789 172 1060 C 3 H 3 0 15.5 23.64 69.74 6.31E-03 0 4.25E-07 1.90E-07 2.05E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 5 15.55 90.84 83.52 1.33E-02 0 -4.67E-09 3.25E-07 4.58E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 10 15.6 183.22 85.67 1.36E-02 0 -2.18E-07 -1.25E-08 4.72E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 15 15.65 122.4 85.61 1.33E-02 0 -1.15E-07 1.86E-07 4.59E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 20 15.7 100.82 84.47 1.34E-02 0 -5.15E-08 2.75E-07 4.63E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 25 15.75 139.8 85.38 1.31E-02 0 -1.71E-07 1.48E-07 4.54E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 30 15.8 155.59 82.94 1.27E-02 0 -3.00E-07 1.39E-07 4.35E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 35 15.85 152.26 79.48 1.28E-02 0 -4.40E-07 2.37E-07 4.38E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 40 15.9 136.71 75.78 1.38E-02 0 -5.25E-07 5.06E-07 4.65E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 45 15.95 112.69 74.8 1.43E-02 0 -3.06E-07 7.49E-07 4.78E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 50 16 76.39 81.85 1.45E-02 0 1.03E-07 4.34E-07 4.98E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 55 16.05 75.07 85.59 1.83E-02 0 7.70E-08 2.95E-07 6.33E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 60 16.1 136.16 83.86 2.22E-02 0 -3.63E-07 3.56E-07 7.64E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 65 16.15 126.22 82.52 2.36E-02 0 -3.85E-07 5.37E-07 8.10E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 70 16.2 111.5 84.93 2.42E-02 0 -1.66E-07 4.31E-07 8.35E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 75 16.25 106.35 86 2.50E-02 0 -1.04E-07 3.62E-07 8.63E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 80 16.3 100.02 83.13 2.61E-02 0 -1.15E-07 6.68E-07 9.00E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 85 16.35 109.12 82.41 2.76E-02 0 -2.54E-07 7.48E-07 9.50E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 90 16.4 124.04 78.76 2.96E-02 0 -6.85E-07 1.04E-06 1.01E-05 03/08/97 Yes Yes 791 172 1060 C 3 H 3 95 16.45 135.77 77.21 2.90E-02 0 -9.75E-07 9.70E-07 9.79E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 100 16.5 129.25 81.12 2.69E-02 0 -5.58E-07 6.98E-07 9.22E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 105 16.55 128.46 81.36 2.53E-02 0 -5.01E-07 6.45E-07 8.66E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 110 16.6 127.45 77.39 2.26E-02 0 -6.36E-07 8.49E-07 7.65E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 115 16.65 133.43 74.53 1.95E-02 0 -7.59E-07 8.20E-07 6.52E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 120 16.7 146.61 75.6 1.66E-02 0 -7.32E-07 4.94E-07 5.58E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 125 16.75 150.27 79.49 1.50E-02 0 -5.05E-07 2.95E-07 5.13E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 130 16.8 135.6 83.95 1.41E-02 0 -2.26E-07 2.26E-07 4.87E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 135 16.85 116.18 82.69 1.33E-02 0 -1.59E-07 3.30E-07 4.58E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 140 16.9 124.15 82.61 1.25E-02 0 -1.91E-07 2.88E-07 4.29E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 145 16.95 115.29 82 1.16E-02 0 -1.46E-07 3.16E-07 3.97E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 3 150 17 154.77 75.09 8.83E-03 0 -4.36E-07 2.10E-07 2.96E-06 03/08/97 Yes Yes 791 172 1060 C 3 H 4 0 17 27.3 62.47 5.25E-03 0 4.58E-07 2.42E-07 1.62E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 5 17.05 81.68 79.48 9.87E-03 0 5.53E-08 3.87E-07 3.37E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 10 17.1 137.62 86.2 1.06E-02 0 -1.10E-07 1.03E-07 3.67E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 15 17.15 47.6 87.38 1.13E-02 0 7.40E-08 8.29E-08 3.92E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 20 17.2 69.84 83.43 1.37E-02 0 1.14E-07 3.19E-07 4.71E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 25 17.25 74.08 82.27 1.61E-02 0 1.26E-07 4.52E-07 5.53E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 30 17.3 69.72 83.51 1.79E-02 0 1.49E-07 4.12E-07 6.17E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 35 17.35 97.93 83.64 1.76E-02 0 -5.71E-08 4.19E-07 6.07E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 40 17.4 102.91 83.35 1.65E-02 0 -9.07E-08 4.05E-07 5.70E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 45 17.45 52.11 84.49 1.69E-02 0 2.11E-07 2.77E-07 5.83E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 50 17.5 56.95 84.37 1.87E-02 0 2.12E-07 3.33E-07 6.45E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 55 17.55 80.56 85.34 1.98E-02 0 5.61E-08 3.45E-07 6.86E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 60 17.6 83.87 87.63 2.03E-02 0 1.90E-08 1.81E-07 7.04E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 65 17.65 63.14 82.53 2.12E-02 0 2.64E-07 5.34E-07 7.29E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 70 17.7 87.52 80.33 2.31E-02 0 3.56E-08 8.42E-07 7.91E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 75 17.75 84.71 81.69 2.33E-02 0 6.58E-08 7.26E-07 7.98E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 80 17.8 79.89 82.85 2.35E-02 0 1.09E-07 6.23E-07 8.07E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 85 17.85 104.73 82.58 2.29E-02 0 -1.60E-07 6.21E-07 7.88E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 90 17.9 113.53 82.62 2.20E-02 0 -2.39E-07 5.62E-07 7.56E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 95 17.95 114.6 85.31 2.10E-02 0 -1.52E-07 3.39E-07 7.27E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 100 18 107.92 86.15 2.09E-02 0 -9.18E-08 2.90E-07 7.24E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 105 18.05 114.98 85.39 2.05E-02 0 -1.48E-07 3.24E-07 7.08E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 110 18.1 88.23 82.76 1.99E-02 0 1.64E-08 5.43E-07 6.84E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 115 18.15 83.49 84.62 1.99E-02 0 4.49E-08 4.02E-07 6.87E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 120 18.2 95.67 83.15 1.99E-02 0 -4.97E-08 5.12E-07 6.85E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 125 18.25 110.87 81 1.96E-02 0 -2.32E-07 6.21E-07 6.71E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 130 18.3 99.49 82.23 1.91E-02 0 -9.00E-08 5.51E-07 6.54E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 135 18.35 85.07 79.17 1.93E-02 0 6.59E-08 7.82E-07 6.56E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 140 18.4 98.53 76.86 1.88E-02 0 -1.34E-07 9.16E-07 6.34E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 145 18.45 104.66 75.98 1.70E-02 0 -2.21E-07 8.65E-07 5.72E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 4 150 18.5 128.07 72.41 1.17E-02 0 -4.61E-07 6.02E-07 3.86E-06 03/08/97 Yes Yes 793 172 1060 C 3 H 5 0 18.5 7.51 58.69 7.29E-03 0 7.97E-07 1.07E-07 2.16E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 5 18.55 52.81 76.72 1.41E-02 0 4.17E-07 5.62E-07 4.77E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 10 18.6 90.24 81.83 1.68E-02 0 -2.16E-09 5.18E-07 5.77E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 15 18.65 92.66 80.05 1.72E-02 0 -2.93E-08 6.44E-07 5.87E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 20 18.7 81.79 79.52 1.73E-02 0 9.54E-08 6.76E-07 5.91E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 25 18.75 71.78 80.49 1.76E-02 0 1.92E-07 5.98E-07 6.01E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 30 18.8 66.13 81.78 1.75E-02 0 2.15E-07 4.96E-07 6.01E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 35 18.85 80.62 80.28 1.76E-02 0 1.03E-07 6.37E-07 6.02E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 40 18.9 92.36 80.52 1.69E-02 0 -2.44E-08 6.04E-07 5.79E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 45 18.95 91.09 78.67 1.68E-02 0 -1.33E-08 7.15E-07 5.70E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 50 19 102.69 77.45 1.67E-02 0 -1.69E-07 7.68E-07 5.66E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 55 19.05 104.5 81.32 1.55E-02 0 -1.25E-07 4.93E-07 5.33E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 60 19.1 74.51 83.08 1.47E-02 0 1.00E-07 3.70E-07 5.06E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 65 19.15 78.61 83.49 1.43E-02 0 6.82E-08 3.46E-07 4.94E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 70 19.2 60.85 82.85 1.38E-02 0 1.78E-07 3.27E-07 4.76E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 75 19.25 64.12 81.51 1.50E-02 0 2.05E-07 4.32E-07 5.14E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 80 19.3 102.85 80.37 1.61E-02 0 -1.27E-07 5.70E-07 5.51E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 85 19.35 118.17 80.47 1.62E-02 0 -2.68E-07 5.12E-07 5.53E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 90 19.4 115.02 84.3 1.58E-02 0 -1.41E-07 3.08E-07 5.45E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 95 19.45 107.33 84.62 1.57E-02 0 -9.30E-08 3.05E-07 5.41E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 100 19.5 95.95 84.77 1.60E-02 0 -3.20E-08 3.14E-07 5.51E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 105 19.55 104.67 85.25 1.64E-02 0 -7.28E-08 2.84E-07 5.66E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 110 19.6 118.89 84.82 1.63E-02 0 -1.51E-07 2.79E-07 5.63E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 115 19.65 104.77 83.33 1.72E-02 0 -1.08E-07 4.19E-07 5.92E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 120 19.7 122.38 84.11 1.83E-02 0 -2.13E-07 3.44E-07 6.32E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 125 19.75 136.52 83.84 1.83E-02 0 -3.02E-07 2.93E-07 6.29E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 130 19.8 141.19 82.22 1.74E-02 0 -3.90E-07 3.21E-07 5.98E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 135 19.85 133.2 84.91 1.70E-02 0 -2.19E-07 2.39E-07 5.88E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 140 19.9 139.93 80.67 1.74E-02 0 -4.59E-07 3.95E-07 5.97E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 145 19.95 146.51 74.32 1.62E-02 0 -7.73E-07 5.23E-07 5.39E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 5 150 20 162.11 63.1 1.13E-02 0 -1.03E-06 3.40E-07 3.49E-06 03/08/97 Yes Yes 795 172 1060 C 3 H 6 0 20 14.66 69.31 7.05E-03 0 5.11E-07 1.37E-07 2.29E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 5 20.05 103.7 83.28 1.43E-02 0 -8.40E-08 3.52E-07 4.92E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 10 20.1 135.54 84.82 1.54E-02 0 -2.11E-07 2.12E-07 5.33E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 15 20.15 91.6 85.92 1.56E-02 0 -6.58E-09 2.40E-07 5.39E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 20 20.2 94.38 85.41 1.58E-02 0 -2.04E-08 2.73E-07 5.45E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 25 20.25 100.08 86.12 1.60E-02 0 -4.03E-08 2.32E-07 5.55E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 30 20.3 126.41 84.34 1.59E-02 0 -1.97E-07 2.73E-07 5.48E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 35 20.35 103.8 86.05 1.57E-02 0 -5.48E-08 2.28E-07 5.44E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 40 20.4 111.98 85.36 1.59E-02 0 -1.02E-07 2.58E-07 5.49E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 45 20.45 131.56 84.88 1.59E-02 0 -2.00E-07 2.31E-07 5.49E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 50 20.5 136.02 80.03 1.57E-02 0 -4.14E-07 4.09E-07 5.35E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 55 20.55 140.4 77.69 1.51E-02 0 -5.27E-07 4.46E-07 5.12E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 60 20.6 137.93 80.53 1.47E-02 0 -3.81E-07 3.52E-07 5.03E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 65 20.65 114.36 84.19 1.36E-02 0 -1.20E-07 2.72E-07 4.69E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 70 20.7 105.6 86.21 1.39E-02 0 -5.22E-08 1.91E-07 4.79E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 75 20.75 121.63 84.69 1.39E-02 0 -1.43E-07 2.38E-07 4.81E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 80 20.8 132.49 86.63 1.41E-02 0 -1.18E-07 1.32E-07 4.87E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 85 20.85 117.27 83.37 1.40E-02 0 -1.57E-07 3.12E-07 4.82E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 90 20.9 87.13 85.02 1.34E-02 0 1.24E-08 2.53E-07 4.64E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 95 20.95 31.92 87.79 1.39E-02 0 9.64E-08 6.14E-08 4.82E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 100 21 110.98 86.81 1.41E-02 0 -5.99E-08 1.60E-07 4.90E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 105 21.05 110.66 85.62 1.51E-02 0 -8.61E-08 2.34E-07 5.21E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 110 21.1 99.93 82.26 1.57E-02 0 -7.71E-08 4.50E-07 5.38E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 115 21.15 62.54 80.03 1.66E-02 0 2.81E-07 5.52E-07 5.66E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 120 21.2 35.46 83.67 1.76E-02 0 3.36E-07 2.45E-07 6.08E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 125 21.25 36.96 83.79 1.79E-02 0 3.27E-07 2.52E-07 6.15E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 130 21.3 75.19 82.55 1.73E-02 0 1.22E-07 4.72E-07 5.96E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 135 21.35 52.94 83.46 1.72E-02 0 2.50E-07 3.39E-07 5.93E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 140 21.4 47.53 85.23 1.79E-02 0 2.13E-07 2.38E-07 6.19E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 145 21.45 76.46 87.32 1.62E-02 0 3.75E-08 1.59E-07 5.60E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 6 150 21.5 170.28 77.59 1.08E-02 0 -4.86E-07 8.51E-08 3.66E-06 03/08/97 Yes Yes 797 172 1060 C 3 H 7 0 21.5 8.45 59.8 7.47E-03 0 7.89E-07 1.20E-07 2.24E-06 03/08/97 Yes Yes 799 172 1060 C 3 H 7 5 21.55 36.02 79.67 1.43E-02 0 4.41E-07 3.28E-07 4.89E-06 03/08/97 Yes Yes 799 172 1060 C 3 H 7 10 21.6 111.05 83.55 1.54E-02 0 -1.32E-07 3.51E-07 5.32E-06 03/08/97 Yes Yes 799 172 1060 C 3 H 7 15 21.65 109.2 83.83 1.57E-02 0 -1.18E-07 3.46E-07 5.42E-06 03/08/97 Yes Yes 799 172 1060 C 3 H 7 20 21.7 86.35 83.06 1.67E-02 0 2.73E-08 4.38E-07 5.76E-06 03/08/97 Yes Yes 799 172 1060 C 3 H 7 25 21.75 57.79 78.09 2.01E-02 0 4.68E-07 7.60E-07 6.80E-06 03/08/97 Yes Yes 799 172 1060 C 3 H 7 30 21.8 174.23 73.62 2.04E-02 0 -1.21E-06 1.25E-07 6.78E-06 03/08/97 Yes Yes 799 172 1060 C 3 H 7 35 21.85 192.74 59.89 1.09E-02 0 -1.13E-06 -2.61E-07 3.26E-06 03/08/97 Yes Yes 799 172 1060 C 3 H 7 40 21.9 46.49 72.43 6.96E-03 0 3.07E-07 3.31E-07 2.30E-06 03/08/97 Yes Yes 799 172 1060 C 3 H 7 45 21.95 52.51 76.68 1.20E-02 0 3.58E-07 4.77E-07 4.06E-06 03/08/97 Yes Yes 799 172 1060 C 4 H 1 0 22 325.34 73.83 6.04E-03 0 2.93E-07 -2.07E-07 2.01E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 5 22.05 307.3 68.09 1.00E-02 0 4.80E-07 -6.44E-07 3.22E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 10 22.1 307.82 78.81 1.07E-02 0 2.70E-07 -3.56E-07 3.64E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 15 22.15 308.59 74.94 1.18E-02 0 4.04E-07 -5.18E-07 3.93E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 20 22.2 321.81 71.34 1.16E-02 0 6.18E-07 -4.97E-07 3.80E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 25 22.25 341.02 70.32 1.17E-02 0 7.90E-07 -2.78E-07 3.82E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 30 22.3 332.93 69.53 1.25E-02 0 8.24E-07 -4.31E-07 4.05E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 35 22.35 328.62 68.64 1.40E-02 0 9.21E-07 -5.74E-07 4.51E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 40 22.4 339.15 68.77 1.59E-02 0 1.14E-06 -4.44E-07 5.13E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 45 22.45 335.47 68.54 1.74E-02 0 1.23E-06 -5.72E-07 5.60E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 50 22.5 327.55 70.16 1.75E-02 0 1.06E-06 -6.91E-07 5.71E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 55 22.55 326.25 71.57 1.72E-02 0 9.58E-07 -6.55E-07 5.65E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 60 22.6 327.19 72.23 1.71E-02 0 9.28E-07 -6.12E-07 5.63E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 65 22.65 329.47 70.86 1.72E-02 0 1.03E-06 -6.23E-07 5.65E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 70 22.7 334.5 69.87 1.78E-02 0 1.17E-06 -5.73E-07 5.80E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 75 22.75 338.11 69.65 1.72E-02 0 1.18E-06 -4.85E-07 5.60E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 80 22.8 342.52 66.68 1.69E-02 0 1.35E-06 -4.36E-07 5.38E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 85 22.85 341.63 62.49 1.70E-02 0 1.58E-06 -5.38E-07 5.24E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 90 22.9 337.69 60.72 1.81E-02 0 1.74E-06 -7.29E-07 5.48E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 95 22.95 337.34 62.77 1.85E-02 0 1.66E-06 -7.07E-07 5.70E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 100 23 335.12 65.22 1.80E-02 0 1.45E-06 -6.87E-07 5.66E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 105 23.05 333.04 64.01 1.74E-02 0 1.44E-06 -7.51E-07 5.43E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 110 23.1 331.14 62.06 1.70E-02 0 1.48E-06 -8.36E-07 5.22E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 115 23.15 336.21 64.37 1.58E-02 0 1.32E-06 -5.97E-07 4.93E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 120 23.2 337.3 62.97 1.49E-02 0 1.32E-06 -5.65E-07 4.59E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 125 23.25 339.43 59.54 1.50E-02 0 1.51E-06 -5.79E-07 4.48E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 130 23.3 340.7 60.84 1.51E-02 0 1.47E-06 -5.26E-07 4.56E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 135 23.35 341.24 62.13 1.48E-02 0 1.39E-06 -4.81E-07 4.52E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 140 23.4 336.91 62.23 1.44E-02 0 1.31E-06 -5.70E-07 4.42E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 145 23.45 332.16 59.79 1.39E-02 0 1.31E-06 -7.06E-07 4.15E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 1 150 23.5 305.69 72.32 8.88E-03 0 3.34E-07 -4.75E-07 2.93E-06 03/08/97 Yes Yes 801 172 1060 C 4 H 2 0 23.5 341.44 47.49 4.55E-03 0 6.18E-07 -2.12E-07 1.16E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 5 23.55 328.45 56.26 1.15E-02 0 1.15E-06 -7.23E-07 3.31E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 10 23.6 326.84 66.42 1.24E-02 0 8.79E-07 -5.87E-07 3.93E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 15 23.65 328.55 66.15 1.24E-02 0 9.10E-07 -5.69E-07 3.94E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 20 23.7 322.37 64.24 1.21E-02 0 8.82E-07 -6.95E-07 3.77E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 25 23.75 323.75 68.3 1.03E-02 0 6.52E-07 -4.89E-07 3.32E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 30 23.8 327.58 67.49 9.68E-03 0 6.64E-07 -4.31E-07 3.10E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 35 23.85 326.19 65.91 9.65E-03 0 6.95E-07 -4.76E-07 3.06E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 40 23.9 325.9 65.91 9.47E-03 0 6.79E-07 -4.70E-07 3.00E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 45 23.95 326.33 65.6 9.65E-03 0 7.04E-07 -4.80E-07 3.05E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 50 24 326.18 67.48 9.68E-03 0 6.53E-07 -4.48E-07 3.10E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 55 24.05 326.94 68.76 9.26E-03 0 5.97E-07 -3.97E-07 2.99E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 60 24.1 329.12 65.78 9.51E-03 0 7.10E-07 -4.34E-07 3.01E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 65 24.15 327.13 66.05 9.65E-03 0 6.98E-07 -4.61E-07 3.06E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 70 24.2 325.34 67.07 9.36E-03 0 6.36E-07 -4.50E-07 2.99E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 75 24.25 318.92 70.6 8.48E-03 0 4.51E-07 -4.02E-07 2.77E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 80 24.3 315.11 69.97 7.64E-03 0 3.93E-07 -4.00E-07 2.49E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 85 24.35 325.14 63.31 8.49E-03 0 6.64E-07 -4.73E-07 2.63E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 90 24.4 314.73 68.13 9.06E-03 0 5.04E-07 -5.20E-07 2.92E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 95 24.45 302.92 70.25 8.62E-03 0 3.36E-07 -5.30E-07 2.81E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 100 24.5 299.1 66.61 8.92E-03 0 3.66E-07 -6.71E-07 2.84E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 105 24.55 338.62 67.47 1.01E-02 0 7.64E-07 -3.06E-07 3.24E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 110 24.6 21.47 65.46 1.50E-02 0 1.23E-06 4.94E-07 4.72E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 115 24.65 35.43 35.3 3.25E-02 0 4.58E-06 3.33E-06 6.51E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 120 24.7 37.74 58.73 2.81E-02 0 2.45E-06 1.94E-06 8.34E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 125 24.75 273.04 65.52 1.30E-02 0 6.08E-08 -1.17E-06 4.11E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 130 24.8 35.42 68.51 1.24E-02 0 7.83E-07 5.69E-07 3.99E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 135 24.85 296.21 67.33 1.30E-02 0 4.68E-07 -9.73E-07 4.15E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 140 24.9 301.16 66.03 1.08E-02 0 4.80E-07 -8.12E-07 3.41E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 145 24.95 344.28 30.21 2.37E-02 0 4.18E-06 -1.20E-06 4.14E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 2 150 25 355.77 50.38 1.85E-02 0 2.50E-06 -1.89E-07 4.95E-06 03/08/97 Yes Yes 803 172 1060 C 4 H 3 0 25 329.05 31.54 2.92E-02 0 4.53E-06 -2.78E-06 5.30E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 5 25.05 353.81 52.71 3.59E-02 0 4.58E-06 -5.08E-07 9.89E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 10 25.1 352.93 59.07 2.89E-02 0 3.13E-06 -3.97E-07 8.60E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 15 25.15 43.26 82.03 1.56E-02 0 3.35E-07 3.22E-07 5.37E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 20 25.2 16.18 81.37 1.29E-02 0 3.94E-07 1.17E-07 4.42E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 25 25.25 286.05 72.89 1.06E-02 0 1.82E-07 -6.48E-07 3.50E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 30 25.3 307.04 73.23 9.70E-03 0 3.58E-07 -4.85E-07 3.22E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 35 25.35 324.28 72.88 9.45E-03 0 4.79E-07 -3.52E-07 3.13E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 40 25.4 327 76.04 8.61E-03 0 3.69E-07 -2.45E-07 2.90E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 45 25.45 337.87 78.16 7.20E-03 0 2.90E-07 -1.21E-07 2.44E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 50 25.5 1.41 72.09 6.62E-03 0 4.32E-07 1.09E-08 2.18E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 55 25.55 325.72 72.75 7.30E-03 0 3.80E-07 -2.65E-07 2.42E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 60 25.6 322.29 73.15 8.40E-03 0 4.09E-07 -3.23E-07 2.79E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 65 25.65 323.37 73.7 8.80E-03 0 4.21E-07 -3.20E-07 2.93E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 70 25.7 320.24 71.86 9.37E-03 0 4.76E-07 -4.05E-07 3.09E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 75 25.75 326.01 72.62 1.02E-02 0 5.35E-07 -3.69E-07 3.37E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 80 25.8 333.52 73.81 1.13E-02 0 5.98E-07 -3.04E-07 3.76E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 85 25.85 331.12 75.35 1.17E-02 0 5.51E-07 -3.11E-07 3.93E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 90 25.9 355.04 69.27 1.25E-02 0 9.32E-07 -8.28E-08 4.04E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 95 25.95 340.27 72.85 1.28E-02 0 7.51E-07 -2.76E-07 4.23E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 100 26 316.92 77.3 1.18E-02 0 4.03E-07 -3.85E-07 4.00E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 105 26.05 328.28 76.7 1.11E-02 0 4.61E-07 -2.91E-07 3.75E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 110 26.1 329.17 74.77 1.12E-02 0 5.38E-07 -3.28E-07 3.76E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 115 26.15 313.39 75.76 1.12E-02 0 4.01E-07 -4.33E-07 3.76E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 120 26.2 300.71 76.17 1.03E-02 0 2.67E-07 -4.60E-07 3.48E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 125 26.25 353.6 65.29 9.94E-03 0 8.76E-07 -1.00E-07 3.13E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 130 26.3 29.95 42.13 1.31E-02 0 1.79E-06 1.05E-06 3.05E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 135 26.35 7.21 71.05 9.08E-03 0 6.21E-07 8.02E-08 2.98E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 140 26.4 306.79 70.85 6.91E-03 0 2.88E-07 -3.94E-07 2.26E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 145 26.45 317.25 70.09 6.32E-03 0 3.35E-07 -3.17E-07 2.06E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 3 150 26.5 256.5 80.7 4.40E-03 0 -3.52E-08 -1.50E-07 1.51E-06 03/08/97 Yes Yes 805 172 1060 C 4 H 4 0 26.5 321.27 54.77 1.90E-03 0 1.82E-07 -1.49E-07 5.39E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 5 26.55 333.7 62.77 5.30E-03 0 4.61E-07 -2.33E-07 1.63E-06 03/08/97 Yes Yes 807 172 1060 C 4 H 4 10 26.6 326.06 70.74 6.34E-03 0 3.68E-07 -2.53E-07 2.07E-06 03/08/97 Yes Yes 807 172 1060 C 4 H 4 15 26.65 321.76 74.19 6.29E-03 0 2.85E-07 -2.30E-07 2.10E-06 03/08/97 Yes Yes 807 172 1060 C 4 H 4 20 26.7 302.32 80.07 4.77E-03 0 9.33E-08 -1.51E-07 1.63E-06 03/08/97 Yes Yes 807 172 1060 C 4 H 4 25 26.75 323.98 85.84 3.07E-03 0 3.82E-08 -2.84E-08 1.06E-06 03/08/97 Yes Yes 807 172 1060 C 4 H 4 30 26.8 159.7 86.67 1.76E-03 0 -2.04E-08 7.70E-09 6.10E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 35 26.85 112.67 87.23 9.87E-04 0 -3.89E-09 9.53E-09 3.42E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 40 26.9 16.34 70.6 9.95E-04 0 6.73E-08 2.02E-08 3.26E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 45 26.95 299.81 61.93 1.18E-03 0 5.84E-08 -1.04E-07 3.60E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 50 27 319.34 77.82 1.04E-03 0 3.52E-08 -3.09E-08 3.51E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 55 27.05 358.35 72.5 1.27E-03 0 8.08E-08 -2.38E-09 4.19E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 60 27.1 359.02 74.33 1.58E-03 0 9.03E-08 -1.58E-09 5.26E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 65 27.15 339 76.01 1.99E-03 0 9.53E-08 -3.74E-08 6.70E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 70 27.2 345.28 72.9 2.62E-03 0 1.58E-07 -4.25E-08 8.70E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 75 27.25 344.22 76.54 2.84E-03 0 1.35E-07 -3.89E-08 9.56E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 80 27.3 337.99 77.78 2.84E-03 0 1.18E-07 -4.88E-08 9.61E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 85 27.35 335.39 76.27 2.80E-03 0 1.28E-07 -6.01E-08 9.44E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 90 27.4 334.07 73.01 2.88E-03 0 1.60E-07 -7.98E-08 9.54E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 95 27.45 327.48 75.59 2.79E-03 0 1.24E-07 -8.09E-08 9.36E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 100 27.5 326.61 76.4 2.49E-03 0 1.04E-07 -7.00E-08 8.40E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 105 27.55 341.01 77.21 2.40E-03 0 1.07E-07 -3.75E-08 8.11E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 110 27.6 333.8 76.81 2.26E-03 0 9.81E-08 -4.94E-08 7.63E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 115 27.65 325.84 73.63 2.19E-03 0 1.09E-07 -7.53E-08 7.30E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 120 27.7 334.24 74.74 2.23E-03 0 1.12E-07 -5.54E-08 7.46E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 125 27.75 343.92 73.06 2.36E-03 0 1.40E-07 -4.13E-08 7.83E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 130 27.8 338.18 72.79 2.51E-03 0 1.46E-07 -5.98E-08 8.30E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 135 27.85 339.95 72.77 2.50E-03 0 1.47E-07 -5.50E-08 8.27E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 140 27.9 340.05 73.65 2.45E-03 0 1.38E-07 -5.11E-08 8.15E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 145 27.95 319.89 71.16 2.28E-03 0 1.19E-07 -1.03E-07 7.47E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 4 150 28 255.02 78.74 1.49E-03 0 -1.60E-08 -6.11E-08 5.08E-07 03/08/97 Yes Yes 807 172 1060 C 4 H 5 0 28 334.24 58.94 6.29E-04 0 6.20E-08 -3.06E-08 1.87E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 5 5 28.05 351.09 65.78 1.86E-03 0 1.60E-07 -2.57E-08 5.88E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 5 10 28.1 343.49 74.3 2.17E-03 0 1.19E-07 -3.62E-08 7.24E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 5 15 28.15 338.51 74.66 2.20E-03 0 1.15E-07 -4.62E-08 7.35E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 5 20 28.2 331.36 72.43 2.39E-03 0 1.34E-07 -7.50E-08 7.90E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 5 25 28.25 331.33 74.98 2.42E-03 0 1.17E-07 -6.54E-08 8.12E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 5 30 28.3 326.78 71.31 2.49E-03 0 1.42E-07 -9.48E-08 8.18E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 5 35 28.35 329.45 69.07 2.86E-03 0 1.87E-07 -1.13E-07 9.26E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 5 40 28.4 327.45 71.86 3.17E-03 0 1.76E-07 -1.15E-07 1.04E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 45 28.45 323.48 72.36 3.23E-03 0 1.67E-07 -1.27E-07 1.07E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 50 28.5 321.31 72.97 3.19E-03 0 1.55E-07 -1.27E-07 1.06E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 55 28.55 339.15 74.7 2.93E-03 0 1.53E-07 -5.97E-08 9.80E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 5 60 28.6 333.69 69.45 3.16E-03 0 2.11E-07 -1.07E-07 1.03E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 65 28.65 327.87 70.61 3.46E-03 0 2.06E-07 -1.32E-07 1.13E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 70 28.7 324.01 71.72 3.48E-03 0 1.88E-07 -1.39E-07 1.15E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 75 28.75 329.16 71.61 3.56E-03 0 2.05E-07 -1.25E-07 1.17E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 80 28.8 324.85 72.47 3.66E-03 0 1.91E-07 -1.38E-07 1.21E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 85 28.85 316.86 72.26 3.61E-03 0 1.70E-07 -1.63E-07 1.19E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 90 28.9 321.65 72.07 3.62E-03 0 1.85E-07 -1.50E-07 1.19E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 95 28.95 321.56 72.44 3.60E-03 0 1.80E-07 -1.46E-07 1.19E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 100 29 305.7 73.97 3.28E-03 0 1.12E-07 -1.60E-07 1.09E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 105 29.05 329.48 71.6 3.22E-03 0 1.86E-07 -1.12E-07 1.06E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 110 29.1 319 75.14 3.38E-03 0 1.39E-07 -1.23E-07 1.13E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 115 29.15 320.16 78.49 3.01E-03 0 9.80E-08 -8.36E-08 1.02E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 120 29.2 349.36 74.37 2.93E-03 0 1.65E-07 -3.16E-08 9.78E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 5 125 29.25 15.24 62.82 3.32E-03 0 3.10E-07 8.64E-08 1.02E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 130 29.3 338.24 79.35 3.19E-03 0 1.16E-07 -4.74E-08 1.09E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 135 29.35 351.39 77.95 3.49E-03 0 1.53E-07 -2.37E-08 1.18E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 140 29.4 340.23 76.97 4.03E-03 0 1.81E-07 -6.66E-08 1.36E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 145 29.45 328.03 74.01 3.85E-03 0 1.91E-07 -1.22E-07 1.28E-06 03/08/97 Yes Yes 809 172 1060 C 4 H 5 150 29.5 308.22 87.92 2.69E-03 0 1.28E-08 -1.66E-08 9.31E-07 03/08/97 Yes Yes 809 172 1060 C 4 H 6 0 29.5 335.62 55.33 1.12E-03 0 1.23E-07 -5.72E-08 3.20E-07 03/08/97 Yes Yes 811 172 1060 C 4 H 6 5 29.55 336.4 67.62 2.70E-03 0 1.99E-07 -8.91E-08 8.64E-07 03/08/97 Yes Yes 811 172 1060 C 4 H 6 10 29.6 335.52 75.63 3.10E-03 0 1.49E-07 -6.92E-08 1.04E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 15 29.65 337.73 76.22 3.27E-03 0 1.53E-07 -6.40E-08 1.10E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 20 29.7 333.95 76.76 3.25E-03 0 1.42E-07 -7.09E-08 1.10E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 25 29.75 329.35 80.13 2.98E-03 0 9.31E-08 -5.64E-08 1.02E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 30 29.8 310.21 82.78 2.50E-03 0 4.30E-08 -5.20E-08 8.60E-07 03/08/97 Yes Yes 811 172 1060 C 4 H 6 35 29.85 330.33 74.95 2.75E-03 0 1.32E-07 -7.68E-08 9.22E-07 03/08/97 Yes Yes 811 172 1060 C 4 H 6 40 29.9 344.84 75.01 3.39E-03 0 1.80E-07 -4.98E-08 1.14E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 45 29.95 331.95 74.77 4.07E-03 0 2.00E-07 -1.09E-07 1.36E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 50 30 331.08 75.48 4.40E-03 0 2.05E-07 -1.16E-07 1.48E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 55 30.05 331.36 74.03 4.77E-03 0 2.44E-07 -1.36E-07 1.59E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 60 30.1 330.44 75.83 4.70E-03 0 2.12E-07 -1.23E-07 1.58E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 65 30.15 332.43 74.98 4.54E-03 0 2.21E-07 -1.18E-07 1.52E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 70 30.2 329.27 67.24 4.35E-03 0 3.07E-07 -1.87E-07 1.39E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 75 30.25 336.02 56.41 3.53E-03 0 3.79E-07 -1.72E-07 1.02E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 80 30.3 347.18 73.01 1.73E-03 0 1.05E-07 -2.44E-08 5.75E-07 03/08/97 Yes Yes 811 172 1060 C 4 H 6 85 30.35 341.89 67.07 3.45E-03 0 2.71E-07 -9.05E-08 1.10E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 90 30.4 323.53 78.68 4.12E-03 0 1.38E-07 -1.04E-07 1.40E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 95 30.45 335.38 78.66 4.18E-03 0 1.59E-07 -7.43E-08 1.42E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 100 30.5 325.37 72.19 4.77E-03 0 2.55E-07 -1.80E-07 1.57E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 105 30.55 318.67 74.48 4.96E-03 0 2.11E-07 -1.90E-07 1.66E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 110 30.6 332.67 79.3 4.56E-03 0 1.59E-07 -8.42E-08 1.55E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 115 30.65 328 77.52 4.40E-03 0 1.71E-07 -1.09E-07 1.49E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 120 30.7 327.34 76.52 4.64E-03 0 1.93E-07 -1.26E-07 1.56E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 125 30.75 333.72 79.51 4.62E-03 0 1.60E-07 -8.08E-08 1.58E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 130 30.8 331.45 79.87 4.62E-03 0 1.51E-07 -8.42E-08 1.58E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 135 30.85 334.47 77.11 5.00E-03 0 2.13E-07 -1.04E-07 1.69E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 140 30.9 336.99 75.69 5.42E-03 0 2.62E-07 -1.14E-07 1.82E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 145 30.95 333.52 73.69 5.51E-03 0 2.94E-07 -1.50E-07 1.84E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 6 150 31 272.23 85.12 3.92E-03 0 2.74E-09 -7.22E-08 1.35E-06 03/08/97 Yes Yes 811 172 1060 C 4 H 7 0 31 355.76 55.88 2.75E-03 0 3.26E-07 -2.47E-08 7.88E-07 03/08/97 Yes Yes 813 172 1060 C 4 H 7 5 31.05 338.12 70.04 5.26E-03 0 3.54E-07 -1.45E-07 1.71E-06 03/08/97 Yes Yes 813 172 1060 C 4 H 7 10 31.1 323.2 77.65 5.16E-03 0 1.87E-07 -1.43E-07 1.75E-06 03/08/97 Yes Yes 813 172 1060 C 4 H 7 15 31.15 333.09 77.12 4.63E-03 0 1.95E-07 -1.01E-07 1.56E-06 03/08/97 Yes Yes 813 172 1060 C 4 H 7 20 31.2 348.11 75.01 4.42E-03 0 2.37E-07 -5.11E-08 1.48E-06 03/08/97 Yes Yes 813 172 1060 C 4 H 7 25 31.25 345.98 73.72 4.58E-03 0 2.64E-07 -6.75E-08 1.52E-06 03/08/97 Yes Yes 813 172 1060 C 4 H 7 30 31.3 337.53 75.36 4.51E-03 0 2.23E-07 -9.44E-08 1.51E-06 03/08/97 Yes Yes 813 172 1060 C 4 H 7 35 31.35 347.89 71.05 4.62E-03 0 3.11E-07 -6.83E-08 1.52E-06 03/08/97 Yes Yes 813 172 1060 C 4 H 7 40 31.4 347.81 72.17 6.24E-03 0 3.96E-07 -8.76E-08 2.06E-06 03/08/97 Yes Yes 813 172 1060 C 4 H 7 45 31.45 214.72 77.89 6.16E-03 0 -2.25E-07 -1.60E-07 2.09E-06 03/08/97 Yes Yes 813 172 1060 C 4 H 7 50 31.5 255.99 77.75 4.05E-03 0 -4.41E-08 -1.81E-07 1.37E-06 03/08/97 Yes Yes 813 172 1060 C 4 H 7 55 31.55 338.5 65.86 3.65E-03 0 2.95E-07 -1.19E-07 1.16E-06 03/08/97 Yes Yes 813 172 1060 C 5 H 1 0 31.5 343.32 -5.59 2.05E-03 0 4.15E-07 -1.27E-07 -6.92E-08 03/08/97 Yes Yes 815 172 1060 C 5 H 1 5 31.55 46 47.15 2.68E-03 0 2.68E-07 2.84E-07 6.81E-07 03/08/97 Yes Yes 815 172 1060 C 5 H 1 10 31.6 74.66 45.06 3.13E-03 0 1.24E-07 4.63E-07 7.69E-07 03/08/97 Yes Yes 815 172 1060 C 5 H 1 15 31.65 332 34.98 7.84E-03 0 1.20E-06 -6.54E-07 1.56E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 20 31.7 294.65 61.35 5.64E-03 0 2.39E-07 -5.33E-07 1.72E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 25 31.75 66.97 83.72 3.75E-03 0 3.40E-08 8.19E-08 1.29E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 30 31.8 44.67 73.54 3.53E-03 0 1.51E-07 1.53E-07 1.17E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 35 31.85 51.37 77.19 3.48E-03 0 1.02E-07 1.31E-07 1.18E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 40 31.9 39.94 79.77 3.51E-03 0 1.01E-07 8.67E-08 1.20E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 45 31.95 47.25 80.16 3.37E-03 0 8.30E-08 9.18E-08 1.15E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 50 32 55.53 82.05 3.22E-03 0 5.34E-08 7.95E-08 1.10E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 55 32.05 47.04 77.46 3.34E-03 0 1.05E-07 1.15E-07 1.13E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 60 32.1 50.91 77.68 3.56E-03 0 1.01E-07 1.28E-07 1.20E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 65 32.15 57.83 77.63 3.54E-03 0 8.57E-08 1.39E-07 1.20E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 70 32.2 56.71 77.6 3.52E-03 0 8.81E-08 1.37E-07 1.19E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 75 32.25 54.38 76.38 3.60E-03 0 1.05E-07 1.50E-07 1.21E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 80 32.3 51.2 76.71 3.65E-03 0 1.12E-07 1.42E-07 1.23E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 85 32.35 42.9 78.43 3.63E-03 0 1.13E-07 1.08E-07 1.23E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 90 32.4 29.51 83.42 3.45E-03 0 7.30E-08 4.23E-08 1.19E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 95 32.45 58.75 83.41 3.55E-03 0 4.48E-08 7.55E-08 1.22E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 100 32.5 54.4 77.43 3.96E-03 0 1.06E-07 1.52E-07 1.34E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 105 32.55 51.05 79.56 4.10E-03 0 9.91E-08 1.25E-07 1.40E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 110 32.6 56.68 81.45 3.56E-03 0 6.17E-08 9.60E-08 1.22E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 115 32.65 44.87 81.42 3.14E-03 0 7.04E-08 7.16E-08 1.08E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 120 32.7 47.8 79.15 3.03E-03 0 8.13E-08 9.17E-08 1.03E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 125 32.75 46.78 78.65 3.05E-03 0 8.73E-08 9.50E-08 1.04E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 130 32.8 36.32 76.55 3.32E-03 0 1.32E-07 9.92E-08 1.12E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 135 32.85 38.86 78.93 3.63E-03 0 1.15E-07 9.47E-08 1.23E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 140 32.9 40.21 80.38 3.66E-03 0 9.90E-08 8.56E-08 1.25E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 145 32.95 30.66 78 3.65E-03 0 1.38E-07 8.39E-08 1.24E-06 03/08/97 Yes Yes 815 172 1060 C 5 H 1 150 33 125.01 79.09 2.61E-03 0 -6.02E-08 8.79E-08 8.90E-07 03/08/97 Yes Yes 815 172 1060 C 5 H 2 0 33 5.64 61.19 1.37E-03 0 1.40E-07 1.41E-08 4.18E-07 03/08/97 Yes Yes 817 172 1060 C 5 H 2 5 33.05 15.16 76.08 2.79E-03 0 1.38E-07 3.81E-08 9.40E-07 03/08/97 Yes Yes 817 172 1060 C 5 H 2 10 33.1 11.05 79.02 3.01E-03 0 1.19E-07 2.38E-08 1.03E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 15 33.15 15.83 78.31 3.12E-03 0 1.29E-07 3.74E-08 1.06E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 20 33.2 14.96 79.9 3.19E-03 0 1.15E-07 3.13E-08 1.09E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 25 33.25 25.86 77.5 3.99E-03 0 1.65E-07 8.17E-08 1.35E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 30 33.3 7.56 80.81 4.40E-03 0 1.48E-07 2.00E-08 1.51E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 35 33.35 4.9 78.05 4.93E-03 0 2.16E-07 1.89E-08 1.67E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 40 33.4 28.04 82.26 4.95E-03 0 1.25E-07 6.80E-08 1.70E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 45 33.45 33.73 82.88 4.49E-03 0 9.82E-08 6.70E-08 1.54E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 50 33.5 24.28 82.02 4.43E-03 0 1.19E-07 5.48E-08 1.52E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 55 33.55 15.38 81.87 4.41E-03 0 1.27E-07 3.58E-08 1.51E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 60 33.6 27 79.97 4.49E-03 0 1.48E-07 7.70E-08 1.53E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 65 33.65 23.32 81.88 4.55E-03 0 1.25E-07 5.52E-08 1.56E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 70 33.7 13.27 84.22 4.39E-03 0 9.13E-08 2.20E-08 1.52E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 75 33.75 30.47 84.31 4.23E-03 0 7.66E-08 4.61E-08 1.46E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 80 33.8 25.65 83.32 4.20E-03 0 9.35E-08 4.59E-08 1.45E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 85 33.85 9.29 85.24 4.19E-03 0 7.28E-08 1.22E-08 1.45E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 90 33.9 356.54 73.66 4.32E-03 0 2.57E-07 -1.59E-08 1.44E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 95 33.95 343.77 67.98 4.43E-03 0 3.38E-07 -1.01E-07 1.42E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 100 34 35.06 83.5 4.00E-03 0 7.86E-08 5.64E-08 1.38E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 105 34.05 40.53 82.28 4.02E-03 0 8.72E-08 7.62E-08 1.38E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 110 34.1 32.55 81.36 4.08E-03 0 1.10E-07 7.15E-08 1.40E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 115 34.15 39.63 82.36 4.04E-03 0 8.78E-08 7.43E-08 1.39E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 120 34.2 34.64 82.61 3.76E-03 0 8.44E-08 5.96E-08 1.29E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 125 34.25 24.6 80.99 3.71E-03 0 1.12E-07 5.24E-08 1.27E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 130 34.3 18.66 82.3 3.69E-03 0 9.94E-08 3.43E-08 1.27E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 135 34.35 7.63 83.27 3.59E-03 0 8.85E-08 1.21E-08 1.24E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 140 34.4 7.52 75.15 3.97E-03 0 2.14E-07 2.89E-08 1.33E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 145 34.45 2.32 75.51 4.42E-03 0 2.34E-07 9.70E-09 1.48E-06 03/08/97 Yes Yes 817 172 1060 C 5 H 2 150 34.5 127.52 75.55 2.93E-03 0 -9.45E-08 1.26E-07 9.84E-07 03/08/97 Yes Yes 817 172 1060 C 5 H 3 0 34.5 356.45 58.45 1.81E-03 0 2.00E-07 -1.27E-08 5.35E-07 03/08/97 Yes Yes 819 172 1060 C 5 H 3 5 34.55 20.43 75.35 3.82E-03 0 1.92E-07 7.30E-08 1.28E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 10 34.6 38.38 80.61 4.42E-03 0 1.20E-07 9.72E-08 1.51E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 15 34.65 29.25 80.37 4.60E-03 0 1.42E-07 8.15E-08 1.57E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 20 34.7 25.56 81.26 4.71E-03 0 1.37E-07 6.69E-08 1.61E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 25 34.75 26.59 82.34 4.65E-03 0 1.18E-07 6.02E-08 1.60E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 30 34.8 27.57 82.51 4.68E-03 0 1.15E-07 6.12E-08 1.61E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 35 34.85 37.64 84.79 4.58E-03 0 6.99E-08 5.51E-08 1.58E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 40 34.9 31.64 83.34 4.54E-03 0 9.51E-08 5.99E-08 1.56E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 45 34.95 35.17 80.13 5.13E-03 0 1.52E-07 1.10E-07 1.75E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 50 35 31.75 79.3 5.61E-03 0 1.88E-07 1.19E-07 1.91E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 55 35.05 25.44 78.85 6.00E-03 0 2.22E-07 1.08E-07 2.04E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 60 35.1 43.41 82.66 5.62E-03 0 1.11E-07 1.07E-07 1.93E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 65 35.15 51.64 82.13 4.75E-03 0 8.56E-08 1.11E-07 1.63E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 70 35.2 22.58 79.92 4.39E-03 0 1.51E-07 6.41E-08 1.50E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 75 35.25 14.39 82.49 4.14E-03 0 1.11E-07 2.92E-08 1.42E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 80 35.3 21.45 85.07 3.72E-03 0 6.32E-08 2.54E-08 1.29E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 85 35.35 19.65 82.58 3.47E-03 0 8.94E-08 3.27E-08 1.19E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 90 35.4 355.91 79.43 3.71E-03 0 1.44E-07 -1.05E-08 1.26E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 95 35.45 17.63 81.45 3.88E-03 0 1.16E-07 3.79E-08 1.33E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 100 35.5 42.25 77.69 3.96E-03 0 1.33E-07 1.23E-07 1.34E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 105 35.55 11.07 80.25 4.27E-03 0 1.51E-07 3.02E-08 1.46E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 110 35.6 24.33 82.03 4.45E-03 0 1.19E-07 5.52E-08 1.53E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 115 35.65 41.88 82.53 4.35E-03 0 8.93E-08 8.18E-08 1.50E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 120 35.7 42.92 82.45 4.15E-03 0 8.48E-08 8.07E-08 1.43E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 125 35.75 42.65 84.19 4.12E-03 0 6.51E-08 6.13E-08 1.42E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 130 35.8 9.24 84.4 4.74E-03 0 9.69E-08 1.61E-08 1.63E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 135 35.85 0.37 79.95 6.24E-03 0 2.31E-07 1.51E-09 2.13E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 140 35.9 355.15 76.35 8.57E-03 0 4.28E-07 -3.71E-08 2.89E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 145 35.95 10.57 70.48 1.17E-02 0 8.17E-07 1.56E-07 3.83E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 150 36 71.75 85.95 1.02E-02 0 4.80E-08 1.49E-07 3.54E-06 03/08/97 Yes Yes 819 172 1060 C 5 H 3 0 34.5 5.67 52.23 7.04E-03 0 9.10E-07 9.24E-08 1.93E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 5 34.55 14.97 78.68 1.15E-02 0 4.61E-07 1.26E-07 3.89E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 10 34.6 27.59 81.74 1.10E-02 0 2.98E-07 1.59E-07 3.78E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 15 34.65 353.53 79.25 1.19E-02 0 4.66E-07 -5.40E-08 4.04E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 20 34.7 12.33 82.82 1.13E-02 0 2.93E-07 6.56E-08 3.90E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 25 34.75 48.88 84.78 9.86E-03 0 1.25E-07 1.47E-07 3.40E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 30 34.8 103.01 87.78 7.14E-03 0 -1.32E-08 5.85E-08 2.47E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 35 34.85 10.13 80.05 6.70E-03 0 2.42E-07 4.41E-08 2.29E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 40 34.9 19.15 82.91 7.54E-03 0 1.87E-07 6.63E-08 2.60E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 45 34.95 36.25 83.4 7.78E-03 0 1.53E-07 1.15E-07 2.68E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 50 35 13.64 86.36 8.25E-03 0 1.08E-07 2.68E-08 2.86E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 55 35.05 93.33 85.92 7.68E-03 0 -6.73E-09 1.18E-07 2.66E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 60 35.1 47.2 81.46 7.31E-03 0 1.56E-07 1.73E-07 2.51E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 65 35.15 16.29 78.04 8.11E-03 0 3.42E-07 1.02E-07 2.75E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 70 35.2 39.61 80.47 8.93E-03 0 2.42E-07 2.04E-07 3.05E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 75 35.25 47.16 84.38 8.57E-03 0 1.21E-07 1.34E-07 2.96E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 80 35.3 296.79 87.8 7.51E-03 0 2.75E-08 -5.58E-08 2.60E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 85 35.35 3.26 84.44 7.54E-03 0 1.55E-07 9.02E-09 2.60E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 90 35.4 38.36 81.38 8.25E-03 0 2.06E-07 1.66E-07 2.83E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 95 35.45 4.9 85.37 9.19E-03 0 1.57E-07 1.37E-08 3.18E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 100 35.5 61.49 83.69 9.50E-03 0 1.06E-07 1.99E-07 3.28E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 105 35.55 43.62 82.52 9.98E-03 0 1.99E-07 1.94E-07 3.43E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 110 35.6 42.87 81.78 1.19E-02 0 2.64E-07 2.51E-07 4.07E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 115 35.65 82.51 86.14 1.14E-02 0 2.11E-08 1.64E-07 3.93E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 120 35.7 41.95 85.75 9.37E-03 0 1.09E-07 1.01E-07 3.24E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 125 35.75 57.7 81.78 8.72E-03 0 1.41E-07 2.29E-07 2.99E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 130 35.8 39.89 82.27 8.72E-03 0 1.91E-07 1.63E-07 3.00E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 135 35.85 71.73 79.29 8.27E-03 0 1.02E-07 3.17E-07 2.82E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 140 35.9 69.82 77.87 7.33E-03 0 1.13E-07 3.14E-07 2.49E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 145 35.95 67.26 82.68 6.76E-03 0 7.06E-08 1.72E-07 2.32E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 3 150 36 149.56 72.58 4.38E-03 0 -2.40E-07 1.44E-07 1.45E-06 03/08/97 Yes Yes 821 172 1060 C 5 H 5 0 37.5 15.4 -0.3 2.54E-01 0 5.20E-05 1.47E-05 -4.61E-07 03/08/97 Yes Yes 823 172 1060 C 5 H 5 5 37.55 14.26 5.37 7.45E-02 0 1.52E-05 3.96E-06 2.41E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 10 37.6 194.78 12.75 3.16E-02 0 -6.33E-06 -1.71E-06 2.42E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 15 37.65 199.04 32.21 1.67E-02 0 -2.83E-06 -1.00E-06 3.09E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 20 37.7 25.97 35.87 3.31E-02 0 5.12E-06 2.55E-06 6.73E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 25 37.75 31.14 32.64 9.22E-02 0 1.41E-05 8.71E-06 1.72E-05 03/08/97 Yes Yes 823 172 1060 C 5 H 5 30 37.8 257.06 82.01 4.36E-02 0 -2.88E-07 -1.28E-06 1.50E-05 03/08/97 Yes Yes 823 172 1060 C 5 H 5 35 37.85 351.79 66.73 3.15E-02 0 2.61E-06 -3.86E-07 1.00E-05 03/08/97 Yes Yes 823 172 1060 C 5 H 5 40 37.9 83.13 86.5 2.86E-02 0 4.43E-08 3.76E-07 9.90E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 45 37.95 166.9 63.25 1.44E-02 0 -1.34E-06 3.20E-07 4.47E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 50 38 9.23 83.67 1.24E-02 0 2.86E-07 4.76E-08 4.27E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 55 38.05 335.99 75.84 2.36E-02 0 1.12E-06 -5.09E-07 7.92E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 60 38.1 100.43 70.97 2.21E-02 0 -2.76E-07 1.54E-06 7.24E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 65 38.15 100.04 76.33 1.28E-02 0 -1.12E-07 6.48E-07 4.32E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 70 38.2 91.46 74.52 1.08E-02 0 -1.55E-08 6.23E-07 3.60E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 75 38.25 101.99 75.13 9.63E-03 0 -1.09E-07 5.24E-07 3.23E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 80 38.3 38.91 87.9 8.83E-03 0 5.34E-08 4.41E-08 3.06E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 85 38.35 55.78 81.8 9.49E-03 0 1.61E-07 2.43E-07 3.26E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 90 38.4 80.81 76.06 9.98E-03 0 8.15E-08 5.15E-07 3.36E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 95 38.45 79.32 79.41 9.99E-03 0 7.22E-08 3.91E-07 3.41E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 100 38.5 59.96 80.89 1.11E-02 0 1.87E-07 3.31E-07 3.81E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 105 38.55 59.5 78.2 1.24E-02 0 2.73E-07 4.74E-07 4.21E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 110 38.6 56.57 78.92 1.33E-02 0 2.98E-07 4.62E-07 4.51E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 115 38.65 49.12 76.18 1.39E-02 0 4.62E-07 5.46E-07 4.69E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 120 38.7 73.8 80.92 1.39E-02 0 1.29E-07 4.55E-07 4.74E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 125 38.75 103.07 82.55 1.41E-02 0 -8.76E-08 3.86E-07 4.84E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 130 38.8 113.09 79.09 1.62E-02 0 -2.55E-07 6.11E-07 5.50E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 135 38.85 110.33 75.35 1.80E-02 0 -3.36E-07 9.28E-07 6.05E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 140 38.9 103.48 70.77 1.93E-02 0 -3.14E-07 1.34E-06 6.31E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 145 38.95 107.78 69.35 1.70E-02 0 -3.89E-07 1.24E-06 5.53E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 5 150 39 154.67 67.37 9.58E-03 0 -7.07E-07 3.42E-07 3.07E-06 03/08/97 Yes Yes 823 172 1060 C 5 H 6 0 39 35.31 67.93 6.85E-03 0 4.46E-07 3.23E-07 2.20E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 5 39.05 78.97 68.52 1.62E-02 0 2.41E-07 1.26E-06 5.23E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 10 39.1 86.11 69.78 1.89E-02 0 9.40E-08 1.42E-06 6.16E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 15 39.15 85.22 70.67 1.92E-02 0 1.12E-07 1.37E-06 6.27E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 20 39.2 80.38 68.49 1.95E-02 0 2.54E-07 1.53E-06 6.30E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 25 39.25 68.14 70.85 1.85E-02 0 4.80E-07 1.22E-06 6.06E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 30 39.3 62.45 72.22 1.77E-02 0 5.30E-07 1.04E-06 5.84E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 35 39.35 76.67 76.81 1.43E-02 0 1.60E-07 6.89E-07 4.83E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 40 39.4 72.22 81.55 1.22E-02 0 1.16E-07 3.71E-07 4.20E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 45 39.45 76.88 74.99 1.46E-02 0 1.82E-07 7.99E-07 4.89E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 50 39.5 87.24 70.81 1.68E-02 0 5.65E-08 1.20E-06 5.52E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 55 39.55 93.24 68.99 1.80E-02 0 -7.75E-08 1.40E-06 5.83E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 60 39.6 90.03 70.08 1.77E-02 0 -7.55E-10 1.31E-06 5.78E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 65 39.65 83.81 76.22 1.69E-02 0 9.19E-08 8.66E-07 5.68E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 70 39.7 65.98 76.19 1.75E-02 0 3.60E-07 8.25E-07 5.88E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 75 39.75 71.74 68.8 1.99E-02 0 4.79E-07 1.48E-06 6.44E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 80 39.8 75.94 63.93 2.08E-02 0 4.72E-07 1.93E-06 6.49E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 85 39.85 75.94 60.6 2.20E-02 0 5.56E-07 2.27E-06 6.64E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 90 39.9 77.34 62.08 2.24E-02 0 4.87E-07 2.22E-06 6.86E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 95 39.95 81.27 68.15 2.08E-02 0 2.50E-07 1.66E-06 6.71E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 100 40 76.84 63.68 2.12E-02 0 4.55E-07 1.99E-06 6.60E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 105 40.05 77.13 62.91 2.06E-02 0 4.43E-07 1.98E-06 6.35E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 110 40.1 84.74 69.95 1.78E-02 0 1.19E-07 1.32E-06 5.80E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 115 40.15 84.82 69.12 1.78E-02 0 1.21E-07 1.37E-06 5.76E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 120 40.2 87.42 70.16 1.81E-02 0 5.87E-08 1.33E-06 5.90E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 125 40.25 87.64 72.41 1.85E-02 0 4.89E-08 1.21E-06 6.12E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 130 40.3 76.51 79.22 1.84E-02 0 1.71E-07 7.27E-07 6.28E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 135 40.35 45.75 81.91 1.92E-02 0 4.01E-07 4.20E-07 6.60E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 140 40.4 84.71 75.78 2.10E-02 0 1.01E-07 1.11E-06 7.04E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 145 40.45 98.42 68.02 2.24E-02 0 -2.60E-07 1.80E-06 7.20E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 6 150 40.5 132.12 68.53 1.46E-02 0 -7.58E-07 8.57E-07 4.69E-06 03/08/97 Yes Yes 825 172 1060 C 5 H 7 0 40.5 5.44 63.49 1.01E-02 0 9.51E-07 9.26E-08 3.13E-06 03/08/97 Yes Yes 827 172 1060 C 5 H 7 5 40.55 46.46 75.25 2.00E-02 0 7.43E-07 8.00E-07 6.70E-06 03/08/97 Yes Yes 827 172 1060 C 5 H 7 10 40.6 79.38 74.84 2.41E-02 0 2.46E-07 1.34E-06 8.07E-06 03/08/97 Yes Yes 827 172 1060 C 5 H 7 15 40.65 88.13 72.49 2.59E-02 0 5.41E-08 1.69E-06 8.56E-06 03/08/97 Yes Yes 827 172 1060 C 5 H 7 20 40.7 94.68 73.04 2.71E-02 0 -1.37E-07 1.71E-06 8.99E-06 03/08/97 Yes Yes 827 172 1060 C 5 H 7 25 40.75 95.6 74.7 2.77E-02 0 -1.51E-07 1.58E-06 9.26E-06 03/08/97 Yes Yes 827 172 1060 C 5 H 7 30 40.8 93.18 74.26 2.91E-02 0 -9.27E-08 1.71E-06 9.71E-06 03/08/97 Yes Yes 827 172 1060 C 5 H 7 35 40.85 70.96 75.09 3.05E-02 0 5.43E-07 1.61E-06 1.02E-05 03/08/97 Yes Yes 827 172 1060 C 5 H 7 40 40.9 61.29 76.98 3.80E-02 0 8.72E-07 1.63E-06 1.28E-05 03/08/97 Yes Yes 827 172 1060 C 5 H 7 45 40.95 138.96 65.59 3.99E-02 0 -2.64E-06 2.35E-06 1.26E-05 03/08/97 Yes Yes 827 172 1060 C 5 H 7 50 41 120.42 59.01 2.62E-02 0 -1.45E-06 2.52E-06 7.78E-06 03/08/97 Yes Yes 827 172 1060 C 5 H 7 55 41.05 92.83 55.59 1.66E-02 0 -9.78E-08 2.03E-06 4.74E-06 03/08/97 Yes Yes 827 172 1060 C 6 H 1 0 41 330.08 55.37 4.27E-03 0 4.46E-07 -2.62E-07 1.22E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 5 41.05 6.98 72.79 1.01E-02 0 6.31E-07 7.89E-08 3.35E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 10 41.1 34.17 70.02 1.48E-02 0 8.89E-07 6.17E-07 4.83E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 15 41.15 30.36 68.29 1.80E-02 0 1.22E-06 7.31E-07 5.80E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 20 41.2 30.56 64.07 2.17E-02 0 1.73E-06 1.05E-06 6.77E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 25 41.25 34.62 66.85 2.31E-02 0 1.59E-06 1.12E-06 7.37E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 30 41.3 35.44 69.74 2.27E-02 0 1.36E-06 9.90E-07 7.39E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 35 41.35 35.89 68.92 2.33E-02 0 1.44E-06 1.07E-06 7.54E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 40 41.4 32.35 69.07 2.40E-02 0 1.53E-06 9.94E-07 7.76E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 45 41.45 24.93 70.96 2.45E-02 0 1.54E-06 7.31E-07 8.03E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 50 41.5 26.29 73.17 2.42E-02 0 1.33E-06 6.72E-07 8.02E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 55 41.55 23.8 72.38 2.27E-02 0 1.33E-06 6.00E-07 7.49E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 60 41.6 30.62 69.94 2.15E-02 0 1.35E-06 8.16E-07 7.01E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 65 41.65 35.82 67.17 2.13E-02 0 1.42E-06 1.05E-06 6.79E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 70 41.7 51.1 64.39 2.19E-02 0 1.26E-06 1.60E-06 6.83E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 75 41.75 41.23 64.56 2.75E-02 0 1.88E-06 1.69E-06 8.61E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 80 41.8 8.14 66.84 2.59E-02 0 2.14E-06 3.13E-07 8.25E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 85 41.85 31.07 61.07 2.73E-02 0 2.40E-06 1.48E-06 8.28E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 90 41.9 28.53 65.45 2.73E-02 0 2.11E-06 1.17E-06 8.61E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 95 41.95 28.1 68.12 2.68E-02 0 1.87E-06 1.02E-06 8.64E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 100 42 32.59 69.01 2.61E-02 0 1.67E-06 1.09E-06 8.45E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 105 42.05 34.98 68.16 2.58E-02 0 1.67E-06 1.19E-06 8.29E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 110 42.1 37.9 66.95 2.83E-02 0 1.85E-06 1.48E-06 9.02E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 115 42.15 35.56 69.51 2.81E-02 0 1.69E-06 1.24E-06 9.11E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 120 42.2 26.88 70.37 2.54E-02 0 1.62E-06 8.37E-07 8.30E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 125 42.25 20.66 69.48 2.38E-02 0 1.66E-06 6.38E-07 7.72E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 130 42.3 21.95 68.6 2.36E-02 0 1.69E-06 6.98E-07 7.62E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 135 42.35 23.29 70.58 2.19E-02 0 1.42E-06 6.25E-07 7.17E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 140 42.4 13.19 63.67 2.20E-02 0 2.01E-06 4.83E-07 6.83E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 145 42.45 17.52 59.46 2.29E-02 0 2.36E-06 7.60E-07 6.84E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 1 150 42.5 65.78 74.78 1.23E-02 0 2.80E-07 6.37E-07 4.11E-06 03/08/97 Yes Yes 829 172 1060 C 6 H 2 0 42.5 9.47 46.43 9.25E-03 0 1.33E-06 2.27E-07 2.32E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 5 42.55 15.44 50.48 2.05E-02 0 2.66E-06 7.52E-07 5.47E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 10 42.6 20.09 58.72 2.28E-02 0 2.36E-06 8.81E-07 6.75E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 15 42.65 24.87 61.2 2.32E-02 0 2.15E-06 1.02E-06 7.05E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 20 42.7 25.51 61.11 2.59E-02 0 2.40E-06 1.17E-06 7.88E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 25 42.75 22.43 66.7 2.44E-02 0 1.89E-06 8.00E-07 7.78E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 30 42.8 20.29 68.86 2.27E-02 0 1.63E-06 6.15E-07 7.34E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 35 42.85 38.86 76.59 1.88E-02 0 7.19E-07 5.93E-07 6.33E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 40 42.9 19.53 65.8 1.86E-02 0 1.53E-06 5.53E-07 5.88E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 45 42.95 10.83 65.18 2.15E-02 0 1.88E-06 3.67E-07 6.76E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 50 43 18.85 67.76 2.08E-02 0 1.58E-06 5.52E-07 6.68E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 55 43.05 27.84 65.95 2.05E-02 0 1.57E-06 8.48E-07 6.50E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 60 43.1 23.45 67.14 2.06E-02 0 1.56E-06 6.90E-07 6.57E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 65 43.15 28.14 72.55 1.83E-02 0 1.02E-06 5.60E-07 6.04E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 70 43.2 45.27 79.79 1.27E-02 0 3.37E-07 3.48E-07 4.34E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 75 43.25 88.37 81.86 6.60E-03 0 5.65E-09 2.03E-07 2.27E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 80 43.3 22.83 74.7 4.24E-03 0 2.19E-07 9.43E-08 1.42E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 85 43.35 21.04 54.62 6.55E-03 0 7.51E-07 2.95E-07 1.85E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 90 43.4 29.22 52.97 9.96E-03 0 1.11E-06 6.35E-07 2.76E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 95 43.45 60.94 65.68 6.47E-03 0 2.75E-07 5.05E-07 2.04E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 100 43.5 42.06 80.17 3.54E-03 0 9.53E-08 8.79E-08 1.21E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 105 43.55 37.44 67.89 3.77E-03 0 2.39E-07 1.87E-07 1.21E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 110 43.6 29.71 66.97 4.52E-03 0 3.26E-07 1.90E-07 1.44E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 115 43.65 43.7 55.73 6.45E-03 0 5.57E-07 5.44E-07 1.85E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 120 43.7 51.21 64.12 7.41E-03 0 4.30E-07 5.47E-07 2.31E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 125 43.75 10.14 71.63 6.92E-03 0 4.55E-07 8.32E-08 2.28E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 130 43.8 7.79 43.61 1.38E-02 0 2.11E-06 2.95E-07 3.31E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 135 43.85 28.59 68.85 1.23E-02 0 8.27E-07 4.61E-07 3.98E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 140 43.9 34.33 61.9 1.15E-02 0 9.50E-07 6.63E-07 3.52E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 145 43.95 34.45 60.9 1.11E-02 0 9.42E-07 6.61E-07 3.35E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 2 150 44 181.23 84.75 5.74E-03 0 -1.11E-07 -2.44E-09 1.98E-06 03/08/97 Yes Yes 831 172 1060 C 6 H 3 0 44 18.26 55.41 6.02E-03 0 6.89E-07 2.32E-07 1.72E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 5 44.05 355.74 67.91 1.16E-02 0 9.25E-07 -7.05E-08 3.74E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 10 44.1 26 77.05 1.27E-02 0 5.42E-07 2.70E-07 4.28E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 15 44.15 33.76 68.56 1.40E-02 0 9.05E-07 6.18E-07 4.53E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 20 44.2 14.71 53.59 2.24E-02 0 2.72E-06 7.31E-07 6.24E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 25 44.25 39.6 68.37 2.23E-02 0 1.34E-06 1.14E-06 7.19E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 30 44.3 108.23 68.93 1.57E-02 0 -3.75E-07 1.16E-06 5.08E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 35 44.35 277.16 21.98 7.31E-02 0 1.79E-06 -1.46E-05 9.49E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 40 44.4 349.63 74.41 4.94E-02 0 2.77E-06 -5.18E-07 1.65E-05 03/08/97 Yes Yes 833 172 1060 C 6 H 3 45 44.45 80.24 47.86 2.36E-02 0 5.69E-07 3.38E-06 6.07E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 50 44.5 43.53 73.64 1.08E-02 0 4.67E-07 4.54E-07 3.59E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 55 44.55 34.99 72.17 9.70E-03 0 5.16E-07 3.69E-07 3.20E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 60 44.6 50.98 66.84 9.03E-03 0 4.74E-07 5.98E-07 2.88E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 65 44.65 24.4 71.57 7.75E-03 0 4.73E-07 2.20E-07 2.55E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 70 44.7 32.13 67.81 7.34E-03 0 4.98E-07 3.20E-07 2.36E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 75 44.75 42.94 65.32 6.87E-03 0 4.45E-07 4.24E-07 2.16E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 80 44.8 33.03 64.39 6.12E-03 0 4.70E-07 3.13E-07 1.91E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 85 44.85 33.19 60.46 6.25E-03 0 5.47E-07 3.66E-07 1.89E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 90 44.9 38.23 54.71 6.46E-03 0 6.22E-07 5.01E-07 1.83E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 95 44.95 41.07 56.71 6.12E-03 0 5.37E-07 4.79E-07 1.77E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 100 45 43.57 63.84 4.76E-03 0 3.22E-07 3.13E-07 1.48E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 105 45.05 11.15 63.82 4.40E-03 0 4.04E-07 8.15E-08 1.37E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 110 45.1 39.17 59.39 4.93E-03 0 4.13E-07 3.44E-07 1.47E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 115 45.15 40.19 54.5 4.98E-03 0 4.69E-07 4.05E-07 1.41E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 120 45.2 35.26 54.45 5.18E-03 0 5.21E-07 3.77E-07 1.46E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 125 45.25 29.09 59.88 4.84E-03 0 4.51E-07 2.56E-07 1.45E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 130 45.3 27.31 65.95 4.65E-03 0 3.57E-07 1.89E-07 1.47E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 135 45.35 301.18 76.43 4.59E-03 0 1.18E-07 -2.00E-07 1.55E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 140 45.4 61.21 62.71 9.38E-03 0 4.39E-07 8.17E-07 2.89E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 145 45.45 64.18 36.39 3.39E-02 0 2.52E-06 5.33E-06 6.97E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 3 150 45.5 0.85 71.73 2.42E-02 0 1.61E-06 2.45E-08 7.97E-06 03/08/97 Yes Yes 833 172 1060 C 6 H 4 0 45.5 352.17 64.29 3.89E-02 0 3.55E-06 -4.99E-07 1.22E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 5 45.55 340.1 40.64 1.89E-01 0 2.85E-05 -1.06E-05 4.26E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 10 45.6 335.18 47.31 2.72E-01 0 3.55E-05 -1.68E-05 6.93E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 15 45.65 26.74 70.5 1.76E-01 0 1.11E-05 5.74E-06 5.76E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 20 45.7 327.87 68.53 1.60E-01 0 1.05E-05 -6.76E-06 5.17E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 25 45.75 34.82 77.84 1.81E-01 0 6.63E-06 4.71E-06 6.12E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 30 45.8 67.94 74.76 1.04E-01 0 2.18E-06 5.50E-06 3.48E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 35 45.85 51.5 68.65 7.77E-02 0 3.74E-06 4.80E-06 2.51E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 40 45.9 84.97 59.97 5.76E-02 0 5.36E-07 6.23E-06 1.73E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 45 45.95 26.31 58.07 7.95E-02 0 7.99E-06 4.04E-06 2.34E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 50 46 75.05 61.92 8.00E-02 0 2.06E-06 7.89E-06 2.45E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 55 46.05 76.74 72.49 6.79E-02 0 9.93E-07 4.31E-06 2.24E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 60 46.1 62.76 56.23 1.26E-01 0 6.80E-06 1.35E-05 3.63E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 65 46.15 76.19 54.44 2.18E-01 0 6.43E-06 2.67E-05 6.16E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 70 46.2 316.24 51.64 3.49E-01 0 3.32E-05 -3.25E-05 9.49E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 75 46.25 292.21 39.76 9.65E-01 0 5.95E-05 -1.49E-04 2.14E-04 03/08/97 Yes Yes 835 172 1060 C 6 H 4 80 46.3 74.64 60.75 5.49E-01 0 1.51E-05 5.61E-05 1.66E-04 03/08/97 Yes Yes 835 172 1060 C 6 H 4 85 46.35 110.45 43.11 1.73E-01 0 -9.37E-06 2.57E-05 4.11E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 90 46.4 197.03 55.38 5.00E-02 0 -5.76E-06 -1.81E-06 1.43E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 95 46.45 289.97 48.39 1.62E-01 0 7.80E-06 -2.20E-05 4.20E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 100 46.5 292.11 47.06 4.45E-01 0 2.42E-05 -6.09E-05 1.13E-04 03/08/97 Yes Yes 835 172 1060 C 6 H 4 105 46.55 326.26 51.42 5.48E-01 0 6.03E-05 -4.12E-05 1.49E-04 03/08/97 Yes Yes 835 172 1060 C 6 H 4 110 46.6 296.73 59.01 6.65E-01 0 3.27E-05 -6.63E-05 1.98E-04 03/08/97 Yes Yes 835 172 1060 C 6 H 4 115 46.65 310.7 62.75 5.36E-01 0 3.39E-05 -4.04E-05 1.65E-04 03/08/97 Yes Yes 835 172 1060 C 6 H 4 120 46.7 0.26 84.96 4.17E-01 0 7.76E-06 3.62E-08 1.44E-04 03/08/97 Yes Yes 835 172 1060 C 6 H 4 125 46.75 98.98 42.02 1.75E-01 0 -4.31E-06 2.79E-05 4.06E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 130 46.8 280.27 9.04 1.15E-01 0 4.31E-06 -2.43E-05 6.28E-06 03/08/97 Yes Yes 835 172 1060 C 6 H 4 135 46.85 291.24 26.21 9.20E-02 0 6.35E-06 -1.67E-05 1.41E-05 03/08/97 Yes Yes 835 172 1060 C 6 H 4 140 46.9 72.92 57.3 2.49E-02 0 8.40E-07 2.79E-06 7.28E-06 03/08/97 Yes Yes 835 172 1060 C 6 H 4 145 46.95 9.06 75.86 1.15E-02 0 5.91E-07 9.63E-08 3.88E-06 03/08/97 Yes Yes 835 172 1060 C 6 H 4 150 47 251.88 39.74 6.68E-03 0 -3.39E-07 -1.06E-06 1.48E-06 03/08/97 Yes Yes 835 172 1060 C 6 H 5 0 47 306.13 82.84 2.10E-03 0 3.28E-08 -4.59E-08 7.23E-07 03/08/97 Yes Yes 837 172 1060 C 6 H 5 5 47.05 112.72 82.82 5.90E-03 0 -6.04E-08 1.48E-07 2.03E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 10 47.1 22.78 87.03 1.10E-02 0 1.12E-07 4.81E-08 3.82E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 15 47.15 8.13 47.03 4.37E-02 0 6.26E-06 9.14E-07 1.11E-05 03/08/97 Yes Yes 837 172 1060 C 6 H 5 20 47.2 19.8 62.32 5.26E-02 0 4.88E-06 1.80E-06 1.62E-05 03/08/97 Yes Yes 837 172 1060 C 6 H 5 25 47.25 87.56 27.46 6.35E-02 0 5.09E-07 1.22E-05 1.01E-05 03/08/97 Yes Yes 837 172 1060 C 6 H 5 30 47.3 5.93 66.81 4.98E-02 0 4.14E-06 4.40E-07 1.59E-05 03/08/97 Yes Yes 837 172 1060 C 6 H 5 35 47.35 303.14 72.27 3.75E-02 0 1.32E-06 -2.07E-06 1.24E-05 03/08/97 Yes Yes 837 172 1060 C 6 H 5 40 47.4 334.54 37.92 7.51E-02 0 1.13E-05 -5.52E-06 1.60E-05 03/08/97 Yes Yes 837 172 1060 C 6 H 5 45 47.45 342.58 45.99 6.58E-02 0 9.25E-06 -2.97E-06 1.64E-05 03/08/97 Yes Yes 837 172 1060 C 6 H 5 50 47.5 118.73 71.66 2.03E-02 0 -6.52E-07 1.22E-06 6.69E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 55 47.55 126.21 74.69 9.33E-03 0 -3.09E-07 4.31E-07 3.12E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 60 47.6 15.41 47.18 2.44E-02 0 3.39E-06 9.56E-07 6.21E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 65 47.65 56.19 65.24 2.14E-02 0 1.06E-06 1.62E-06 6.74E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 70 47.7 143.07 85.85 8.00E-03 0 -9.82E-08 7.55E-08 2.77E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 75 47.75 282.8 82.07 4.38E-03 0 2.84E-08 -1.28E-07 1.50E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 80 47.8 346.05 79.45 5.00E-03 0 1.89E-07 -4.79E-08 1.71E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 85 47.85 28.66 75.39 6.63E-03 0 3.11E-07 1.74E-07 2.22E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 90 47.9 12.76 53.05 7.00E-03 0 8.71E-07 2.02E-07 1.94E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 95 47.95 24.53 40.88 9.91E-03 0 1.45E-06 6.74E-07 2.25E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 100 48 14.28 59.67 1.12E-02 0 1.16E-06 3.02E-07 3.35E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 105 48.05 347.39 72.87 7.63E-03 0 4.65E-07 -1.06E-07 2.53E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 110 48.1 27.59 59.82 1.25E-02 0 1.18E-06 6.32E-07 3.75E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 115 48.15 34.66 68.51 1.40E-02 0 8.98E-07 6.35E-07 4.53E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 120 48.2 27.29 81.1 7.99E-03 0 2.33E-07 1.23E-07 2.74E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 125 48.25 313.42 37.22 1.34E-02 0 1.56E-06 -1.68E-06 2.81E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 130 48.3 7.68 76.37 1.17E-02 0 5.78E-07 7.97E-08 3.93E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 135 48.35 50.21 72.25 8.46E-03 0 3.50E-07 4.30E-07 2.79E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 140 48.4 11.5 64.74 6.12E-03 0 5.43E-07 1.13E-07 1.92E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 145 48.45 352.93 59.23 5.43E-03 0 5.85E-07 -7.42E-08 1.62E-06 03/08/97 Yes Yes 837 172 1060 C 6 H 5 150 48.5 72.73 68.7 3.07E-03 0 7.03E-08 2.31E-07 9.93E-07 03/08/97 Yes Yes 837 172 1060 C 6 H 6 0 48.5 322.58 47.93 2.59E-03 0 2.93E-07 -2.29E-07 6.68E-07 03/08/97 Yes Yes 839 172 1060 C 6 H 6 5 48.55 18.52 56.72 5.64E-03 0 6.22E-07 2.13E-07 1.63E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 10 48.6 23.52 63.57 6.03E-03 0 5.23E-07 2.33E-07 1.87E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 15 48.65 359.33 67.2 6.19E-03 0 5.09E-07 -6.07E-09 1.98E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 20 48.7 14.11 68.33 6.44E-03 0 4.89E-07 1.26E-07 2.07E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 25 48.75 28.51 64.69 5.38E-03 0 4.28E-07 2.38E-07 1.68E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 30 48.8 6.23 65.03 5.33E-03 0 4.75E-07 5.30E-08 1.68E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 35 48.85 34.12 59.03 5.10E-03 0 4.61E-07 3.19E-07 1.51E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 40 48.9 29.04 58.55 4.49E-03 0 4.34E-07 2.47E-07 1.33E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 45 48.95 34.19 56.62 4.38E-03 0 4.23E-07 2.94E-07 1.27E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 50 49 26.14 61.52 4.10E-03 0 3.72E-07 1.87E-07 1.25E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 55 49.05 19.92 61.58 4.06E-03 0 3.85E-07 1.43E-07 1.24E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 60 49.1 20.95 59.19 4.57E-03 0 4.64E-07 1.82E-07 1.36E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 65 49.15 27.61 59.02 4.65E-03 0 4.50E-07 2.41E-07 1.38E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 70 49.2 30.52 59.2 4.28E-03 0 4.01E-07 2.42E-07 1.28E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 75 49.25 22.75 60.67 3.93E-03 0 3.77E-07 1.61E-07 1.19E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 80 49.3 23.04 58.43 3.98E-03 0 4.06E-07 1.77E-07 1.17E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 85 49.35 23.36 57.1 3.79E-03 0 4.00E-07 1.77E-07 1.10E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 90 49.4 21.83 56.51 3.72E-03 0 4.05E-07 1.66E-07 1.08E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 95 49.45 24.74 58.45 3.39E-03 0 3.42E-07 1.61E-07 1.00E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 100 49.5 23.71 56.55 3.34E-03 0 3.57E-07 1.60E-07 9.65E-07 03/08/97 Yes Yes 839 172 1060 C 6 H 6 105 49.55 24.71 52.85 3.85E-03 0 4.48E-07 2.11E-07 1.06E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 110 49.6 24.44 55.29 3.99E-03 0 4.38E-07 2.04E-07 1.14E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 115 49.65 23.08 56.17 3.89E-03 0 4.23E-07 1.84E-07 1.12E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 120 49.7 26.65 53.7 4.09E-03 0 4.59E-07 2.35E-07 1.14E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 125 49.75 23.93 55.32 4.01E-03 0 4.43E-07 2.01E-07 1.14E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 130 49.8 44.54 43.03 4.35E-03 0 4.81E-07 4.84E-07 1.03E-06 03/08/97 Yes Yes 839 172 1060 C 6 H 6 135 49.85 44.53 30.65 3.35E-03 0 4.36E-07 4.39E-07 5.93E-07 03/08/97 Yes Yes 839 172 1060 C 6 H 6 140 49.9 352.29 55.13 3.07E-03 0 3.69E-07 -5.10E-08 8.72E-07 03/08/97 Yes Yes 839 172 1060 C 6 H 6 145 49.95 20.69 51.82 3.37E-03 0 4.14E-07 1.60E-07 9.20E-07 03/08/97 Yes Yes 839 172 1060 C 6 H 6 150 50 38.04 55.38 2.22E-03 0 2.11E-07 1.69E-07 6.34E-07 03/08/97 Yes Yes 839 172 1060 C 6 H 7 0 50 0.78 32.93 1.47E-03 0 2.62E-07 3.62E-09 2.77E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 5 50.05 14.51 40.9 2.64E-03 0 4.10E-07 1.09E-07 6.00E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 10 50.1 27.25 54.99 1.95E-03 0 2.11E-07 1.11E-07 5.55E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 15 50.15 15.19 70.18 1.46E-03 0 1.01E-07 2.81E-08 4.75E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 20 50.2 5.83 69.15 1.50E-03 0 1.12E-07 1.17E-08 4.85E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 25 50.25 18.96 62.84 1.67E-03 0 1.53E-07 5.39E-08 5.17E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 30 50.3 22.66 52.8 2.00E-03 0 2.36E-07 1.01E-07 5.51E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 35 50.35 22.61 49.97 2.28E-03 0 2.87E-07 1.22E-07 6.05E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 40 50.4 25.7 52.42 2.42E-03 0 2.82E-07 1.39E-07 6.65E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 45 50.45 23.53 51.02 3.10E-03 0 3.79E-07 1.69E-07 8.34E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 50 50.5 29.45 62.42 3.98E-03 0 3.40E-07 1.97E-07 1.22E-06 03/08/97 Yes Yes 841 172 1060 C 6 H 7 55 50.55 62.75 66.37 3.10E-03 0 1.21E-07 2.40E-07 9.85E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 60 50.6 16.98 54.77 2.03E-03 0 2.38E-07 7.43E-08 5.76E-07 03/08/97 Yes Yes 841 172 1060 C 6 H 7 65 50.65 340.43 59.8 9.01E-04 0 9.06E-08 -3.29E-08 2.70E-07 03/08/97 Yes Yes 841 172 1060 C 7 H 1 0 50.5 12.46 36.2 5.66E-04 0 9.45E-08 2.14E-08 1.16E-07 03/08/97 Yes Yes 843 172 1060 C 7 H 1 5 50.55 331.66 40.84 1.95E-03 0 2.76E-07 -1.52E-07 4.43E-07 03/08/97 Yes Yes 843 172 1060 C 7 H 1 10 50.6 319.47 59.64 2.85E-03 0 2.33E-07 -2.03E-07 8.54E-07 03/08/97 Yes Yes 843 172 1060 C 7 H 1 15 50.65 17.96 71.36 3.06E-03 0 1.98E-07 6.55E-08 1.01E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 20 50.7 29.15 81.36 2.77E-03 0 7.70E-08 4.39E-08 9.49E-07 03/08/97 Yes Yes 843 172 1060 C 7 H 1 25 50.75 303.64 83.08 3.28E-03 0 4.64E-08 -7.13E-08 1.13E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 30 50.8 123.4 81.69 3.81E-03 0 -6.44E-08 9.98E-08 1.31E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 35 50.85 62.72 74.59 3.78E-03 0 9.76E-08 1.93E-07 1.26E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 40 50.9 53.03 66.07 3.74E-03 0 1.94E-07 2.63E-07 1.19E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 45 50.95 59.25 61.56 3.84E-03 0 1.98E-07 3.41E-07 1.17E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 50 51 85.45 66.83 3.10E-03 0 2.05E-08 2.64E-07 9.87E-07 03/08/97 Yes Yes 843 172 1060 C 7 H 1 55 51.05 108.51 84.96 1.64E-03 0 -9.72E-09 2.97E-08 5.67E-07 03/08/97 Yes Yes 843 172 1060 C 7 H 1 60 51.1 36.68 62.94 2.80E-03 0 2.16E-07 1.65E-07 8.64E-07 03/08/97 Yes Yes 843 172 1060 C 7 H 1 65 51.15 61.85 64.97 3.62E-03 0 1.53E-07 2.93E-07 1.14E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 70 51.2 69.32 59.09 4.02E-03 0 1.55E-07 4.19E-07 1.19E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 75 51.25 65.02 58.32 4.44E-03 0 2.09E-07 4.58E-07 1.31E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 80 51.3 61.61 65.55 4.21E-03 0 1.76E-07 3.33E-07 1.33E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 85 51.35 61.14 65.01 4.29E-03 0 1.86E-07 3.44E-07 1.35E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 90 51.4 66.71 63.54 4.58E-03 0 1.71E-07 4.07E-07 1.42E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 95 51.45 69.62 63.61 4.69E-03 0 1.54E-07 4.24E-07 1.46E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 100 51.5 64.5 64.58 4.84E-03 0 1.90E-07 4.07E-07 1.51E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 105 51.55 65.22 61.44 5.14E-03 0 2.19E-07 4.84E-07 1.57E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 110 51.6 66.43 67.07 5.10E-03 0 1.69E-07 3.95E-07 1.63E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 115 51.65 81.38 66.55 5.15E-03 0 6.51E-08 4.39E-07 1.64E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 120 51.7 64.39 48.26 7.60E-03 0 4.64E-07 9.90E-07 1.97E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 125 51.75 25.32 45.22 1.15E-02 0 1.55E-06 7.50E-07 2.83E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 130 51.8 273.85 43.91 1.44E-02 0 1.48E-07 -2.25E-06 3.46E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 135 51.85 87.47 57.68 7.61E-03 0 3.81E-08 8.82E-07 2.23E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 140 51.9 54.75 63.94 4.96E-03 0 2.67E-07 3.86E-07 1.54E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 145 51.95 40.01 69.29 5.20E-03 0 2.99E-07 2.56E-07 1.68E-06 03/08/97 Yes Yes 843 172 1060 C 7 H 1 150 52 105.06 55.43 3.02E-03 0 -9.44E-08 3.59E-07 8.62E-07 03/08/97 Yes Yes 843 172 1060 C 7 H 2 0 52 223 48.5 3.25E-03 0 -3.34E-07 -3.19E-07 8.44E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 5 52.05 324.21 32.91 1.94E-02 0 2.81E-06 -2.07E-06 3.66E-06 03/08/97 Yes Yes 845 172 1060 C 7 H 2 10 52.1 43.49 44.32 3.44E-02 0 3.79E-06 3.67E-06 8.33E-06 03/08/97 Yes Yes 845 172 1060 C 7 H 2 15 52.15 48.39 43.4 3.33E-02 0 3.41E-06 3.92E-06 7.93E-06 03/08/97 Yes Yes 845 172 1060 C 7 H 2 20 52.2 24.43 77.31 2.88E-02 0 1.22E-06 5.67E-07 9.74E-06 03/08/97 Yes Yes 845 172 1060 C 7 H 2 25 52.25 196.46 64.84 9.88E-03 0 -8.55E-07 -2.58E-07 3.10E-06 03/08/97 Yes Yes 845 172 1060 C 7 H 2 30 52.3 355.91 32.45 9.87E-03 0 1.76E-06 -1.29E-07 1.84E-06 03/08/97 Yes Yes 845 172 1060 C 7 H 2 35 52.35 1.84 59.7 8.29E-03 0 8.87E-07 2.92E-08 2.48E-06 03/08/97 Yes Yes 845 172 1060 C 7 H 2 40 52.4 145.26 55.9 3.85E-03 0 -3.76E-07 2.67E-07 1.11E-06 03/08/97 Yes Yes 845 172 1060 C 7 H 2 45 52.45 75.31 68.47 2.11E-03 0 4.17E-08 1.63E-07 6.81E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 50 52.5 73.87 62.79 2.14E-03 0 5.77E-08 2.04E-07 6.60E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 55 52.55 82.25 65.4 1.80E-03 0 2.14E-08 1.61E-07 5.68E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 60 52.6 68.87 68.91 1.77E-03 0 4.87E-08 1.29E-07 5.72E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 65 52.65 305.89 32.26 3.95E-03 0 4.16E-07 -5.87E-07 7.31E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 70 52.7 336.73 59.85 4.68E-03 0 4.58E-07 -2.01E-07 1.40E-06 03/08/97 Yes Yes 845 172 1060 C 7 H 2 75 52.75 98.83 51.24 2.84E-03 0 -5.78E-08 3.81E-07 7.67E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 80 52.8 85.43 70.38 1.53E-03 0 8.67E-09 1.11E-07 4.99E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 85 52.85 57.33 69.14 1.38E-03 0 5.62E-08 8.96E-08 4.46E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 90 52.9 49.12 72.48 1.33E-03 0 5.54E-08 6.54E-08 4.38E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 95 52.95 40.01 73.35 1.35E-03 0 6.28E-08 5.39E-08 4.48E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 100 53 51.64 72.36 1.33E-03 0 5.31E-08 6.87E-08 4.40E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 105 53.05 51.03 72.18 1.32E-03 0 5.40E-08 6.83E-08 4.37E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 110 53.1 12.63 75.72 1.35E-03 0 6.88E-08 1.58E-08 4.53E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 115 53.15 58.03 70.14 1.45E-03 0 5.53E-08 9.06E-08 4.73E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 120 53.2 64.76 75.64 1.25E-03 0 2.81E-08 6.08E-08 4.20E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 125 53.25 43.89 78.56 1.16E-03 0 3.51E-08 3.45E-08 3.93E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 130 53.3 55.17 77.26 1.11E-03 0 2.97E-08 4.37E-08 3.76E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 135 53.35 46.02 71.58 1.14E-03 0 5.30E-08 5.62E-08 3.75E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 140 53.4 40.94 71.86 1.13E-03 0 5.61E-08 4.98E-08 3.71E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 145 53.45 63.81 75.96 9.10E-04 0 2.07E-08 4.30E-08 3.06E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 2 150 53.5 145.39 71.69 4.63E-04 0 -2.54E-08 1.79E-08 1.52E-07 03/08/97 Yes Yes 845 172 1060 C 7 H 3 0 53.5 352.27 62.54 4.82E-04 0 4.67E-08 -6.49E-09 1.48E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 5 53.55 18.96 71.78 1.09E-03 0 6.84E-08 2.40E-08 3.59E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 10 53.6 35.44 63.63 1.49E-03 0 1.15E-07 8.34E-08 4.64E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 15 53.65 24.08 77.75 1.60E-03 0 6.58E-08 3.01E-08 5.43E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 20 53.7 33.76 83.79 1.25E-03 0 2.38E-08 1.63E-08 4.31E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 25 53.75 7.22 81.79 1.11E-03 0 3.34E-08 4.33E-09 3.82E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 30 53.8 359.96 81.88 1.10E-03 0 3.29E-08 -2.51E-11 3.77E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 35 53.85 22.01 75.62 1.14E-03 0 5.57E-08 2.30E-08 3.83E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 40 53.9 12.17 69.22 1.30E-03 0 9.54E-08 2.10E-08 4.20E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 45 53.95 350.6 81.24 1.51E-03 0 4.83E-08 -8.17E-09 5.19E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 50 54 99.82 69.9 1.36E-03 0 -1.69E-08 9.97E-08 4.42E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 55 54.05 31.18 72.67 1.16E-03 0 6.26E-08 3.88E-08 3.84E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 60 54.1 28.73 75.68 1.28E-03 0 5.90E-08 3.31E-08 4.31E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 65 54.15 52.53 80.33 1.18E-03 0 2.55E-08 3.41E-08 4.03E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 70 54.2 41.4 76.24 1.15E-03 0 4.34E-08 3.91E-08 3.86E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 75 54.25 41 75.96 1.17E-03 0 4.56E-08 4.06E-08 3.95E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 80 54.3 33.65 70.68 1.31E-03 0 7.66E-08 5.22E-08 4.29E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 85 54.35 36.49 76.09 1.52E-03 0 6.24E-08 4.72E-08 5.12E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 90 54.4 81.67 84.69 1.30E-03 0 3.71E-09 2.59E-08 4.50E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 95 54.45 18.21 78.49 1.21E-03 0 4.87E-08 1.64E-08 4.12E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 100 54.5 37.82 77.02 1.31E-03 0 4.95E-08 3.93E-08 4.44E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 105 54.55 47.14 74.04 1.25E-03 0 4.97E-08 5.48E-08 4.18E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 110 54.6 53.28 78.91 1.19E-03 0 2.90E-08 3.97E-08 4.04E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 115 54.65 47.18 75.56 1.11E-03 0 3.98E-08 4.39E-08 3.71E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 120 54.7 58.12 75.71 1.06E-03 0 2.94E-08 4.83E-08 3.57E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 125 54.75 40.93 74.32 9.75E-04 0 4.22E-08 3.74E-08 3.25E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 130 54.8 33.04 72.92 1.03E-03 0 5.36E-08 3.56E-08 3.40E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 135 54.85 31.55 78.8 1.07E-03 0 3.77E-08 2.37E-08 3.65E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 140 54.9 29.83 71.08 1.29E-03 0 7.69E-08 4.51E-08 4.23E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 145 54.95 16.12 67 1.76E-03 0 1.40E-07 4.14E-08 5.61E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 3 150 55 119.35 80.38 1.28E-03 0 -2.23E-08 4.06E-08 4.39E-07 03/08/97 Yes Yes 847 172 1060 C 7 H 4 0 55 5.97 53.74 9.26E-04 0 1.16E-07 1.23E-08 2.59E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 5 55.05 30.64 71.2 1.69E-03 0 9.94E-08 6.02E-08 5.55E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 10 55.1 37.64 83.84 1.33E-03 0 2.40E-08 1.89E-08 4.59E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 15 55.15 7.28 83.93 1.12E-03 0 2.49E-08 3.26E-09 3.87E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 20 55.2 10.99 83.93 1.12E-03 0 2.46E-08 4.88E-09 3.85E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 25 55.25 51.06 68.4 1.21E-03 0 5.94E-08 7.52E-08 3.90E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 30 55.3 62.78 66.84 1.20E-03 0 4.58E-08 9.11E-08 3.83E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 35 55.35 10.95 78.75 1.17E-03 0 4.76E-08 9.42E-09 3.99E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 40 55.4 25.06 83.9 1.18E-03 0 2.40E-08 1.15E-08 4.06E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 45 55.45 61.02 78.54 1.13E-03 0 2.30E-08 4.25E-08 3.83E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 50 55.5 57 75.74 1.10E-03 0 3.13E-08 4.93E-08 3.69E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 55 55.55 81.86 77.83 1.17E-03 0 7.42E-09 5.30E-08 3.97E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 60 55.6 74.06 81.72 1.38E-03 0 1.16E-08 4.15E-08 4.74E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 65 55.65 11.34 33.48 4.51E-03 0 7.83E-07 1.61E-07 8.64E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 70 55.7 196.07 82.93 5.09E-03 0 -1.28E-07 -3.76E-08 1.75E-06 03/08/97 Yes Yes 849 172 1060 C 7 H 4 75 55.75 189.71 43.9 2.95E-03 0 -4.45E-07 -7.78E-08 7.10E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 80 55.8 28.44 71.14 1.32E-03 0 7.95E-08 4.40E-08 4.32E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 85 55.85 38.27 70.62 1.22E-03 0 6.74E-08 5.44E-08 3.99E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 90 55.9 53.65 73.29 1.16E-03 0 4.21E-08 5.85E-08 3.87E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 95 55.95 44.27 74.63 1.14E-03 0 4.60E-08 4.58E-08 3.82E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 100 56 45.17 71.2 1.35E-03 0 6.49E-08 6.68E-08 4.42E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 105 56.05 34.76 81.92 1.45E-03 0 3.56E-08 2.53E-08 4.99E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 110 56.1 354.09 84.67 1.60E-03 0 3.14E-08 -3.32E-09 5.53E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 115 56.15 87.79 72.09 1.69E-03 0 4.24E-09 1.12E-07 5.56E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 120 56.2 3.03 76.11 1.77E-03 0 8.98E-08 4.86E-09 5.94E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 125 56.25 0.2 73.06 2.21E-03 0 1.37E-07 4.76E-10 7.34E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 130 56.3 76.38 67.01 1.82E-03 0 3.55E-08 1.50E-07 5.81E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 135 56.35 45.74 84.16 1.47E-03 0 2.22E-08 2.33E-08 5.07E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 140 56.4 65.99 73.7 1.46E-03 0 3.55E-08 8.15E-08 4.87E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 145 56.45 335.99 79.68 1.61E-03 0 5.57E-08 -2.54E-08 5.48E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 4 150 56.5 99.26 65.79 1.06E-03 0 -1.48E-08 9.28E-08 3.34E-07 03/08/97 Yes Yes 849 172 1060 C 7 H 5 0 56.5 5.15 51.57 5.62E-04 0 7.38E-08 6.81E-09 1.53E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 5 56.55 14.47 72.04 1.09E-03 0 6.89E-08 1.82E-08 3.59E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 10 56.6 47.25 76.96 1.11E-03 0 3.59E-08 3.98E-08 3.74E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 15 56.65 41.66 73.25 1.08E-03 0 4.94E-08 4.49E-08 3.59E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 20 56.7 43.14 69.35 1.10E-03 0 6.01E-08 5.76E-08 3.57E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 25 56.75 44.19 70.78 1.16E-03 0 5.81E-08 5.77E-08 3.80E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 30 56.8 43.79 69.91 1.16E-03 0 6.12E-08 6.00E-08 3.79E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 35 56.85 40.91 70.31 1.21E-03 0 6.51E-08 5.77E-08 3.94E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 40 56.9 46.3 70.39 1.17E-03 0 5.76E-08 6.16E-08 3.82E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 45 56.95 30.43 72.77 1.15E-03 0 6.26E-08 3.76E-08 3.82E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 50 57 34.61 73.19 1.16E-03 0 5.87E-08 4.14E-08 3.86E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 55 57.05 37.96 73.15 1.18E-03 0 5.74E-08 4.58E-08 3.93E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 60 57.1 37.91 72.9 1.20E-03 0 5.90E-08 4.70E-08 3.97E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 65 57.15 42.56 69.43 1.30E-03 0 7.13E-08 6.70E-08 4.22E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 70 57.2 36.26 68.99 1.49E-03 0 9.13E-08 6.85E-08 4.82E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 75 57.25 16.39 82.46 1.51E-03 0 4.03E-08 1.21E-08 5.18E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 80 57.3 351.01 81.32 1.41E-03 0 4.47E-08 -7.23E-09 4.84E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 85 57.35 22.47 79.62 1.50E-03 0 5.31E-08 2.24E-08 5.12E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 90 57.4 41.75 75.29 1.41E-03 0 5.68E-08 5.19E-08 4.74E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 95 57.45 49.42 79.05 1.30E-03 0 3.42E-08 4.08E-08 4.44E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 100 57.5 67.8 80.46 9.99E-04 0 1.33E-08 3.32E-08 3.42E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 105 57.55 26.73 78.29 8.97E-04 0 3.45E-08 1.78E-08 3.05E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 110 57.6 20.69 78.79 7.94E-04 0 3.06E-08 1.18E-08 2.70E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 115 57.65 35.55 75.79 7.75E-04 0 3.28E-08 2.40E-08 2.60E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 120 57.7 12.2 73.04 8.96E-04 0 5.42E-08 1.20E-08 2.97E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 125 57.75 41.54 76.33 9.64E-04 0 3.62E-08 3.28E-08 3.25E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 130 57.8 44.95 78.82 8.46E-04 0 2.46E-08 2.51E-08 2.88E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 135 57.85 46.7 76.96 7.80E-04 0 2.56E-08 2.78E-08 2.64E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 140 57.9 31.87 67.51 8.76E-04 0 6.04E-08 3.84E-08 2.81E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 145 57.95 10.06 67.75 9.98E-04 0 7.89E-08 1.43E-08 3.20E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 5 150 58 119.31 78.78 6.62E-04 0 -1.34E-08 2.44E-08 2.25E-07 03/08/97 Yes Yes 851 172 1060 C 7 H 6 0 58 17.15 55.07 4.71E-04 0 5.47E-08 1.73E-08 1.34E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 5 58.05 21.67 69.65 1.05E-03 0 7.19E-08 2.92E-08 3.41E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 10 58.1 52.03 81.18 1.07E-03 0 2.14E-08 2.80E-08 3.66E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 15 58.15 51.89 77.21 1.05E-03 0 3.03E-08 3.95E-08 3.54E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 20 58.2 17.97 75.8 1.08E-03 0 5.35E-08 1.77E-08 3.63E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 25 58.25 22.44 73.76 1.23E-03 0 6.76E-08 2.85E-08 4.10E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 30 58.3 13.87 78.62 1.24E-03 0 5.04E-08 1.27E-08 4.21E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 35 58.35 24.29 80.61 1.16E-03 0 3.66E-08 1.69E-08 3.96E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 40 58.4 18.18 75.18 1.15E-03 0 5.91E-08 1.98E-08 3.84E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 45 58.45 26.13 78.78 1.18E-03 0 4.35E-08 2.18E-08 4.00E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 50 58.5 32.45 80.06 1.13E-03 0 3.49E-08 2.27E-08 3.86E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 55 58.55 31.08 75.96 1.16E-03 0 5.11E-08 3.15E-08 3.90E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 60 58.6 25.14 78.83 1.19E-03 0 4.43E-08 2.13E-08 4.05E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 65 58.65 13.63 75.81 1.21E-03 0 6.11E-08 1.51E-08 4.06E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 70 58.7 39.86 75.62 1.31E-03 0 5.29E-08 4.52E-08 4.39E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 75 58.75 26.24 78.24 1.27E-03 0 4.92E-08 2.48E-08 4.31E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 80 58.8 353.47 70.76 1.27E-03 0 8.79E-08 -1.03E-08 4.14E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 85 58.85 21.37 71.21 1.33E-03 0 8.48E-08 3.39E-08 4.37E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 90 58.9 20.92 75.62 1.29E-03 0 6.36E-08 2.49E-08 4.34E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 95 58.95 33.04 75.77 1.31E-03 0 5.75E-08 3.82E-08 4.42E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 100 59 22.6 79.45 1.24E-03 0 4.44E-08 1.89E-08 4.22E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 105 59.05 15.92 76.97 1.26E-03 0 5.78E-08 1.69E-08 4.25E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 110 59.1 6.29 75.15 1.32E-03 0 7.15E-08 8.06E-09 4.43E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 115 59.15 29.17 77.03 1.35E-03 0 5.60E-08 3.19E-08 4.55E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 120 59.2 26.54 75.56 1.26E-03 0 5.98E-08 3.05E-08 4.24E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 125 59.25 14.48 76.45 1.23E-03 0 5.90E-08 1.56E-08 4.14E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 130 59.3 25.33 77.15 1.19E-03 0 5.08E-08 2.46E-08 4.03E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 135 59.35 18.21 76.51 1.27E-03 0 5.99E-08 2.02E-08 4.30E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 140 59.4 26.04 74.74 1.38E-03 0 6.91E-08 3.45E-08 4.60E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 145 59.45 17.21 74.52 1.41E-03 0 7.64E-08 2.42E-08 4.72E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 6 150 59.5 141.71 86.24 1.03E-03 0 -1.13E-08 9.09E-09 3.56E-07 03/08/97 Yes Yes 853 172 1060 C 7 H 7 0 59.5 352.81 53.06 6.35E-04 0 8.03E-08 -1.04E-08 1.76E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 5 59.55 359.76 69.38 1.27E-03 0 9.48E-08 -4.01E-10 4.12E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 10 59.6 10.08 78.79 1.31E-03 0 5.32E-08 9.67E-09 4.46E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 15 59.65 6.53 77.7 1.22E-03 0 5.49E-08 6.43E-09 4.14E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 20 59.7 354.33 74.45 1.24E-03 0 6.99E-08 -7.10E-09 4.13E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 25 59.75 2.73 82.2 1.25E-03 0 3.60E-08 1.76E-09 4.30E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 30 59.8 341.83 78.17 1.17E-03 0 4.85E-08 -1.63E-08 3.98E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 35 59.85 351.03 75.46 1.22E-03 0 6.41E-08 -1.03E-08 4.09E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 40 59.9 359.09 75.54 1.30E-03 0 6.88E-08 -1.12E-09 4.36E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 45 59.95 350.26 78.38 1.38E-03 0 5.81E-08 -1.02E-08 4.68E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 50 60 354.42 78.86 1.53E-03 0 6.25E-08 -6.24E-09 5.21E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 55 60.05 355.42 76.79 1.90E-03 0 9.20E-08 -7.53E-09 6.43E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 60 60.1 349.44 75.16 2.41E-03 0 1.29E-07 -2.45E-08 8.07E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 65 60.15 154.57 80.56 2.25E-03 0 -7.08E-08 3.44E-08 7.71E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 70 60.2 148.41 67.21 9.45E-04 0 -6.62E-08 4.16E-08 3.02E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 75 60.25 20.72 77.28 4.92E-04 0 2.15E-08 8.30E-09 1.66E-07 03/08/97 Yes Yes 855 172 1060 C 7 H 7 80 60.3 7.93 62.71 3.11E-04 0 2.99E-08 4.26E-09 9.57E-08 03/08/97 Yes Yes 855 172 1060 C 8 H 1 0 60 258.91 84.68 8.05E-04 0 -1.52E-09 -7.94E-09 1.39E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 5 60.05 101.87 65.56 2.38E-03 0 -2.14E-08 1.04E-07 3.75E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 10 60.1 276.66 77.65 2.66E-03 0 7.01E-09 -6.14E-08 4.51E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 15 60.15 255.2 69.92 2.84E-03 0 -2.64E-08 -1.02E-07 4.62E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 20 60.2 349.3 68.55 2.55E-03 0 9.72E-08 -1.88E-08 4.11E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 25 60.25 335.66 41.39 3.32E-03 0 2.40E-07 -1.11E-07 3.80E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 30 60.3 43.25 69.17 2.69E-03 0 7.40E-08 7.11E-08 4.36E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 35 60.35 48.44 75.61 3.10E-03 0 5.42E-08 6.25E-08 5.20E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 40 60.4 28.11 73.99 3.66E-03 0 9.44E-08 5.15E-08 6.09E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 45 60.45 23.48 72.51 4.07E-03 0 1.19E-07 5.29E-08 6.73E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 50 60.5 19.15 79.61 3.89E-03 0 7.03E-08 2.50E-08 6.64E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 55 60.55 20.87 81.31 3.36E-03 0 5.04E-08 1.96E-08 5.76E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 60 60.6 33.62 80.37 3.01E-03 0 4.45E-08 3.03E-08 5.15E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 65 60.65 30.12 78.23 2.80E-03 0 5.24E-08 3.11E-08 4.75E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 70 60.7 28.73 76.89 2.89E-03 0 6.10E-08 3.42E-08 4.88E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 75 60.75 46.54 79.18 2.75E-03 0 3.77E-08 4.06E-08 4.68E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 80 60.8 21.21 82.94 2.66E-03 0 3.23E-08 1.28E-08 4.57E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 85 60.85 23.94 79.38 2.74E-03 0 4.89E-08 2.22E-08 4.67E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 90 60.9 35.06 76.39 2.72E-03 0 5.55E-08 3.98E-08 4.58E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 95 60.95 32.91 76.34 2.65E-03 0 5.58E-08 3.70E-08 4.47E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 100 61 26.93 77.86 2.61E-03 0 5.20E-08 2.70E-08 4.43E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 105 61.05 32.24 82.05 2.32E-03 0 2.88E-08 1.85E-08 3.98E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 110 61.1 353.25 79.52 2.32E-03 0 4.45E-08 -5.38E-09 3.96E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 115 61.15 356.83 76.87 2.97E-03 0 7.15E-08 -4.04E-09 5.02E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 120 61.2 9.61 76.89 3.79E-03 0 8.99E-08 1.56E-08 6.40E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 125 61.25 22.89 86.84 3.49E-03 0 1.88E-08 8.12E-09 6.04E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 130 61.3 346.62 74.85 3.14E-03 0 8.45E-08 -2.06E-08 5.25E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 135 61.35 339.37 83.15 3.40E-03 0 4.03E-08 -1.55E-08 5.86E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 1 140 61.4 121.67 69.35 2.34E-03 0 -4.60E-08 7.62E-08 3.80E-07 03/08/97 Yes Yes 857 172 1060 C 8 H 2 0 61.44 5.65 56.26 8.11E-04 0 4.75E-08 4.81E-09 1.17E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 5 61.49 12.41 68.19 2.20E-03 0 8.45E-08 1.90E-08 3.54E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 10 61.54 28.54 83 2.66E-03 0 3.02E-08 1.68E-08 4.58E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 15 61.59 51.44 81.36 2.52E-03 0 2.50E-08 3.21E-08 4.32E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 20 61.64 29.29 78.1 2.51E-03 0 4.78E-08 2.74E-08 4.25E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 25 61.69 33.52 82.28 2.39E-03 0 2.84E-08 1.92E-08 4.11E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 30 61.74 52.03 82.08 2.18E-03 0 1.96E-08 2.57E-08 3.74E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 35 61.79 58.83 79.25 2.24E-03 0 2.29E-08 3.88E-08 3.81E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 40 61.84 62.08 80.05 2.36E-03 0 2.02E-08 3.91E-08 4.03E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 45 61.89 51.43 76.7 2.46E-03 0 3.74E-08 4.80E-08 4.15E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 50 61.94 29.56 78.33 2.46E-03 0 4.59E-08 2.66E-08 4.18E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 55 61.99 38.74 81.15 2.46E-03 0 3.13E-08 2.57E-08 4.21E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 60 62.04 50.69 79.64 2.34E-03 0 2.83E-08 3.53E-08 3.99E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 65 62.09 23.3 78.82 2.43E-03 0 4.59E-08 2.02E-08 4.13E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 70 62.14 11.38 80.42 2.57E-03 0 4.44E-08 9.14E-09 4.39E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 75 62.19 21.36 79.36 2.72E-03 0 4.96E-08 1.98E-08 4.64E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 80 62.24 25.29 80.94 2.68E-03 0 4.05E-08 1.96E-08 4.59E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 85 62.29 61.29 84.24 2.26E-03 0 1.16E-08 2.16E-08 3.90E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 90 62.34 315.57 87.89 1.80E-03 0 5.01E-09 -5.02E-09 3.12E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 95 62.39 355.01 85.65 1.82E-03 0 1.46E-08 -1.30E-09 3.14E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 100 62.44 327.38 84.07 1.96E-03 0 1.81E-08 -1.19E-08 3.38E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 105 62.49 336.65 86.7 2.14E-03 0 1.20E-08 -5.31E-09 3.71E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 110 62.54 307.16 71.9 2.88E-03 0 5.74E-08 -7.75E-08 4.75E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 115 62.59 357.54 78.66 4.21E-03 0 8.76E-08 -3.85E-09 7.15E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 120 62.64 64.54 79.15 3.72E-03 0 3.19E-08 6.85E-08 6.33E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 125 62.69 18.04 82.51 2.81E-03 0 3.70E-08 1.23E-08 4.83E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 130 62.74 17.64 82.63 2.38E-03 0 3.08E-08 1.00E-08 4.09E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 135 62.79 75.59 82.89 2.00E-03 0 6.52E-09 2.60E-08 3.43E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 140 62.84 18.44 80.75 1.95E-03 0 3.15E-08 1.07E-08 3.33E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 145 62.89 6.89 75.74 2.00E-03 0 5.18E-08 6.40E-09 3.36E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 2 150 62.94 133.6 82.37 1.41E-03 0 -1.37E-08 1.47E-08 2.43E-07 03/08/97 Yes Yes 859 172 1060 C 8 H 3 0 62.94 20.48 59.14 1.22E-03 0 6.21E-08 2.37E-08 1.81E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 5 62.99 1.1 75.37 2.25E-03 0 6.04E-08 1.18E-09 3.78E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 10 63.04 355.91 75.91 1.91E-03 0 4.91E-08 -3.59E-09 3.21E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 15 63.09 2.85 75.13 1.74E-03 0 4.74E-08 2.41E-09 2.92E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 20 63.14 33.56 76.79 1.72E-03 0 3.48E-08 2.36E-08 2.91E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 25 63.19 40.73 72.59 1.72E-03 0 4.13E-08 3.63E-08 2.84E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 30 63.24 13.1 78.83 1.91E-03 0 3.82E-08 9.08E-09 3.24E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 35 63.29 24.38 71.64 2.19E-03 0 6.68E-08 3.09E-08 3.61E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 40 63.34 354.02 75.95 2.40E-03 0 6.15E-08 -6.58E-09 4.04E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 45 63.39 298.81 82.16 2.19E-03 0 1.53E-08 -2.84E-08 3.76E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 50 63.44 47.84 83.29 2.24E-03 0 1.86E-08 2.10E-08 3.86E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 55 63.49 36.29 73.78 2.42E-03 0 5.77E-08 4.34E-08 4.03E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 60 63.54 16.32 66.4 2.90E-03 0 1.18E-07 3.54E-08 4.61E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 65 63.59 45.76 67.12 3.64E-03 0 1.05E-07 1.10E-07 5.82E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 70 63.64 71.34 71.97 3.15E-03 0 3.31E-08 1.00E-07 5.19E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 75 63.69 1.03 75.7 3.15E-03 0 8.26E-08 1.52E-09 5.30E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 80 63.74 326.42 77.36 2.83E-03 0 5.47E-08 -3.71E-08 4.78E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 85 63.79 359.13 80.18 2.76E-03 0 4.99E-08 -7.78E-10 4.71E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 90 63.84 28.43 74.33 2.84E-03 0 7.15E-08 3.96E-08 4.74E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 95 63.89 23.72 74.89 3.11E-03 0 7.88E-08 3.54E-08 5.21E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 100 63.94 291.25 76.16 2.77E-03 0 2.54E-08 -6.69E-08 4.66E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 105 63.99 32.94 72.9 2.74E-03 0 7.17E-08 4.75E-08 4.54E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 110 64.04 44.5 74.58 2.95E-03 0 5.94E-08 5.97E-08 4.94E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 115 64.09 342.49 78.97 3.36E-03 0 6.50E-08 -2.10E-08 5.71E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 120 64.14 347.94 78.13 3.04E-03 0 6.48E-08 -1.42E-08 5.15E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 125 64.19 23.66 79.14 3.04E-03 0 5.57E-08 2.50E-08 5.18E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 130 64.24 18.37 77.11 3.00E-03 0 6.74E-08 2.29E-08 5.07E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 135 64.29 20.13 74.04 3.14E-03 0 8.59E-08 3.22E-08 5.23E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 140 64.34 11.04 76.47 3.33E-03 0 8.10E-08 1.62E-08 5.61E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 145 64.39 3.63 76.12 2.97E-03 0 7.54E-08 4.89E-09 5.00E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 3 150 64.44 119.04 82.82 1.70E-03 0 -1.09E-08 2.01E-08 2.92E-07 03/08/97 Yes Yes 861 172 1060 C 8 H 4 0 64.44 16.62 54.88 1.35E-03 0 7.88E-08 2.41E-08 1.91E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 5 64.49 23.89 67.94 2.87E-03 0 1.04E-07 4.73E-08 4.61E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 10 64.54 16.33 73.93 3.21E-03 0 9.05E-08 2.71E-08 5.35E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 15 64.59 19.71 71.26 3.54E-03 0 1.14E-07 4.16E-08 5.82E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 20 64.64 23.41 69.59 4.10E-03 0 1.39E-07 6.16E-08 6.66E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 25 64.69 32.39 73.4 4.05E-03 0 1.04E-07 6.73E-08 6.73E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 30 64.74 25.09 69.57 3.70E-03 0 1.24E-07 5.95E-08 6.01E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 35 64.79 26.71 65.88 3.67E-03 0 1.42E-07 7.32E-08 5.81E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 40 64.84 37.27 62.81 3.78E-03 0 1.46E-07 1.13E-07 5.83E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 45 64.89 40.36 67.78 3.62E-03 0 1.11E-07 9.62E-08 5.81E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 50 64.94 34.7 69.9 3.40E-03 0 1.02E-07 7.22E-08 5.54E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 55 64.99 35.78 64.5 3.96E-03 0 1.47E-07 1.08E-07 6.20E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 60 65.04 32.41 69.46 3.97E-03 0 1.25E-07 8.10E-08 6.45E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 65 65.09 33.32 68.35 3.92E-03 0 1.28E-07 8.62E-08 6.32E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 70 65.14 32.68 66.51 4.08E-03 0 1.45E-07 9.52E-08 6.48E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 75 65.19 28.98 69.85 4.11E-03 0 1.31E-07 7.43E-08 6.68E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 80 65.24 25.68 70.51 4.15E-03 0 1.33E-07 6.52E-08 6.79E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 85 65.29 29.2 71.34 4.12E-03 0 1.22E-07 6.97E-08 6.76E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 90 65.34 25.02 71.28 4.05E-03 0 1.25E-07 5.96E-08 6.64E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 95 65.39 29.9 72.14 4.11E-03 0 1.16E-07 6.81E-08 6.78E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 100 65.44 27.25 74.66 4.07E-03 0 1.02E-07 5.35E-08 6.80E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 105 65.49 27.52 73.55 4.10E-03 0 1.09E-07 5.82E-08 6.82E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 110 65.54 38.89 75.12 3.83E-03 0 8.11E-08 6.69E-08 6.41E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 115 65.59 42.16 71.28 3.56E-03 0 8.99E-08 8.33E-08 5.85E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 120 65.64 33.05 70.75 3.38E-03 0 9.92E-08 6.60E-08 5.54E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 125 65.69 38.14 73.89 3.00E-03 0 6.95E-08 5.58E-08 5.00E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 130 65.74 24.63 71.39 2.70E-03 0 8.31E-08 3.90E-08 4.44E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 135 65.79 36.35 68.52 2.68E-03 0 8.39E-08 6.31E-08 4.33E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 140 65.84 41.16 69.14 2.51E-03 0 7.13E-08 6.37E-08 4.06E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 145 65.89 23.97 69.85 2.18E-03 0 7.27E-08 3.31E-08 3.55E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 4 150 65.94 52.27 81.27 1.43E-03 0 1.41E-08 1.86E-08 2.45E-07 03/08/97 Yes Yes 863 172 1060 C 8 H 5 0 65.94 19.15 51.97 9.79E-04 0 6.04E-08 2.15E-08 1.34E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 5 65.99 22.32 60.49 2.04E-03 0 9.87E-08 4.15E-08 3.08E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 10 66.04 35.86 65.31 2.33E-03 0 8.37E-08 6.19E-08 3.67E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 15 66.09 29.75 68.68 2.49E-03 0 8.34E-08 4.88E-08 4.03E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 20 66.14 21.88 70.05 2.86E-03 0 9.60E-08 3.94E-08 4.66E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 25 66.19 14.19 68.79 3.64E-03 0 1.35E-07 3.50E-08 5.88E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 30 66.24 25.56 70.06 4.27E-03 0 1.39E-07 6.81E-08 6.96E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 35 66.29 37.46 78.1 3.89E-03 0 6.75E-08 5.29E-08 6.60E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 40 66.34 51.1 76.47 2.94E-03 0 4.58E-08 5.81E-08 4.96E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 45 66.39 14.67 76.3 2.73E-03 0 6.63E-08 1.77E-08 4.59E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 50 66.44 18.86 74.08 2.76E-03 0 7.60E-08 2.65E-08 4.60E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 55 66.49 14.46 77.83 2.75E-03 0 5.96E-08 1.57E-08 4.66E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 60 66.54 21.85 75.92 2.64E-03 0 6.32E-08 2.59E-08 4.43E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 65 66.59 17.82 74.55 2.60E-03 0 7.00E-08 2.30E-08 4.35E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 70 66.64 22.52 74.7 2.65E-03 0 6.86E-08 2.91E-08 4.44E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 75 66.69 26.48 73.86 2.73E-03 0 7.21E-08 3.67E-08 4.55E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 80 66.74 9.78 72.97 2.88E-03 0 8.82E-08 1.55E-08 4.77E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 85 66.79 19.27 76.34 2.97E-03 0 7.02E-08 2.51E-08 5.00E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 90 66.84 18.86 78.18 2.69E-03 0 5.53E-08 1.93E-08 4.56E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 95 66.89 19.37 74.9 2.60E-03 0 6.77E-08 2.43E-08 4.35E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 100 66.94 18.72 71.72 2.63E-03 0 8.28E-08 2.87E-08 4.33E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 105 66.99 25.93 69.62 2.88E-03 0 9.56E-08 4.75E-08 4.68E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 110 67.04 13.95 70.37 3.12E-03 0 1.08E-07 2.74E-08 5.10E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 115 67.09 24.79 71.99 3.25E-03 0 9.68E-08 4.57E-08 5.36E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 120 67.14 18.35 69.45 3.23E-03 0 1.14E-07 3.88E-08 5.25E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 125 67.19 22.99 70.07 3.41E-03 0 1.13E-07 4.92E-08 5.55E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 130 67.24 17.53 72.65 3.26E-03 0 9.82E-08 3.17E-08 5.39E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 135 67.29 16.84 68.18 3.46E-03 0 1.31E-07 4.04E-08 5.57E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 140 67.34 27.06 65 3.50E-03 0 1.40E-07 7.29E-08 5.49E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 145 67.39 23.59 64.29 3.13E-03 0 1.32E-07 5.89E-08 4.89E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 5 150 67.44 58.23 75.91 1.75E-03 0 2.38E-08 3.92E-08 2.94E-07 03/08/97 Yes Yes 865 172 1060 C 8 H 6 0 67.44 17.18 49 1.58E-03 0 1.05E-07 3.32E-08 2.07E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 5 67.49 13.7 56.44 3.42E-03 0 1.95E-07 4.86E-08 4.94E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 10 67.54 23.34 62.84 3.90E-03 0 1.73E-07 7.65E-08 6.01E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 15 67.59 24.51 65.33 3.90E-03 0 1.57E-07 7.33E-08 6.15E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 20 67.64 33.07 66.03 3.96E-03 0 1.43E-07 9.52E-08 6.27E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 25 67.69 30.68 71.11 3.81E-03 0 1.13E-07 6.83E-08 6.25E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 30 67.74 39.58 74.42 3.62E-03 0 7.96E-08 6.73E-08 6.05E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 35 67.79 32.01 76.02 3.87E-03 0 8.42E-08 5.38E-08 6.52E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 40 67.84 23.84 83.58 4.11E-03 0 4.46E-08 2.02E-08 7.09E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 45 67.89 212.57 85.71 3.27E-03 0 -2.19E-08 -1.43E-08 5.66E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 50 67.94 26.81 80.44 2.24E-03 0 3.53E-08 1.82E-08 3.84E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 55 67.99 20.33 67.32 2.26E-03 0 8.66E-08 3.28E-08 3.61E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 60 68.04 21.4 66.01 2.40E-03 0 9.65E-08 3.86E-08 3.81E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 65 68.09 20.12 64.98 2.60E-03 0 1.10E-07 4.10E-08 4.09E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 70 68.14 25.99 61.42 3.03E-03 0 1.38E-07 6.89E-08 4.61E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 75 68.19 27.66 62.87 3.21E-03 0 1.37E-07 7.36E-08 4.95E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 80 68.24 21.9 63.34 3.45E-03 0 1.52E-07 6.26E-08 5.34E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 85 68.29 24.14 65.26 3.48E-03 0 1.41E-07 6.45E-08 5.47E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 90 68.34 31.14 69.83 3.15E-03 0 9.87E-08 6.10E-08 5.13E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 95 68.39 23.78 72.18 2.93E-03 0 8.70E-08 3.92E-08 4.83E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 100 68.44 15.27 72.82 3.34E-03 0 1.01E-07 2.82E-08 5.53E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 105 68.49 359.56 75.56 3.62E-03 0 9.58E-08 -7.50E-10 6.08E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 110 68.54 17.25 68.78 4.68E-03 0 1.72E-07 5.45E-08 7.56E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 115 68.59 37.35 76.06 4.51E-03 0 9.16E-08 7.15E-08 7.59E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 120 68.64 22.3 75.81 4.08E-03 0 9.82E-08 4.12E-08 6.86E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 125 68.69 25.38 73.62 4.35E-03 0 1.18E-07 5.70E-08 7.24E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 130 68.74 15.09 82.99 3.85E-03 0 4.81E-08 1.33E-08 6.62E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 135 68.79 338.84 79.61 3.17E-03 0 5.65E-08 -2.24E-08 5.40E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 140 68.84 3.1 69.41 3.82E-03 0 1.42E-07 7.89E-09 6.21E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 145 68.89 50.5 85.36 3.27E-03 0 1.78E-08 2.21E-08 5.65E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 6 150 68.94 168.42 75.75 1.54E-03 0 -3.94E-08 8.25E-09 2.59E-07 03/08/97 Yes Yes 867 172 1060 C 8 H 7 0 68.94 13.79 57.79 6.81E-04 0 3.74E-08 9.39E-09 9.99E-08 03/08/97 Yes Yes 869 172 1060 C 8 H 7 5 68.99 12.7 71.21 1.62E-03 0 5.39E-08 1.24E-08 2.65E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 10 69.04 14.11 81.36 1.69E-03 0 2.62E-08 6.73E-09 2.90E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 15 69.09 5.62 83.03 1.73E-03 0 2.22E-08 2.23E-09 2.98E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 20 69.14 356.77 74.75 2.13E-03 0 5.94E-08 -3.42E-09 3.57E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 25 69.19 349.95 72.03 4.12E-03 0 1.33E-07 -2.40E-08 6.79E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 30 69.24 168.48 72.8 4.74E-03 0 -1.46E-07 3.04E-08 7.86E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 35 69.29 155.48 74.38 2.61E-03 0 -6.77E-08 3.16E-08 4.35E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 40 69.34 5.45 76.31 2.06E-03 0 5.14E-08 5.01E-09 3.46E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 45 69.39 11.82 76.5 2.00E-03 0 4.86E-08 1.04E-08 3.38E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 50 69.44 29.58 80.83 1.90E-03 0 2.79E-08 1.62E-08 3.25E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 55 69.49 355.88 66.42 3.13E-03 0 1.32E-07 -9.75E-09 4.97E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 60 69.54 2.56 85.7 4.91E-03 0 3.90E-08 1.78E-09 8.49E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 65 69.59 91.36 84.96 3.48E-03 0 -7.68E-10 3.31E-08 6.01E-07 03/08/97 Yes Yes 869 172 1060 C 8 H 7 70 69.64 48.49 82.24 1.82E-03 0 1.73E-08 2.00E-08 3.13E-07 03/08/97 Yes Yes 869 172 1060 C 9 H 1 0 69.5 231.47 46.92 2.11E-03 0 -9.52E-08 -1.22E-07 2.67E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 5 69.55 205.25 57.05 5.65E-03 0 -2.95E-07 -1.42E-07 8.21E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 10 69.6 153.02 81.21 8.20E-03 0 -1.18E-07 6.16E-08 1.40E-06 03/08/97 Yes Yes 871 172 1060 C 9 H 1 15 69.65 24.37 71.03 8.88E-03 0 2.79E-07 1.29E-07 1.46E-06 03/08/97 Yes Yes 871 172 1060 C 9 H 1 20 69.7 358.29 69.67 1.05E-02 0 3.86E-07 -1.18E-08 1.70E-06 03/08/97 Yes Yes 871 172 1060 C 9 H 1 25 69.75 12.68 75.2 1.07E-02 0 2.84E-07 6.53E-08 1.80E-06 03/08/97 Yes Yes 871 172 1060 C 9 H 1 30 69.8 315.81 89.47 7.78E-03 0 5.43E-09 -5.40E-09 1.35E-06 03/08/97 Yes Yes 871 172 1060 C 9 H 1 35 69.85 6.75 85.4 5.18E-03 0 4.37E-08 5.29E-09 8.94E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 40 69.9 332.52 80.56 4.15E-03 0 6.40E-08 -3.41E-08 7.09E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 45 69.95 351.62 73.57 4.19E-03 0 1.24E-07 -1.87E-08 6.96E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 50 70 17.63 78.67 4.08E-03 0 8.10E-08 2.63E-08 6.93E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 55 70.05 20.57 77.57 3.42E-03 0 7.31E-08 2.80E-08 5.79E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 60 70.1 24.42 75.83 3.11E-03 0 7.35E-08 3.41E-08 5.23E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 65 70.15 7.41 77.42 2.74E-03 0 6.27E-08 8.34E-09 4.63E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 70 70.2 352.41 77.77 2.39E-03 0 5.32E-08 -7.25E-09 4.05E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 75 70.25 7.73 78.79 2.15E-03 0 4.40E-08 6.10E-09 3.66E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 80 70.3 5.39 76.6 2.21E-03 0 5.40E-08 5.20E-09 3.72E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 85 70.35 18.83 70.69 2.81E-03 0 9.32E-08 3.25E-08 4.59E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 90 70.4 15.33 75.97 3.05E-03 0 7.56E-08 2.12E-08 5.13E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 95 70.45 33.06 73.86 3.12E-03 0 7.71E-08 5.13E-08 5.19E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 100 70.5 13.26 80.94 2.78E-03 0 4.52E-08 1.09E-08 4.76E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 105 70.55 17.58 78.64 2.43E-03 0 4.83E-08 1.57E-08 4.12E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 110 70.6 35.94 79.24 1.98E-03 0 3.17E-08 2.35E-08 3.37E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 115 70.65 16.74 68.7 1.97E-03 0 7.27E-08 2.24E-08 3.18E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 120 70.7 343.22 61.75 2.38E-03 0 1.14E-07 -3.53E-08 3.63E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 125 70.75 347.49 77.06 1.89E-03 0 4.39E-08 -9.95E-09 3.20E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 130 70.8 51.23 76.65 1.53E-03 0 2.35E-08 3.00E-08 2.59E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 135 70.85 351.65 86.59 1.08E-03 0 6.72E-09 -1.01E-09 1.86E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 140 70.9 8.78 74.72 8.94E-04 0 2.47E-08 3.90E-09 1.49E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 145 70.95 8.39 71.37 8.27E-04 0 2.77E-08 4.18E-09 1.36E-07 03/08/97 Yes Yes 871 172 1060 C 9 H 1 150 71 16.26 66.56 4.95E-04 0 2.00E-08 5.98E-09 7.87E-08 03/08/97 Yes Yes 871 172 1060 C 9 H 2 0 71 331 61.03 4.03E-04 0 1.81E-08 -1.03E-08 6.11E-08 03/08/97 Yes Yes 873 172 1060 C 9 H 2 5 71.05 271.51 72.38 9.61E-04 0 8.11E-10 -3.15E-08 1.59E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 10 71.1 61.26 75.76 8.79E-04 0 1.10E-08 2.06E-08 1.48E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 15 71.15 23.59 68.38 8.16E-04 0 2.92E-08 1.31E-08 1.32E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 20 71.2 13.11 70.58 8.29E-04 0 2.85E-08 6.78E-09 1.36E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 25 71.25 19.82 75.6 8.41E-04 0 2.09E-08 7.69E-09 1.41E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 30 71.3 14.89 74.01 8.65E-04 0 2.44E-08 6.64E-09 1.44E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 35 71.35 11.37 73.78 8.49E-04 0 2.46E-08 5.07E-09 1.41E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 40 71.4 23.9 64.23 1.01E-03 0 4.25E-08 1.93E-08 1.58E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 45 71.45 349.26 70.03 1.02E-03 0 3.63E-08 -7.05E-09 1.66E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 50 71.5 38.03 69.27 9.63E-04 0 2.85E-08 2.28E-08 1.56E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 55 71.55 57.58 71.96 8.28E-04 0 1.46E-08 2.35E-08 1.37E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 60 71.6 23.67 71.18 6.77E-04 0 2.12E-08 9.51E-09 1.11E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 65 71.65 23.52 55.64 7.99E-04 0 4.38E-08 1.95E-08 1.14E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 70 71.7 11.73 73.28 7.82E-04 0 2.33E-08 4.96E-09 1.30E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 75 71.75 32.63 72.94 8.15E-04 0 2.14E-08 1.40E-08 1.35E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 80 71.8 31.09 76.97 8.42E-04 0 1.72E-08 1.06E-08 1.42E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 85 71.85 3.61 77.87 7.96E-04 0 1.77E-08 1.14E-09 1.35E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 90 71.9 32.52 71.49 8.03E-04 0 2.28E-08 1.49E-08 1.32E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 95 71.95 41 83.06 6.44E-04 0 6.22E-09 5.53E-09 1.11E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 100 72 44.81 72.14 6.66E-04 0 1.54E-08 1.56E-08 1.10E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 105 72.05 31.22 68.57 7.75E-04 0 2.57E-08 1.59E-08 1.25E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 110 72.1 25.29 74.04 8.00E-04 0 2.11E-08 1.02E-08 1.33E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 115 72.15 38.9 78.24 6.95E-04 0 1.17E-08 9.64E-09 1.18E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 120 72.2 13.65 67.28 8.14E-04 0 3.24E-08 8.04E-09 1.30E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 125 72.25 28.41 74.22 9.09E-04 0 2.31E-08 1.28E-08 1.52E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 130 72.3 49.02 80.34 9.00E-04 0 1.05E-08 1.24E-08 1.54E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 135 72.35 49.11 69.29 9.55E-04 0 2.34E-08 2.77E-08 1.55E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 140 72.4 348.85 72.43 1.04E-03 0 3.28E-08 -6.60E-09 1.72E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 145 72.45 284.84 47.99 2.45E-03 0 4.46E-08 -1.72E-07 3.16E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 2 150 72.5 100.16 44.91 2.24E-03 0 -2.97E-08 1.70E-07 2.75E-07 03/08/97 Yes Yes 873 172 1060 C 9 H 3 0 72.5 13.45 51.26 3.68E-04 0 2.38E-08 5.81E-09 4.98E-08 03/08/97 Yes Yes 875 172 1060 C 9 H 3 5 72.55 14.57 65.74 8.07E-04 0 3.40E-08 9.05E-09 1.28E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 10 72.6 5.62 75.58 9.58E-04 0 2.52E-08 2.53E-09 1.61E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 15 72.65 36.56 74.19 1.02E-03 0 2.36E-08 1.79E-08 1.70E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 20 72.7 15.16 68.64 1.37E-03 0 5.10E-08 1.41E-08 2.21E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 25 72.75 19.05 65.46 2.31E-03 0 9.64E-08 3.40E-08 3.65E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 30 72.8 18.32 69.42 3.37E-03 0 1.19E-07 4.03E-08 5.46E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 35 72.85 11.82 71.53 4.03E-03 0 1.32E-07 2.84E-08 6.62E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 40 72.9 15.89 72.47 4.52E-03 0 1.39E-07 4.04E-08 7.47E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 45 72.95 24.26 70.81 5.05E-03 0 1.60E-07 7.39E-08 8.26E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 50 73 17.93 66.46 5.83E-03 0 2.35E-07 7.78E-08 9.27E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 55 73.05 26.01 70.78 6.39E-03 0 2.00E-07 1.00E-07 1.05E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 60 73.1 6.18 76.59 5.74E-03 0 1.40E-07 1.55E-08 9.68E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 65 73.15 16.52 72.68 5.88E-03 0 1.78E-07 5.40E-08 9.72E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 70 73.2 17.26 69.02 6.03E-03 0 2.19E-07 6.95E-08 9.77E-07 03/08/97 Yes Yes 875 172 1060 C 9 H 3 75 73.25 21.68 65.98 7.71E-03 0 3.09E-07 1.26E-07 1.22E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 80 73.3 16.56 69.95 8.29E-03 0 2.89E-07 8.79E-08 1.35E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 85 73.35 15.9 70.99 8.76E-03 0 2.91E-07 8.48E-08 1.44E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 90 73.4 14.93 74.08 8.59E-03 0 2.41E-07 6.58E-08 1.43E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 95 73.45 23.53 73.2 8.68E-03 0 2.44E-07 1.09E-07 1.44E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 100 73.5 24.71 71.06 8.84E-03 0 2.77E-07 1.30E-07 1.45E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 105 73.55 16.99 67.01 1.05E-02 0 4.16E-07 1.30E-07 1.68E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 110 73.6 22.09 70.95 1.22E-02 0 3.91E-07 1.62E-07 2.00E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 115 73.65 2.52 71.09 1.43E-02 0 4.91E-07 2.21E-08 2.35E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 120 73.7 5.91 71.56 1.59E-02 0 5.30E-07 5.61E-08 2.61E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 125 73.75 14.79 69.69 1.81E-02 0 6.44E-07 1.74E-07 2.94E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 130 73.8 6.44 70.98 2.10E-02 0 7.23E-07 8.34E-08 3.45E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 135 73.85 20.74 70.82 2.33E-02 0 7.58E-07 2.94E-07 3.81E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 140 73.9 28.51 69.97 2.26E-02 0 7.20E-07 4.00E-07 3.68E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 145 73.95 12.5 72.32 1.90E-02 0 5.98E-07 1.36E-07 3.14E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 3 150 74 105.83 82.32 1.07E-02 0 -4.14E-08 1.49E-07 1.84E-06 03/08/97 Yes Yes 875 172 1060 C 9 H 4 0 74 2.02 65.42 3.15E-03 0 1.39E-07 4.99E-09 4.96E-07 03/08/97 Yes Yes 877 172 1060 C 9 H 4 5 74.05 17.72 58.33 1.25E-02 0 6.65E-07 2.17E-07 1.85E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 10 74.1 18.31 65.47 1.96E-02 0 8.18E-07 2.77E-07 3.09E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 15 74.15 19.83 70.67 2.16E-02 0 7.15E-07 2.63E-07 3.54E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 20 74.2 15.82 72.07 2.32E-02 0 7.29E-07 2.11E-07 3.83E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 25 74.25 27.86 66.28 2.69E-02 0 1.02E-06 5.49E-07 4.27E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 30 74.3 24.27 66.72 3.02E-02 0 1.15E-06 5.32E-07 4.81E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 35 74.35 35.52 76.05 2.54E-02 0 5.28E-07 3.85E-07 4.27E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 40 74.4 32.17 71.31 2.09E-02 0 6.03E-07 3.88E-07 3.44E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 45 74.45 19.93 67.4 2.14E-02 0 8.18E-07 3.03E-07 3.42E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 50 74.5 29.67 68.67 2.05E-02 0 6.88E-07 4.01E-07 3.32E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 55 74.55 19.01 74.14 1.77E-02 0 4.86E-07 1.71E-07 2.96E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 60 74.6 20.34 68.93 1.82E-02 0 6.52E-07 2.47E-07 2.95E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 65 74.65 40.33 71.74 1.76E-02 0 4.46E-07 3.87E-07 2.90E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 70 74.7 359.87 72.36 1.75E-02 0 5.63E-07 -1.34E-09 2.90E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 75 74.75 16.17 73.82 1.79E-02 0 5.08E-07 1.51E-07 2.98E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 80 74.8 53.27 80.43 1.49E-02 0 1.57E-07 2.15E-07 2.55E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 85 74.85 27.81 70.85 1.35E-02 0 4.15E-07 2.24E-07 2.21E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 90 74.9 28.55 73.08 1.33E-02 0 3.61E-07 2.01E-07 2.21E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 95 74.95 4.03 78.01 1.21E-02 0 2.66E-07 1.91E-08 2.05E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 100 75 353.5 76.49 1.24E-02 0 3.06E-07 -3.57E-08 2.09E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 105 75.05 9.32 73.31 1.30E-02 0 3.90E-07 6.55E-08 2.16E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 110 75.1 6.52 75.08 1.41E-02 0 3.84E-07 4.48E-08 2.37E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 115 75.15 24.57 78.98 1.40E-02 0 2.58E-07 1.21E-07 2.38E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 120 75.2 7.45 73.18 1.51E-02 0 4.60E-07 6.16E-08 2.51E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 125 75.25 16.1 81.66 1.41E-02 0 2.09E-07 6.16E-08 2.42E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 130 75.3 23.03 77.38 1.18E-02 0 2.51E-07 1.09E-07 1.99E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 135 75.35 26.16 74.51 1.06E-02 0 2.69E-07 1.35E-07 1.77E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 140 75.4 21.1 75.04 1.00E-02 0 2.56E-07 1.01E-07 1.68E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 145 75.45 14.54 71.62 9.79E-03 0 3.17E-07 8.41E-08 1.61E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 4 150 75.5 32.98 78.83 7.89E-03 0 1.36E-07 9.01E-08 1.34E-06 03/08/97 Yes Yes 877 172 1060 C 9 H 5 0 75.5 4.88 52.54 3.31E-03 0 2.13E-07 1.86E-08 4.55E-07 03/08/97 Yes Yes 879 172 1060 C 9 H 5 5 75.55 359.41 65.55 7.80E-03 0 3.42E-07 -3.57E-09 1.23E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 10 75.6 15.21 76.17 7.85E-03 0 1.92E-07 5.34E-08 1.32E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 15 75.65 19.56 70.66 8.14E-03 0 2.69E-07 9.79E-08 1.33E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 20 75.7 14.37 70.87 9.77E-03 0 3.29E-07 8.62E-08 1.60E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 25 75.75 354.86 75.19 9.51E-03 0 2.57E-07 -2.36E-08 1.59E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 30 75.8 4.19 74.06 9.66E-03 0 2.81E-07 2.10E-08 1.61E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 35 75.85 19.86 76.54 9.15E-03 0 2.13E-07 7.85E-08 1.54E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 40 75.9 15.18 76.28 8.49E-03 0 2.06E-07 5.72E-08 1.43E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 45 75.95 17.36 72.84 8.26E-03 0 2.47E-07 7.89E-08 1.37E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 50 76 16.1 74.15 7.77E-03 0 2.16E-07 6.38E-08 1.30E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 55 76.05 16.11 72.89 7.50E-03 0 2.25E-07 6.64E-08 1.24E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 60 76.1 8.43 73.95 7.57E-03 0 2.20E-07 3.33E-08 1.26E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 65 76.15 21.6 75.75 7.17E-03 0 1.74E-07 7.05E-08 1.21E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 70 76.2 36.11 73.13 6.73E-03 0 1.67E-07 1.25E-07 1.12E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 75 76.25 14.35 72.37 6.80E-03 0 2.12E-07 5.54E-08 1.12E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 80 76.3 14.6 72.17 7.36E-03 0 2.31E-07 6.16E-08 1.21E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 85 76.35 11.56 71.18 8.04E-03 0 2.70E-07 5.64E-08 1.32E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 90 76.4 23.7 71.3 8.79E-03 0 2.74E-07 1.23E-07 1.44E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 95 76.45 31.39 70.23 8.96E-03 0 2.75E-07 1.71E-07 1.46E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 100 76.5 23.52 69.56 9.50E-03 0 3.23E-07 1.44E-07 1.54E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 105 76.55 27.1 74.13 8.89E-03 0 2.30E-07 1.20E-07 1.48E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 110 76.6 46.95 76.43 7.12E-03 0 1.21E-07 1.32E-07 1.20E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 115 76.65 22.13 69.84 7.05E-03 0 2.39E-07 9.93E-08 1.15E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 120 76.7 27.24 68.37 8.23E-03 0 2.86E-07 1.51E-07 1.33E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 125 76.75 32.71 68.42 8.72E-03 0 2.86E-07 1.88E-07 1.41E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 130 76.8 29.69 70.09 8.62E-03 0 2.71E-07 1.58E-07 1.41E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 135 76.85 23.74 73.89 7.49E-03 0 2.02E-07 9.07E-08 1.25E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 140 76.9 10.97 69.86 6.95E-03 0 2.49E-07 4.94E-08 1.13E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 145 76.95 21.43 67.11 6.38E-03 0 2.45E-07 9.84E-08 1.02E-06 03/08/97 Yes Yes 879 172 1060 C 9 H 5 150 77 62.27 75.31 4.14E-03 0 5.18E-08 1.01E-07 6.94E-07 03/08/97 Yes Yes 879 172 1060 C 9 H 6 0 77 349.46 54.02 2.35E-03 0 1.44E-07 -2.74E-08 3.30E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 5 77.05 13.56 60.5 5.32E-03 0 2.70E-07 6.66E-08 8.02E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 10 77.1 30.56 63.43 6.80E-03 0 2.78E-07 1.68E-07 1.05E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 15 77.15 35.61 66.49 7.21E-03 0 2.48E-07 1.82E-07 1.15E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 20 77.2 37.24 66.38 7.56E-03 0 2.56E-07 1.99E-07 1.20E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 25 77.25 39.39 68.89 7.23E-03 0 2.13E-07 1.79E-07 1.17E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 30 77.3 44.23 67.08 6.89E-03 0 2.04E-07 2.03E-07 1.10E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 35 77.35 36.16 64.3 7.29E-03 0 2.71E-07 2.02E-07 1.14E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 40 77.4 43.95 63.98 7.59E-03 0 2.54E-07 2.51E-07 1.18E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 45 77.45 45.82 66.77 7.01E-03 0 2.04E-07 2.15E-07 1.12E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 50 77.5 37.83 68.36 6.68E-03 0 2.07E-07 1.64E-07 1.08E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 55 77.55 46.82 62.49 7.11E-03 0 2.38E-07 2.60E-07 1.09E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 60 77.6 44.07 64.44 7.03E-03 0 2.31E-07 2.29E-07 1.10E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 65 77.65 49.67 66.56 6.57E-03 0 1.79E-07 2.16E-07 1.04E-06 03/08/97 Yes Yes 881 172 1060 C 9 H 6 70 77.7 43.81 69.37 5.72E-03 0 1.54E-07 1.51E-07 9.29E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 75 77.75 45.08 68.18 4.93E-03 0 1.37E-07 1.41E-07 7.94E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 80 77.8 50.92 63.7 4.31E-03 0 1.28E-07 1.61E-07 6.70E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 85 77.85 42.42 61.81 3.99E-03 0 1.47E-07 1.38E-07 6.09E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 90 77.9 41.06 64.61 3.88E-03 0 1.33E-07 1.18E-07 6.07E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 95 77.95 53.91 65.15 3.69E-03 0 9.68E-08 1.36E-07 5.80E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 100 78 48.85 62.66 3.74E-03 0 1.20E-07 1.40E-07 5.76E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 105 78.05 46.73 59.78 4.61E-03 0 1.69E-07 1.83E-07 6.91E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 110 78.1 54.51 57.98 5.48E-03 0 1.79E-07 2.57E-07 8.06E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 115 78.15 53.52 57.51 6.03E-03 0 2.04E-07 2.83E-07 8.82E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 120 78.2 53.04 60.95 5.53E-03 0 1.71E-07 2.33E-07 8.38E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 125 78.25 53.04 59.57 5.51E-03 0 1.78E-07 2.42E-07 8.24E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 130 78.3 54.69 60.72 5.13E-03 0 1.54E-07 2.22E-07 7.76E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 135 78.35 55.16 62.37 4.72E-03 0 1.33E-07 1.95E-07 7.25E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 140 78.4 47.43 59.17 4.60E-03 0 1.69E-07 1.88E-07 6.84E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 145 78.45 49.45 55.87 4.36E-03 0 1.69E-07 2.02E-07 6.26E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 6 150 78.5 73.59 66.62 2.57E-03 0 3.05E-08 1.06E-07 4.08E-07 03/08/97 Yes Yes 881 172 1060 C 9 H 7 0 78.5 21.04 42.53 1.55E-03 0 1.13E-07 4.46E-08 1.82E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 5 78.55 44.83 55.56 2.43E-03 0 1.03E-07 1.05E-07 3.47E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 10 78.6 44.72 69.03 1.80E-03 0 4.86E-08 4.92E-08 2.92E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 15 78.65 39.62 69.09 1.49E-03 0 4.34E-08 3.67E-08 2.41E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 20 78.7 25.49 71.58 1.40E-03 0 4.23E-08 2.06E-08 2.30E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 25 78.75 5.41 77.84 1.40E-03 0 3.12E-08 3.02E-09 2.37E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 30 78.8 222.13 79.28 1.51E-03 0 -2.21E-08 -2.04E-08 2.57E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 35 78.85 211.3 38.63 2.86E-03 0 -2.02E-07 -1.26E-07 3.09E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 40 78.9 210.92 15.41 8.95E-03 0 -7.85E-07 -4.81E-07 4.12E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 45 78.95 91.5 70.21 7.85E-03 0 -7.38E-09 2.88E-07 1.28E-06 03/08/97 Yes Yes 883 172 1060 C 9 H 7 50 79 31.05 24.09 1.02E-01 0 8.48E-06 5.22E-06 7.23E-06 03/08/97 Yes Yes 883 172 1060 C 9 H 7 55 79.05 7.48 61.68 7.10E-02 0 3.54E-06 4.76E-07 1.08E-05 03/08/97 Yes Yes 883 172 1060 C 9 H 7 60 79.1 204.4 48.01 2.50E-02 0 -1.62E-06 -7.49E-07 3.22E-06 03/08/97 Yes Yes 883 172 1060 C 9 H 7 65 79.15 196.38 58.72 6.32E-03 0 -3.34E-07 -1.00E-07 9.37E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 70 79.2 142.38 64.77 2.63E-03 0 -9.41E-08 7.42E-08 4.12E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 75 79.25 58.19 47.59 1.61E-03 0 6.08E-08 1.00E-07 2.07E-07 03/08/97 Yes Yes 883 172 1060 C 9 H 7 80 79.3 6.99 42.78 1.27E-03 0 9.82E-08 1.23E-08 1.50E-07 03/08/97 Yes Yes 883 172 1060 C 10 H 1 0 79 2.23 37.4 7.28E-04 0 6.13E-08 2.44E-09 7.67E-08 03/08/97 Yes Yes 885 172 1060 C 10 H 1 5 79.05 337.68 26.7 2.66E-03 0 2.33E-07 -9.80E-08 2.07E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 10 79.1 318.98 59.26 1.39E-03 0 5.68E-08 -5.05E-08 2.07E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 15 79.15 355.9 70.64 9.94E-04 0 3.49E-08 -2.56E-09 1.63E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 20 79.2 355.02 57.81 1.38E-03 0 7.78E-08 -6.93E-09 2.03E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 25 79.25 356.75 60.77 1.49E-03 0 7.72E-08 -4.49E-09 2.26E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 30 79.3 5.54 66.66 1.33E-03 0 5.58E-08 5.53E-09 2.12E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 35 79.35 353.77 64.11 1.36E-03 0 6.27E-08 -6.99E-09 2.12E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 40 79.4 359.71 65.36 1.46E-03 0 6.48E-08 -3.33E-10 2.31E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 45 79.45 18.61 62.59 1.59E-03 0 7.37E-08 2.54E-08 2.45E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 50 79.5 333.77 79.21 1.47E-03 0 2.62E-08 -1.32E-08 2.50E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 55 79.55 319.91 67.08 1.43E-03 0 4.52E-08 -3.89E-08 2.28E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 60 79.6 278.44 60.35 2.11E-03 0 1.63E-08 -1.12E-07 3.19E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 65 79.65 100.59 62.8 1.79E-03 0 -1.59E-08 8.71E-08 2.76E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 70 79.7 359.22 72.56 1.32E-03 0 4.18E-08 -5.83E-10 2.18E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 75 79.75 13.68 75.36 1.32E-03 0 3.45E-08 8.58E-09 2.22E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 80 79.8 13.47 61.56 1.38E-03 0 6.79E-08 1.66E-08 2.11E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 85 79.85 298.18 55.08 1.93E-03 0 5.54E-08 -1.06E-07 2.75E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 90 79.9 56.35 81.3 2.31E-03 0 2.06E-08 3.16E-08 3.96E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 95 79.95 81.77 63.24 2.35E-03 0 1.61E-08 1.14E-07 3.64E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 100 80 359.2 75.53 1.73E-03 0 4.58E-08 -6.57E-10 2.90E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 105 80.05 1.38 72.43 1.67E-03 0 5.35E-08 1.32E-09 2.76E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 110 80.1 31.98 66.74 1.53E-03 0 5.43E-08 3.46E-08 2.43E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 115 80.15 12.22 70 1.39E-03 0 4.93E-08 1.09E-08 2.26E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 120 80.2 359.28 71.4 1.23E-03 0 4.16E-08 -5.37E-10 2.02E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 125 80.25 20.59 74.62 9.60E-04 0 2.53E-08 9.71E-09 1.60E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 130 80.3 356.06 75.13 1.01E-03 0 2.75E-08 -1.93E-09 1.69E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 135 80.35 340.75 69.98 1.66E-03 0 5.68E-08 -2.03E-08 2.70E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 140 80.4 14.08 67.76 1.97E-03 0 7.66E-08 1.96E-08 3.16E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 145 80.45 289.69 82.93 1.50E-03 0 6.60E-09 -1.89E-08 2.58E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 1 150 80.5 104.13 65.36 6.75E-04 0 -7.28E-09 2.96E-08 1.06E-07 03/08/97 Yes Yes 885 172 1060 C 10 H 2 0 80.5 225.57 79.46 3.06E-03 0 -4.16E-08 -4.34E-08 5.22E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 5 80.55 116.71 79.32 3.31E-03 0 -2.92E-08 5.94E-08 5.63E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 10 80.6 344.89 77.84 2.50E-03 0 5.38E-08 -1.49E-08 4.23E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 15 80.65 328.38 81.64 1.63E-03 0 2.14E-08 -1.35E-08 2.80E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 20 80.7 0.91 74.31 1.57E-03 0 4.49E-08 7.27E-10 2.61E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 25 80.75 347.14 75.79 1.71E-03 0 4.34E-08 -1.01E-08 2.87E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 30 80.8 345.92 79.01 1.60E-03 0 3.15E-08 -8.07E-09 2.73E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 35 80.85 358.92 76.27 1.59E-03 0 4.01E-08 -7.71E-10 2.68E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 40 80.9 342.83 74.48 1.67E-03 0 4.54E-08 -1.43E-08 2.80E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 45 80.95 339.41 62.73 2.00E-03 0 9.10E-08 -3.50E-08 3.08E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 50 81 342.33 73.47 1.90E-03 0 5.47E-08 -1.78E-08 3.16E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 55 81.05 26.9 79.17 1.66E-03 0 2.96E-08 1.53E-08 2.83E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 60 81.1 354.2 77.72 1.50E-03 0 3.36E-08 -3.49E-09 2.54E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 65 81.15 342.75 72.75 1.48E-03 0 4.44E-08 -1.41E-08 2.45E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 70 81.2 353.15 71.43 1.55E-03 0 5.19E-08 -6.37E-09 2.54E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 75 81.25 10.87 71.75 1.62E-03 0 5.28E-08 1.04E-08 2.66E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 80 81.3 345.33 76.19 1.80E-03 0 4.40E-08 -1.18E-08 3.03E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 85 81.35 325.59 75.86 1.69E-03 0 3.61E-08 -2.53E-08 2.84E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 90 81.4 340.11 73.95 1.63E-03 0 4.48E-08 -1.66E-08 2.71E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 95 81.45 6.54 75.14 1.57E-03 0 4.24E-08 4.97E-09 2.63E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 100 81.5 6.06 78.37 1.56E-03 0 3.33E-08 3.61E-09 2.66E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 105 81.55 316.14 78.16 1.61E-03 0 2.52E-08 -2.48E-08 2.73E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 110 81.6 345.99 74.68 1.55E-03 0 4.22E-08 -1.08E-08 2.59E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 115 81.65 359.66 74.12 1.59E-03 0 4.60E-08 -2.82E-10 2.64E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 120 81.7 336.58 76.7 1.72E-03 0 3.85E-08 -1.70E-08 2.90E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 125 81.75 298 49.44 3.00E-03 0 9.71E-08 -1.87E-07 3.95E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 130 81.8 61.72 65.28 3.60E-03 0 7.56E-08 1.44E-07 5.67E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 135 81.85 56.19 78.25 2.66E-03 0 3.20E-08 4.88E-08 4.52E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 140 81.9 295.47 57.06 2.36E-03 0 5.85E-08 -1.26E-07 3.43E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 145 81.95 328 69.2 1.54E-03 0 4.93E-08 -3.15E-08 2.50E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 2 150 82 125.14 83.94 8.41E-04 0 -5.42E-09 7.88E-09 1.45E-07 03/08/97 Yes Yes 887 172 1060 C 10 H 3 0 82 337.77 54.45 5.76E-04 0 3.29E-08 -1.37E-08 8.13E-08 03/08/97 Yes Yes 889 172 1060 C 10 H 3 5 82.05 329.32 64.55 1.26E-03 0 4.94E-08 -3.00E-08 1.97E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 10 82.1 340.48 69.67 1.41E-03 0 4.88E-08 -1.77E-08 2.28E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 15 82.15 350.63 73.83 1.37E-03 0 3.98E-08 -6.72E-09 2.27E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 20 82.2 348.98 72.42 1.28E-03 0 4.01E-08 -7.99E-09 2.11E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 25 82.25 345.98 67.69 1.57E-03 0 6.14E-08 -1.57E-08 2.52E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 30 82.3 343.95 70.98 1.70E-03 0 5.64E-08 -1.66E-08 2.78E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 35 82.35 345.97 74.07 1.69E-03 0 4.77E-08 -1.22E-08 2.81E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 40 82.4 345.57 70.19 1.72E-03 0 5.99E-08 -1.57E-08 2.81E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 45 82.45 332.51 72.81 1.72E-03 0 4.78E-08 -2.54E-08 2.84E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 50 82.5 336.11 75.85 1.66E-03 0 3.93E-08 -1.78E-08 2.78E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 55 82.55 311.11 77.97 1.54E-03 0 2.23E-08 -2.62E-08 2.60E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 60 82.6 327.32 73.1 1.53E-03 0 3.96E-08 -2.60E-08 2.53E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 65 82.65 320.12 73.37 1.49E-03 0 3.46E-08 -2.96E-08 2.47E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 70 82.7 331.9 72.01 1.55E-03 0 4.49E-08 -2.45E-08 2.56E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 75 82.75 322.49 75.89 1.51E-03 0 3.10E-08 -2.43E-08 2.54E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 80 82.8 336.08 76.74 1.40E-03 0 3.10E-08 -1.41E-08 2.35E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 85 82.85 352.73 70.99 1.38E-03 0 4.73E-08 -6.17E-09 2.26E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 90 82.9 358.25 70.42 1.48E-03 0 5.24E-08 -1.63E-09 2.41E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 95 82.95 340.95 70.8 1.57E-03 0 5.19E-08 -1.83E-08 2.58E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 100 83 323.73 72.51 1.52E-03 0 3.91E-08 -2.93E-08 2.52E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 105 83.05 340.97 75.77 1.45E-03 0 3.58E-08 -1.26E-08 2.44E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 110 83.1 339.88 71.7 1.41E-03 0 4.41E-08 -1.65E-08 2.32E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 115 83.15 357.61 73.68 1.32E-03 0 3.94E-08 -1.68E-09 2.20E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 120 83.2 342.89 74.27 1.47E-03 0 4.04E-08 -1.27E-08 2.45E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 125 83.25 4.01 74.91 1.74E-03 0 4.79E-08 3.43E-09 2.91E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 130 83.3 45.73 66.83 2.32E-03 0 6.76E-08 7.09E-08 3.70E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 135 83.35 46.7 77.95 3.32E-03 0 5.05E-08 5.48E-08 5.64E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 140 83.4 262.15 55.31 2.87E-03 0 -2.36E-08 -1.75E-07 4.09E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 145 83.45 328.24 72.38 1.96E-03 0 5.36E-08 -3.39E-08 3.25E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 3 150 83.5 115.65 74.78 9.90E-04 0 -1.19E-08 2.54E-08 1.66E-07 03/08/97 Yes Yes 889 172 1060 C 10 H 4 0 83.5 344.5 56.57 6.07E-04 0 3.42E-08 -9.69E-09 8.78E-08 03/08/97 Yes Yes 891 172 1060 C 10 H 4 5 83.55 346.41 63.85 1.38E-03 0 6.26E-08 -1.55E-08 2.15E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 10 83.6 347.5 67.68 1.63E-03 0 6.42E-08 -1.46E-08 2.62E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 15 83.65 338.62 59.95 1.98E-03 0 9.79E-08 -3.92E-08 2.97E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 20 83.7 342.18 66.89 2.07E-03 0 8.22E-08 -2.70E-08 3.31E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 25 83.75 348.24 69.02 1.94E-03 0 7.22E-08 -1.54E-08 3.14E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 30 83.8 349.04 68.56 1.87E-03 0 7.12E-08 -1.41E-08 3.02E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 35 83.85 341.38 68.07 1.81E-03 0 6.79E-08 -2.34E-08 2.91E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 40 83.9 339.71 65.99 1.90E-03 0 7.67E-08 -2.90E-08 3.00E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 45 83.95 342.54 71.05 1.84E-03 0 6.04E-08 -1.94E-08 3.02E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 50 84 345.25 71.51 1.78E-03 0 5.80E-08 -1.56E-08 2.93E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 55 84.05 341.63 74.42 1.71E-03 0 4.61E-08 -1.57E-08 2.85E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 60 84.1 344.33 75.64 1.57E-03 0 3.99E-08 -1.14E-08 2.64E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 65 84.15 340.41 73.39 1.55E-03 0 4.43E-08 -1.61E-08 2.57E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 70 84.2 347.31 70.86 1.57E-03 0 5.33E-08 -1.23E-08 2.57E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 75 84.25 351.54 71.84 1.59E-03 0 5.19E-08 -7.89E-09 2.61E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 80 84.3 345.79 75.43 1.49E-03 0 3.85E-08 -9.97E-09 2.50E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 85 84.35 344.6 75 1.41E-03 0 3.74E-08 -1.05E-08 2.36E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 90 84.4 342.9 75.94 1.24E-03 0 3.05E-08 -9.58E-09 2.08E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 95 84.45 358.42 67.63 1.29E-03 0 5.20E-08 -1.46E-09 2.06E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 100 84.5 1.34 73.71 1.23E-03 0 3.66E-08 8.74E-10 2.05E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 105 84.55 352.37 72.63 1.19E-03 0 3.74E-08 -5.12E-09 1.97E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 110 84.6 342.97 69.98 1.39E-03 0 4.81E-08 -1.51E-08 2.26E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 115 84.65 15.11 70.5 1.61E-03 0 5.50E-08 1.52E-08 2.63E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 120 84.7 352.65 75.09 1.77E-03 0 4.78E-08 -6.31E-09 2.96E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 125 84.75 333.2 72.18 1.64E-03 0 4.76E-08 -2.46E-08 2.71E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 130 84.8 338.15 70.62 1.42E-03 0 4.64E-08 -1.90E-08 2.32E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 135 84.85 347.4 69.75 1.27E-03 0 4.56E-08 -1.04E-08 2.07E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 140 84.9 348.45 67.41 1.20E-03 0 4.78E-08 -9.99E-09 1.92E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 145 84.95 338.45 63.21 1.19E-03 0 5.28E-08 -2.13E-08 1.84E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 4 150 85 21.11 79.18 6.58E-04 0 1.22E-08 4.82E-09 1.12E-07 03/08/97 Yes Yes 891 172 1060 C 10 H 5 0 85 350.99 49.34 5.12E-04 0 3.50E-08 -5.67E-09 6.74E-08 03/08/97 Yes Yes 893 172 1060 C 10 H 5 5 85.05 343.17 60.01 1.02E-03 0 5.18E-08 -1.60E-08 1.53E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 10 85.1 342.58 65.18 1.03E-03 0 4.39E-08 -1.41E-08 1.63E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 15 85.15 341.5 68.02 9.74E-04 0 3.67E-08 -1.26E-08 1.57E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 20 85.2 333.11 65.83 9.25E-04 0 3.58E-08 -1.86E-08 1.46E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 25 85.25 335.96 61.15 1.04E-03 0 4.85E-08 -2.21E-08 1.58E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 30 85.3 339.22 64.75 1.09E-03 0 4.61E-08 -1.79E-08 1.71E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 35 85.35 344.48 70.99 9.85E-04 0 3.28E-08 -9.31E-09 1.62E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 40 85.4 351.29 72.31 9.30E-04 0 2.96E-08 -4.65E-09 1.54E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 45 85.45 342.91 69.67 1.03E-03 0 3.62E-08 -1.14E-08 1.67E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 50 85.5 343.81 72.46 1.10E-03 0 3.37E-08 -1.00E-08 1.81E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 55 85.55 352.44 76.08 1.06E-03 0 2.68E-08 -3.64E-09 1.78E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 60 85.6 343.73 73.82 1.11E-03 0 3.16E-08 -9.42E-09 1.85E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 65 85.65 347.81 72.8 1.35E-03 0 4.14E-08 -9.15E-09 2.24E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 70 85.7 354.95 76.53 1.56E-03 0 3.85E-08 -3.48E-09 2.64E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 75 85.75 326.41 71.59 1.89E-03 0 5.28E-08 -3.59E-08 3.11E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 80 85.8 15.62 74.26 1.82E-03 0 5.03E-08 1.44E-08 3.03E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 85 85.85 345.47 76.31 1.52E-03 0 3.70E-08 -9.81E-09 2.57E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 90 85.9 339.86 74.37 1.35E-03 0 3.61E-08 -1.35E-08 2.25E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 95 85.95 342.89 73.85 1.27E-03 0 3.57E-08 -1.13E-08 2.11E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 100 86 343.33 70.68 1.25E-03 0 4.19E-08 -1.28E-08 2.04E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 105 86.05 350.99 70.52 1.21E-03 0 4.23E-08 -6.87E-09 1.98E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 110 86.1 355.45 72.1 1.15E-03 0 3.73E-08 -3.04E-09 1.89E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 115 86.15 349.86 65.84 1.15E-03 0 4.90E-08 -8.96E-09 1.81E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 120 86.2 357.39 71.02 1.18E-03 0 4.08E-08 -1.90E-09 1.94E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 125 86.25 354.68 80.28 9.51E-04 0 1.70E-08 -1.61E-09 1.62E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 130 86.3 355.43 77.33 8.53E-04 0 1.98E-08 -1.62E-09 1.44E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 135 86.35 11.64 75.11 9.37E-04 0 2.50E-08 5.27E-09 1.57E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 140 86.4 319.95 73.63 9.76E-04 0 2.23E-08 -1.92E-08 1.62E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 145 86.45 339.89 68.87 9.94E-04 0 3.57E-08 -1.34E-08 1.61E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 5 150 86.5 248.29 87.88 6.26E-04 0 -9.07E-10 -2.33E-09 1.08E-07 03/08/97 Yes Yes 893 172 1060 C 10 H 6 0 86.5 342.71 66.88 4.58E-04 0 1.82E-08 -5.79E-09 7.30E-08 03/08/97 Yes Yes 895 172 1060 C 10 H 6 5 86.55 340.48 71.15 9.76E-04 0 3.15E-08 -1.14E-08 1.60E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 10 86.6 344.26 70.71 1.21E-03 0 4.09E-08 -1.18E-08 1.99E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 15 86.65 356.6 68.66 1.44E-03 0 5.54E-08 -3.37E-09 2.32E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 20 86.7 330.89 74.24 1.37E-03 0 3.44E-08 -1.96E-08 2.28E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 25 86.75 332.72 71.47 1.13E-03 0 3.39E-08 -1.79E-08 1.86E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 30 86.8 320.07 81.22 6.22E-04 0 7.72E-09 -6.61E-09 1.07E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 35 86.85 155.25 50.41 1.81E-04 0 -1.11E-08 5.23E-09 2.41E-08 03/08/97 Yes Yes 895 172 1060 C 10 H 6 40 86.9 153.83 44.33 1.11E-04 0 -7.54E-09 3.79E-09 1.34E-08 03/08/97 Yes Yes 895 172 1060 C 10 H 6 45 86.95 339.13 54.88 3.78E-04 0 2.16E-08 -8.41E-09 5.37E-08 03/08/97 Yes Yes 895 172 1060 C 10 H 6 50 87 327.59 63.22 9.65E-04 0 3.89E-08 -2.53E-08 1.49E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 55 87.05 328.8 72.15 1.13E-03 0 3.13E-08 -1.94E-08 1.86E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 60 87.1 332.95 71.47 1.26E-03 0 3.79E-08 -1.98E-08 2.07E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 65 87.15 335.06 72.61 1.37E-03 0 3.94E-08 -1.88E-08 2.27E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 70 87.2 333.65 69.52 1.45E-03 0 4.82E-08 -2.44E-08 2.36E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 75 87.25 344.96 73.03 1.50E-03 0 4.49E-08 -1.23E-08 2.49E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 80 87.3 340.82 76.59 1.33E-03 0 3.09E-08 -1.10E-08 2.24E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 85 87.35 336.78 71.88 1.24E-03 0 3.75E-08 -1.64E-08 2.04E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 90 87.4 334.53 70.87 1.21E-03 0 3.80E-08 -1.85E-08 1.98E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 95 87.45 333.43 70.26 1.17E-03 0 3.76E-08 -1.92E-08 1.91E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 100 87.5 337.29 71.07 1.18E-03 0 3.73E-08 -1.60E-08 1.93E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 105 87.55 327.62 71.24 1.22E-03 0 3.50E-08 -2.27E-08 2.00E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 110 87.6 331.86 70.82 1.26E-03 0 3.88E-08 -2.12E-08 2.07E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 115 87.65 338.17 71.31 1.28E-03 0 4.04E-08 -1.66E-08 2.10E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 120 87.7 333.28 71.76 1.25E-03 0 3.71E-08 -1.91E-08 2.06E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 125 87.75 329.98 71.96 1.22E-03 0 3.47E-08 -2.05E-08 2.01E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 130 87.8 339.17 69.41 1.24E-03 0 4.31E-08 -1.68E-08 2.01E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 135 87.85 350.46 59.82 1.49E-03 0 7.81E-08 -1.34E-08 2.23E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 140 87.9 316.65 66.4 1.62E-03 0 4.99E-08 -4.82E-08 2.57E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 145 87.95 292.1 78.82 1.01E-03 0 7.85E-09 -1.98E-08 1.73E-07 03/08/97 Yes Yes 895 172 1060 C 10 H 6 150 88 145.93 81.25 4.57E-04 0 -6.11E-09 4.22E-09 7.83E-08 03/08/97 Yes Yes 895 172 1060 C 10 H 7 0 88 3.19 43.65 2.74E-04 0 2.10E-08 1.20E-09 3.28E-08 03/08/97 Yes Yes 897 172 1060 C 10 H 7 5 88.05 331.92 64.7 5.43E-04 0 2.17E-08 -1.18E-08 8.51E-08 03/08/97 Yes Yes 897 172 1060 C 10 H 7 10 88.1 323.87 74.22 5.87E-04 0 1.37E-08 -1.02E-08 9.79E-08 03/08/97 Yes Yes 897 172 1060 C 10 H 7 15 88.15 329.54 76.16 6.32E-04 0 1.38E-08 -8.31E-09 1.06E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 20 88.2 320.66 74.71 6.93E-04 0 1.50E-08 -1.26E-08 1.16E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 25 88.25 331.18 76.55 7.75E-04 0 1.67E-08 -9.42E-09 1.31E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 30 88.3 21.91 67.85 1.06E-03 0 3.93E-08 1.62E-08 1.70E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 35 88.35 317.79 66.83 1.30E-03 0 4.01E-08 -3.72E-08 2.07E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 40 88.4 343.38 79.89 1.20E-03 0 2.13E-08 -6.52E-09 2.04E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 45 88.45 336.93 82.56 1.16E-03 0 1.47E-08 -6.41E-09 2.00E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 50 88.5 331.04 79.48 1.20E-03 0 2.04E-08 -1.15E-08 2.05E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 55 88.55 346.39 77.19 1.31E-03 0 3.00E-08 -7.42E-09 2.22E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 60 88.6 330.85 79.61 1.40E-03 0 2.34E-08 -1.33E-08 2.39E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 65 88.65 338.6 80.78 1.28E-03 0 2.03E-08 -8.12E-09 2.19E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 70 88.7 16.37 80.14 1.45E-03 0 2.53E-08 7.60E-09 2.48E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 75 88.75 290.32 74.25 1.22E-03 0 1.22E-08 -3.37E-08 2.04E-07 03/08/97 Yes Yes 897 172 1060 C 10 H 7 80 88.8 323.08 70.66 6.72E-04 0 1.89E-08 -1.45E-08 1.10E-07 03/08/97 Yes Yes 897 172 1060 C 11 H 1 0 88.5 43.64 34.33 4.42E-03 0 2.80E-07 2.73E-07 4.32E-07 03/08/97 Yes Yes 899 172 1060 C 11 H 1 5 88.55 88.44 56.56 1.31E-02 0 2.08E-08 7.80E-07 1.89E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 10 88.6 235.77 46.08 1.18E-02 0 -4.87E-07 -7.32E-07 1.47E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 15 88.65 26.82 63.55 4.86E-03 0 2.05E-07 1.06E-07 7.54E-07 03/08/97 Yes Yes 899 172 1060 C 11 H 1 20 88.7 41.86 50.15 4.53E-03 0 2.30E-07 2.10E-07 6.03E-07 03/08/97 Yes Yes 899 172 1060 C 11 H 1 25 88.75 39.95 56.13 4.20E-03 0 1.90E-07 1.63E-07 6.04E-07 03/08/97 Yes Yes 899 172 1060 C 11 H 1 30 88.8 21.19 61.08 4.37E-03 0 2.09E-07 8.28E-08 6.63E-07 03/08/97 Yes Yes 899 172 1060 C 11 H 1 35 88.85 345.17 56.18 5.97E-03 0 3.41E-07 -9.23E-08 8.60E-07 03/08/97 Yes Yes 899 172 1060 C 11 H 1 40 88.9 31.15 60.17 6.77E-03 0 3.06E-07 1.89E-07 1.02E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 45 88.95 38.34 53.18 7.60E-03 0 3.79E-07 3.07E-07 1.06E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 50 89 37.01 57.39 7.68E-03 0 3.50E-07 2.70E-07 1.12E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 55 89.05 34.61 61.63 7.02E-03 0 2.91E-07 2.05E-07 1.07E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 60 89.1 37.93 55.18 7.31E-03 0 3.49E-07 2.78E-07 1.04E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 65 89.15 41.79 56.71 7.18E-03 0 3.12E-07 2.85E-07 1.04E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 70 89.2 27.26 57.59 8.29E-03 0 4.19E-07 2.21E-07 1.21E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 75 89.25 29.49 55.93 1.04E-02 0 5.38E-07 3.11E-07 1.49E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 80 89.3 36.73 55.42 1.19E-02 0 5.73E-07 4.37E-07 1.70E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 85 89.35 42.38 58.17 1.09E-02 0 4.49E-07 4.19E-07 1.60E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 90 89.4 38.67 61.1 1.07E-02 0 4.27E-07 3.50E-07 1.62E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 95 89.45 41.28 67.07 8.84E-03 0 2.74E-07 2.46E-07 1.41E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 100 89.5 28.35 55.87 1.07E-02 0 5.59E-07 3.09E-07 1.53E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 105 89.55 31.94 51.97 1.54E-02 0 8.54E-07 5.45E-07 2.10E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 110 89.6 38.34 60.16 1.64E-02 0 6.78E-07 5.48E-07 2.46E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 115 89.65 33.5 59.19 1.86E-02 0 8.44E-07 5.71E-07 2.77E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 120 89.7 35.36 57.83 2.28E-02 0 1.05E-06 7.63E-07 3.35E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 125 89.75 39.48 58.18 2.51E-02 0 1.08E-06 9.12E-07 3.69E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 130 89.8 33.78 71.91 2.13E-02 0 5.83E-07 3.99E-07 3.51E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 135 89.85 17.53 71.05 1.95E-02 0 6.41E-07 2.07E-07 3.20E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 140 89.9 27.46 60.53 2.50E-02 0 1.16E-06 6.15E-07 3.77E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 145 89.95 21.84 61.71 2.41E-02 0 1.13E-06 4.61E-07 3.68E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 1 150 90 78.75 80.57 1.35E-02 0 4.59E-08 2.36E-07 2.32E-06 03/08/97 Yes Yes 899 172 1060 C 11 H 2 0 90 349.34 51.74 1.25E-02 0 8.09E-07 -1.56E-07 1.71E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 5 90.05 14.63 62.33 2.16E-02 0 1.03E-06 2.75E-07 3.31E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 10 90.1 38.12 69.01 1.86E-02 0 5.56E-07 4.46E-07 3.01E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 15 90.15 62.59 70.85 1.36E-02 0 2.17E-07 4.28E-07 2.22E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 20 90.2 21.64 68.21 1.25E-02 0 4.56E-07 1.85E-07 2.01E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 25 90.25 24.41 64.45 1.91E-02 0 7.96E-07 3.70E-07 2.99E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 30 90.3 38.61 69.62 2.05E-02 0 5.91E-07 4.83E-07 3.33E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 35 90.35 17.35 71.81 1.79E-02 0 5.65E-07 1.80E-07 2.94E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 40 90.4 14.89 71.71 1.70E-02 0 5.48E-07 1.49E-07 2.80E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 45 90.45 48.57 81.96 1.11E-02 0 1.09E-07 1.26E-07 1.91E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 50 90.5 19.7 66.22 1.14E-02 0 4.61E-07 1.69E-07 1.82E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 55 90.55 353.03 79.34 1.33E-02 0 2.59E-07 -3.24E-08 2.27E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 60 90.6 20.46 81.56 9.72E-03 0 1.42E-07 5.41E-08 1.67E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 65 90.65 26 65.22 9.23E-03 0 3.69E-07 1.84E-07 1.45E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 70 90.7 2.56 65.91 1.11E-02 0 4.78E-07 2.18E-08 1.75E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 75 90.75 20.54 79.11 9.95E-03 0 1.87E-07 7.15E-08 1.69E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 80 90.8 40.86 82.5 6.77E-03 0 7.10E-08 6.28E-08 1.16E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 85 90.85 15.91 77.93 5.89E-03 0 1.26E-07 3.66E-08 9.99E-07 03/08/97 Yes Yes 901 172 1060 C 11 H 2 90 90.9 12.66 73.25 5.77E-03 0 1.72E-07 3.95E-08 9.58E-07 03/08/97 Yes Yes 901 172 1060 C 11 H 2 95 90.95 353.67 81.85 5.26E-03 0 7.87E-08 -8.92E-09 9.03E-07 03/08/97 Yes Yes 901 172 1060 C 11 H 2 100 91 337.57 77.77 5.53E-03 0 1.15E-07 -4.85E-08 9.37E-07 03/08/97 Yes Yes 901 172 1060 C 11 H 2 105 91.05 6.95 74.1 8.75E-03 0 2.52E-07 3.15E-08 1.46E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 110 91.1 52.27 78.57 9.37E-03 0 1.21E-07 1.59E-07 1.59E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 115 91.15 13.16 71.87 9.94E-03 0 3.19E-07 7.64E-08 1.64E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 120 91.2 354.16 79.1 1.05E-02 0 2.09E-07 -2.18E-08 1.78E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 125 91.25 15.3 68.93 1.13E-02 0 4.16E-07 1.16E-07 1.83E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 130 91.3 26.13 69.02 1.18E-02 0 4.01E-07 2.01E-07 1.90E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 135 91.35 110.01 83.39 6.55E-03 0 -2.74E-08 7.68E-08 1.13E-06 03/08/97 Yes Yes 901 172 1060 C 11 H 2 140 91.4 349.68 74.37 3.90E-03 0 1.10E-07 -2.04E-08 6.51E-07 03/08/97 Yes Yes 901 172 1060 C 11 H 2 145 91.45 8.32 68.46 3.54E-03 0 1.36E-07 2.04E-08 5.70E-07 03/08/97 Yes Yes 901 172 1060 C 11 H 3 0 91.5 350.31 52.42 1.57E-03 0 1.00E-07 -1.75E-08 2.16E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 5 91.55 5.9 64.27 3.51E-03 0 1.61E-07 1.70E-08 5.49E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 10 91.6 11.65 72.51 3.78E-03 0 1.18E-07 2.49E-08 6.25E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 15 91.65 20.18 73.69 3.54E-03 0 9.89E-08 3.72E-08 5.88E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 20 91.7 7.22 70.27 3.53E-03 0 1.26E-07 1.63E-08 5.76E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 25 91.75 2.92 63.89 4.01E-03 0 1.87E-07 9.76E-09 6.24E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 30 91.8 347.44 74.68 4.33E-03 0 1.18E-07 -2.70E-08 7.24E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 35 91.85 32.45 81.71 3.64E-03 0 4.70E-08 3.06E-08 6.25E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 40 91.9 15.1 68.37 3.85E-03 0 1.45E-07 4.01E-08 6.21E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 45 91.95 21.48 63.87 4.88E-03 0 2.12E-07 8.54E-08 7.60E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 50 92 27.65 74.47 5.15E-03 0 1.30E-07 6.95E-08 8.61E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 55 92.05 13.05 76.22 5.71E-03 0 1.41E-07 3.33E-08 9.62E-07 03/08/97 Yes Yes 903 172 1060 C 11 H 3 60 92.1 19.91 70.23 6.64E-03 0 2.24E-07 8.29E-08 1.08E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 65 92.15 11.39 67.81 7.85E-03 0 3.08E-07 6.35E-08 1.26E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 70 92.2 357.98 74.76 7.91E-03 0 2.20E-07 -7.94E-09 1.32E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 75 92.25 5.29 74.78 7.92E-03 0 2.20E-07 2.08E-08 1.32E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 80 92.3 350.93 69.62 9.19E-03 0 3.35E-07 -5.47E-08 1.49E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 85 92.35 354.53 71.35 1.04E-02 0 3.50E-07 -3.43E-08 1.70E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 90 92.4 62.12 77.19 8.28E-03 0 9.10E-08 1.76E-07 1.40E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 95 92.45 13.45 69.01 7.50E-03 0 2.77E-07 6.77E-08 1.21E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 100 92.5 359.52 70.19 8.80E-03 0 3.16E-07 -2.73E-09 1.43E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 105 92.55 7.17 73.65 9.00E-03 0 2.67E-07 3.43E-08 1.50E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 110 92.6 352.41 77.61 9.13E-03 0 2.06E-07 -2.81E-08 1.55E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 115 92.65 0.67 77.52 8.70E-03 0 1.99E-07 2.37E-09 1.47E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 120 92.7 16.61 70.59 1.01E-02 0 3.41E-07 1.04E-07 1.65E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 125 92.75 21.2 65.77 1.23E-02 0 5.00E-07 1.98E-07 1.95E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 130 92.8 8.84 70.56 1.29E-02 0 4.51E-07 7.17E-08 2.11E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 135 92.85 14.75 75.04 1.13E-02 0 2.98E-07 8.03E-08 1.89E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 140 92.9 14.67 68.72 1.03E-02 0 3.84E-07 1.03E-07 1.67E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 145 92.95 8.68 68.2 9.07E-03 0 3.53E-07 5.51E-08 1.46E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 3 150 93 48.27 74.55 6.81E-03 0 1.28E-07 1.47E-07 1.14E-06 03/08/97 Yes Yes 903 172 1060 C 11 H 4 0 93 344.2 46.44 4.57E-03 0 3.21E-07 -9.29E-08 5.74E-07 03/08/97 Yes Yes 905 172 1060 C 11 H 4 5 93.05 351.96 59.91 9.38E-03 0 4.94E-07 -7.14E-08 1.41E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 10 93.1 19.49 70.15 8.81E-03 0 2.99E-07 1.08E-07 1.44E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 15 93.15 24.38 75.06 8.02E-03 0 2.00E-07 9.25E-08 1.34E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 20 93.2 344.61 73.4 8.98E-03 0 2.62E-07 -7.38E-08 1.49E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 25 93.25 4.02 73.84 9.60E-03 0 2.83E-07 2.03E-08 1.60E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 30 93.3 12.74 70.09 1.02E-02 0 3.58E-07 8.28E-08 1.66E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 35 93.35 10.66 71.63 1.11E-02 0 3.65E-07 7.04E-08 1.83E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 40 93.4 13.93 71.44 1.13E-02 0 3.70E-07 9.39E-08 1.86E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 45 93.45 2.55 65.28 1.22E-02 0 5.41E-07 2.46E-08 1.92E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 50 93.5 11.99 66.46 1.33E-02 0 5.52E-07 1.20E-07 2.12E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 55 93.55 359.01 75.25 1.09E-02 0 2.94E-07 -5.17E-09 1.82E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 60 93.6 32.43 76.27 8.44E-03 0 1.79E-07 1.16E-07 1.42E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 65 93.65 9.24 70.29 7.46E-03 0 2.63E-07 4.38E-08 1.22E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 70 93.7 11.21 72 8.01E-03 0 2.57E-07 5.22E-08 1.32E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 75 93.75 14.46 71.66 8.64E-03 0 2.79E-07 7.36E-08 1.42E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 80 93.8 20.17 64.64 1.02E-02 0 4.33E-07 1.63E-07 1.59E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 85 93.85 26.19 63.16 1.19E-02 0 5.13E-07 2.58E-07 1.85E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 90 93.9 28.07 72.6 1.08E-02 0 3.03E-07 1.65E-07 1.79E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 95 93.95 50.91 78.11 7.71E-03 0 1.06E-07 1.34E-07 1.31E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 100 94 17.2 72.71 6.70E-03 0 2.02E-07 6.39E-08 1.11E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 105 94.05 354.97 66.16 8.48E-03 0 3.62E-07 -3.26E-08 1.34E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 110 94.1 10.12 65.92 1.09E-02 0 4.62E-07 8.44E-08 1.72E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 115 94.15 17.8 65.8 1.32E-02 0 5.48E-07 1.80E-07 2.09E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 120 94.2 23.32 71.6 1.34E-02 0 4.13E-07 1.82E-07 2.21E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 125 94.25 28.71 69.49 1.36E-02 0 4.42E-07 2.47E-07 2.20E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 130 94.3 28.29 61.68 1.57E-02 0 6.95E-07 3.83E-07 2.39E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 135 94.35 21.22 61.97 1.99E-02 0 9.26E-07 3.68E-07 3.05E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 140 94.4 19.67 66.36 1.92E-02 0 7.71E-07 2.82E-07 3.06E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 145 94.45 19.53 71.67 1.52E-02 0 4.77E-07 1.73E-07 2.50E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 4 150 94.5 95.7 72.9 8.89E-03 0 -2.76E-08 2.82E-07 1.47E-06 03/08/97 Yes Yes 905 172 1060 C 11 H 5 0 94.5 4.39 51.38 8.07E-03 0 5.33E-07 4.18E-08 1.09E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 5 94.55 28.72 55.48 1.84E-02 0 9.71E-07 5.44E-07 2.63E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 10 94.6 23.89 65.12 2.03E-02 0 8.28E-07 3.75E-07 3.19E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 15 94.65 41.35 71.26 1.66E-02 0 4.25E-07 3.82E-07 2.73E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 20 94.7 38.49 72.45 1.25E-02 0 3.14E-07 2.55E-07 2.07E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 25 94.75 36.97 71.93 1.13E-02 0 2.97E-07 2.28E-07 1.86E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 30 94.8 16.3 71.83 1.10E-02 0 3.50E-07 1.05E-07 1.82E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 35 94.85 6.36 66.72 1.27E-02 0 5.28E-07 6.02E-08 2.02E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 40 94.9 5.49 67.75 1.46E-02 0 5.85E-07 5.75E-08 2.35E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 45 94.95 24.89 74.52 1.47E-02 0 3.79E-07 1.80E-07 2.46E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 50 95 36.52 74.29 1.17E-02 0 2.71E-07 2.05E-07 1.96E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 55 95.05 29.11 71.86 1.03E-02 0 2.97E-07 1.69E-07 1.70E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 60 95.1 13.34 71.01 9.87E-03 0 3.32E-07 8.04E-08 1.62E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 65 95.15 33.39 66.03 1.07E-02 0 3.85E-07 2.59E-07 1.69E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 70 95.2 26.26 66.87 1.10E-02 0 4.10E-07 2.07E-07 1.75E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 75 95.25 26.63 70.86 1.01E-02 0 3.13E-07 1.61E-07 1.65E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 80 95.3 44.06 68.88 8.55E-03 0 2.35E-07 2.32E-07 1.38E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 85 95.35 46.1 66.92 7.29E-03 0 2.10E-07 2.23E-07 1.16E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 90 95.4 41.14 68.16 6.30E-03 0 1.87E-07 1.67E-07 1.01E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 95 95.45 33.84 66.88 5.95E-03 0 2.06E-07 1.41E-07 9.49E-07 03/08/97 Yes Yes 907 172 1060 C 11 H 5 100 95.5 28.68 65.79 6.45E-03 0 2.46E-07 1.38E-07 1.02E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 105 95.55 26.4 66.22 6.89E-03 0 2.64E-07 1.34E-07 1.09E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 110 95.6 23.47 65.54 7.05E-03 0 2.84E-07 1.26E-07 1.11E-06 03/08/97 Yes Yes 907 172 1060 C 11 H 5 115 95.65 33.34 66.08 6.19E-03 0 2.22E-07 1.50E-07 9.81E-07 03/08/97 Yes Yes 907 172 1060 C 11 H 5 120 95.7 29.44 64.06 5.75E-03 0 2.32E-07 1.34E-07 8.97E-07 03/08/97 Yes Yes 907 172 1060 C 11 H 5 125 95.75 27.34 67.58 5.07E-03 0 1.82E-07 9.64E-08 8.13E-07 03/08/97 Yes Yes 907 172 1060 C 11 H 5 130 95.8 31.46 62.8 4.57E-03 0 1.89E-07 1.18E-07 7.05E-07 03/08/97 Yes Yes 907 172 1060 C 11 H 5 135 95.85 29.35 63.31 4.13E-03 0 1.72E-07 9.87E-08 6.40E-07 03/08/97 Yes Yes 907 172 1060 C 11 H 5 140 95.9 25.19 71.87 3.02E-03 0 9.03E-08 4.34E-08 4.98E-07 03/08/97 Yes Yes 907 172 1060 C 11 H 5 145 95.95 27.68 75.51 2.05E-03 0 4.81E-08 2.58E-08 3.44E-07 03/08/97 Yes Yes 907 172 1060 C 11 H 6 0 96 10.14 44.6 5.87E-04 0 4.37E-08 7.98E-09 7.15E-08 03/08/97 Yes Yes 909 172 1060 C 11 H 6 5 96.05 19.63 61.83 1.06E-03 0 5.00E-08 1.82E-08 1.62E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 10 96.1 26.83 65.65 1.08E-03 0 4.21E-08 2.18E-08 1.71E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 15 96.15 15.93 62.27 1.30E-03 0 6.18E-08 1.81E-08 2.00E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 20 96.2 92.73 79.08 1.15E-03 0 -1.10E-09 2.36E-08 1.96E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 25 96.25 23.22 70.87 9.94E-04 0 3.18E-08 1.39E-08 1.63E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 30 96.3 22.59 65.94 1.01E-03 0 4.02E-08 1.71E-08 1.59E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 35 96.35 44.21 66.21 9.91E-04 0 3.04E-08 3.02E-08 1.57E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 40 96.4 37.87 69.42 8.77E-04 0 2.58E-08 2.05E-08 1.42E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 45 96.45 21.42 64.85 9.69E-04 0 4.07E-08 1.63E-08 1.52E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 50 96.5 26.36 64.9 1.07E-03 0 4.33E-08 2.19E-08 1.69E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 55 96.55 34 66.39 1.08E-03 0 3.82E-08 2.63E-08 1.72E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 60 96.6 31.8 71.8 9.42E-04 0 2.65E-08 1.68E-08 1.55E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 65 96.65 26.69 62.36 9.07E-04 0 3.99E-08 2.05E-08 1.39E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 70 96.7 24.62 56.83 1.13E-03 0 5.95E-08 2.79E-08 1.64E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 75 96.75 343.51 76.22 8.98E-04 0 2.18E-08 -6.59E-09 1.51E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 80 96.8 39.6 74.67 7.94E-04 0 1.72E-08 1.45E-08 1.33E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 85 96.85 28.79 69.43 7.85E-04 0 2.56E-08 1.44E-08 1.27E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 90 96.9 21.55 70.69 8.69E-04 0 2.84E-08 1.15E-08 1.42E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 95 96.95 37.29 71.05 9.20E-04 0 2.52E-08 1.96E-08 1.51E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 100 97 40.98 71.76 9.19E-04 0 2.30E-08 2.05E-08 1.51E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 105 97.05 30.33 69.01 1.01E-03 0 3.33E-08 1.99E-08 1.64E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 110 97.1 32.58 66.79 1.07E-03 0 3.78E-08 2.47E-08 1.71E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 115 97.15 25.87 71.44 9.94E-04 0 3.02E-08 1.50E-08 1.63E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 120 97.2 28.39 72.85 9.36E-04 0 2.57E-08 1.42E-08 1.55E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 125 97.25 34.62 68.1 8.92E-04 0 2.90E-08 2.05E-08 1.43E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 130 97.3 26.84 68 9.97E-04 0 3.53E-08 1.83E-08 1.60E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 135 97.35 29.56 69.48 1.02E-03 0 3.29E-08 1.91E-08 1.65E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 140 97.4 28.2 64.91 1.08E-03 0 4.28E-08 2.35E-08 1.70E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 145 97.45 31.35 64.97 1.06E-03 0 4.05E-08 2.52E-08 1.66E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 6 150 97.5 112 78.85 7.21E-04 0 -5.54E-09 1.40E-08 1.23E-07 03/08/97 Yes Yes 909 172 1060 C 11 H 7 0 97.5 19.88 46.82 4.40E-04 0 3.01E-08 1.11E-08 5.57E-08 03/08/97 Yes Yes 911 172 1060 C 11 H 7 5 97.55 24.72 56.32 8.82E-04 0 4.71E-08 2.22E-08 1.27E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 10 97.6 35 65.4 8.74E-04 0 3.16E-08 2.26E-08 1.38E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 15 97.65 34.89 68.96 8.15E-04 0 2.54E-08 1.81E-08 1.32E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 20 97.7 33.56 66.46 8.71E-04 0 3.08E-08 2.09E-08 1.38E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 25 97.75 345.36 70.69 9.12E-04 0 3.10E-08 -8.27E-09 1.49E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 30 97.8 49.28 64.06 9.81E-04 0 2.97E-08 3.53E-08 1.53E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 35 97.85 45.72 69.99 8.42E-04 0 2.13E-08 2.24E-08 1.37E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 40 97.9 27.16 71.46 8.09E-04 0 2.43E-08 1.27E-08 1.33E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 45 97.95 29.99 74.12 7.39E-04 0 1.86E-08 1.10E-08 1.23E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 50 98 32.88 73.29 7.55E-04 0 1.93E-08 1.28E-08 1.25E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 55 98.05 39.74 68.2 8.80E-04 0 2.67E-08 2.27E-08 1.42E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 60 98.1 0.38 64.11 1.23E-03 0 5.71E-08 3.91E-10 1.92E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 65 98.15 10.82 76.12 1.67E-03 0 4.17E-08 8.15E-09 2.81E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 70 98.2 116.78 65.2 1.21E-03 0 -2.44E-08 4.93E-08 1.91E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 75 98.25 63.93 61.12 7.57E-04 0 1.70E-08 3.56E-08 1.15E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 80 98.3 42.97 50.43 7.82E-04 0 3.86E-08 3.68E-08 1.04E-07 03/08/97 Yes Yes 911 172 1060 C 11 H 7 85 98.35 18.79 25.88 1.60E-03 0 1.44E-07 5.03E-08 1.21E-07 03/08/97 Yes Yes 911 172 1060 C 12 H 1 0 98 305.54 25.56 1.03E-03 0 5.75E-08 -8.23E-08 7.73E-08 03/08/97 Yes Yes 913 172 1060 C 12 H 1 5 98.05 19.49 45.38 1.97E-03 0 1.38E-07 5.01E-08 2.43E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 10 98.1 19.18 63.55 2.34E-03 0 1.04E-07 3.71E-08 3.63E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 15 98.15 36.99 66.73 2.44E-03 0 8.16E-08 6.29E-08 3.88E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 20 98.2 344.85 76.11 2.25E-03 0 5.53E-08 -1.53E-08 3.79E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 25 98.25 10.78 62.68 2.40E-03 0 1.15E-07 2.24E-08 3.70E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 30 98.3 29.94 56.07 3.02E-03 0 1.55E-07 9.13E-08 4.35E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 35 98.35 25.81 62.56 3.14E-03 0 1.38E-07 6.84E-08 4.83E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 40 98.4 24.77 64.53 3.01E-03 0 1.25E-07 5.88E-08 4.71E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 45 98.45 24.1 67.51 2.73E-03 0 1.01E-07 4.62E-08 4.37E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 50 98.5 25.68 63.41 2.75E-03 0 1.18E-07 5.78E-08 4.26E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 55 98.55 21.77 64.73 2.66E-03 0 1.12E-07 4.57E-08 4.17E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 60 98.6 30.54 64.91 2.64E-03 0 1.02E-07 6.16E-08 4.14E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 65 98.65 23.75 68.56 2.56E-03 0 9.09E-08 4.09E-08 4.13E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 70 98.7 22.3 65.96 2.64E-03 0 1.05E-07 4.42E-08 4.17E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 75 98.75 23.54 63.89 2.71E-03 0 1.16E-07 5.17E-08 4.22E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 80 98.8 23.65 66.18 2.72E-03 0 1.07E-07 4.78E-08 4.32E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 85 98.85 24.03 63.19 2.85E-03 0 1.25E-07 5.69E-08 4.42E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 90 98.9 28.06 63.46 2.87E-03 0 1.20E-07 6.54E-08 4.45E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 95 98.95 24.77 67.2 2.47E-03 0 9.24E-08 4.36E-08 3.96E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 100 99 26.18 65.65 2.34E-03 0 9.17E-08 4.61E-08 3.69E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 105 99.05 33.76 62.79 2.27E-03 0 9.13E-08 6.24E-08 3.49E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 110 99.1 15.24 65.29 2.16E-03 0 9.26E-08 2.58E-08 3.41E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 115 99.15 15.97 71.78 2.08E-03 0 6.62E-08 1.94E-08 3.42E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 120 99.2 35.7 66.38 2.03E-03 0 7.00E-08 5.14E-08 3.22E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 125 99.25 21.22 66.54 2.19E-03 0 8.62E-08 3.42E-08 3.48E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 130 99.3 15.52 70.66 2.05E-03 0 6.92E-08 1.97E-08 3.35E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 135 99.35 25.47 69.47 1.91E-03 0 6.41E-08 3.12E-08 3.10E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 140 99.4 24.79 65.44 1.87E-03 0 7.50E-08 3.54E-08 2.95E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 145 99.45 29.64 66.38 1.69E-03 0 6.24E-08 3.63E-08 2.69E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 1 150 99.5 117.84 76.32 8.51E-04 0 -9.97E-09 1.93E-08 1.43E-07 03/08/97 Yes Yes 913 172 1060 C 12 H 2 0 99.5 354.5 52.28 8.10E-04 0 5.23E-08 -5.15E-09 1.11E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 5 99.55 5.41 61.7 1.77E-03 0 8.86E-08 8.58E-09 2.70E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 10 99.6 12.84 63.21 2.21E-03 0 1.03E-07 2.40E-08 3.42E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 15 99.65 43.61 47.85 4.15E-03 0 2.14E-07 2.08E-07 5.33E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 20 99.7 168.43 77.04 3.74E-03 0 -8.71E-08 1.82E-08 6.31E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 25 99.75 329.62 84.38 2.46E-03 0 2.20E-08 -1.32E-08 4.24E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 30 99.8 355.2 77.11 2.05E-03 0 4.83E-08 -4.14E-09 3.46E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 35 99.85 350.95 73.14 1.97E-03 0 5.99E-08 -9.75E-09 3.27E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 40 99.9 8.44 62.24 2.57E-03 0 1.26E-07 1.91E-08 3.95E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 45 99.95 354.48 71.89 2.55E-03 0 8.36E-08 -8.26E-09 4.20E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 50 100 18.58 80.5 1.87E-03 0 3.10E-08 1.06E-08 3.19E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 55 100.05 20.78 72.23 1.74E-03 0 5.27E-08 2.04E-08 2.87E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 60 100.1 45.98 66.56 1.98E-03 0 5.80E-08 6.14E-08 3.15E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 65 100.15 323.96 86.93 2.12E-03 0 9.73E-09 -7.24E-09 3.67E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 70 100.2 355.17 66.08 2.42E-03 0 1.04E-07 -8.96E-09 3.83E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 75 100.25 32.86 74.36 2.63E-03 0 6.33E-08 4.18E-08 4.40E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 80 100.3 60.31 73.43 2.17E-03 0 3.25E-08 5.83E-08 3.60E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 85 100.35 41.65 64.68 2.33E-03 0 7.90E-08 7.19E-08 3.65E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 90 100.4 338.94 80.74 2.09E-03 0 3.33E-08 -1.31E-08 3.57E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 95 100.45 6.81 75.74 1.93E-03 0 5.00E-08 6.10E-09 3.24E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 100 100.5 27.06 77.25 1.77E-03 0 3.70E-08 1.93E-08 3.00E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 105 100.55 5.15 72.79 1.94E-03 0 6.06E-08 5.58E-09 3.21E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 110 100.6 359.88 74.32 2.26E-03 0 6.49E-08 -1.43E-10 3.78E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 115 100.65 53.66 72.4 1.86E-03 0 3.53E-08 4.90E-08 3.07E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 120 100.7 14.51 71.97 1.77E-03 0 5.62E-08 1.49E-08 2.92E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 125 100.75 21.63 67.91 1.92E-03 0 7.11E-08 2.88E-08 3.08E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 130 100.8 24.73 72.7 1.93E-03 0 5.52E-08 2.60E-08 3.19E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 135 100.85 17.43 73.07 1.78E-03 0 5.24E-08 1.68E-08 2.95E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 140 100.9 12.33 65.22 1.76E-03 0 7.66E-08 1.71E-08 2.78E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 2 145 100.95 38.25 74.6 1.33E-03 0 2.94E-08 2.37E-08 2.22E-07 03/08/97 Yes Yes 915 172 1060 C 12 H 3 0 101 15.83 48.5 1.36E-03 0 9.22E-08 2.68E-08 1.77E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 5 101.05 33.02 77.51 2.06E-03 0 3.97E-08 2.64E-08 3.49E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 10 101.1 21.49 72.73 2.16E-03 0 6.32E-08 2.54E-08 3.57E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 15 101.15 26.41 48.57 3.75E-03 0 2.36E-07 1.20E-07 4.88E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 20 101.2 166.94 88.62 3.75E-03 0 -9.32E-09 2.21E-09 6.51E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 25 101.25 303.1 83.89 2.69E-03 0 1.66E-08 -2.60E-08 4.63E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 30 101.3 13.84 68.13 2.59E-03 0 9.92E-08 2.50E-08 4.16E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 35 101.35 85.24 80.76 2.03E-03 0 2.86E-09 3.52E-08 3.47E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 40 101.4 208.47 69.76 9.05E-04 0 -2.92E-08 -1.62E-08 1.47E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 45 101.45 1.75 56.65 1.53E-03 0 8.89E-08 2.78E-09 2.21E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 50 101.5 40.2 61.31 2.32E-03 0 9.02E-08 7.80E-08 3.53E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 55 101.55 42.38 74.44 2.42E-03 0 5.09E-08 4.75E-08 4.05E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 60 101.6 32.64 78.79 2.23E-03 0 3.87E-08 2.53E-08 3.79E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 65 101.65 35.65 68.05 2.23E-03 0 7.20E-08 5.28E-08 3.59E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 70 101.7 22.12 68.44 2.55E-03 0 9.21E-08 3.83E-08 4.12E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 75 101.75 347.67 69.42 2.94E-03 0 1.07E-07 -2.39E-08 4.77E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 80 101.8 80.87 81.45 2.48E-03 0 6.20E-09 3.94E-08 4.25E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 85 101.85 35.71 75.82 1.96E-03 0 4.13E-08 3.04E-08 3.29E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 90 101.9 19.04 67.3 1.99E-03 0 7.69E-08 2.71E-08 3.18E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 95 101.95 5.27 77.44 1.81E-03 0 4.15E-08 3.92E-09 3.06E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 100 102 21.35 74.06 1.57E-03 0 4.25E-08 1.70E-08 2.61E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 105 102.05 29.6 70.52 1.42E-03 0 4.38E-08 2.55E-08 2.33E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 110 102.1 34.12 71.85 1.21E-03 0 3.31E-08 2.30E-08 2.00E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 115 102.15 32.83 75.28 1.06E-03 0 2.41E-08 1.59E-08 1.78E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 120 102.2 8.61 77.03 1.03E-03 0 2.43E-08 3.77E-09 1.75E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 125 102.25 28.63 80.05 1.16E-03 0 1.87E-08 1.05E-08 1.99E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 130 102.3 68.35 44.48 2.16E-03 0 6.04E-08 1.56E-07 2.63E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 135 102.35 6.05 51.81 4.04E-03 0 2.63E-07 2.86E-08 5.51E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 140 102.4 288.51 42.31 2.97E-03 0 7.39E-08 -2.26E-07 3.47E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 145 102.45 261.45 70.11 1.33E-03 0 -7.16E-09 -4.87E-08 2.17E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 3 150 102.5 83.44 78.9 7.22E-04 0 1.68E-09 1.50E-08 1.23E-07 03/08/97 Yes Yes 917 172 1060 C 12 H 4 0 102.5 39.67 23.4 2.00E-03 0 1.50E-07 1.27E-07 1.38E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 5 102.55 36.82 57.31 2.16E-03 0 9.92E-08 7.60E-08 3.16E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 10 102.6 332.43 75.66 2.16E-03 0 5.03E-08 -2.68E-08 3.63E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 15 102.65 12.35 72.52 1.98E-03 0 6.16E-08 1.38E-08 3.27E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 20 102.7 12.21 70.16 1.94E-03 0 6.84E-08 1.51E-08 3.17E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 25 102.75 2.25 73.59 1.91E-03 0 5.72E-08 2.30E-09 3.18E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 30 102.8 344.96 71.33 2.02E-03 0 6.63E-08 -1.82E-08 3.32E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 35 102.85 27.02 74.43 2.01E-03 0 5.09E-08 2.65E-08 3.35E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 40 102.9 25.41 69.66 2.12E-03 0 7.06E-08 3.43E-08 3.44E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 45 102.95 32.6 80.38 1.86E-03 0 2.78E-08 1.82E-08 3.18E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 50 103 5.47 73.77 1.67E-03 0 4.92E-08 4.82E-09 2.77E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 55 103.05 35.8 78.45 1.40E-03 0 2.41E-08 1.78E-08 2.37E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 60 103.1 286.81 81.35 1.09E-03 0 5.04E-09 -1.71E-08 1.88E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 65 103.15 26.43 80.15 1.17E-03 0 1.90E-08 9.65E-09 1.99E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 70 103.2 358.51 73.77 1.59E-03 0 4.72E-08 -1.25E-09 2.65E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 75 103.25 351.92 71.3 2.01E-03 0 6.76E-08 -9.81E-09 3.30E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 80 103.3 359.13 76.45 2.10E-03 0 5.21E-08 -8.12E-10 3.54E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 85 103.35 14.16 77.79 1.98E-03 0 4.30E-08 1.11E-08 3.35E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 90 103.4 357.96 75.29 1.78E-03 0 4.79E-08 -1.74E-09 2.99E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 95 103.45 350.79 71.45 1.80E-03 0 6.01E-08 -9.97E-09 2.97E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 100 103.5 358.79 73.23 1.82E-03 0 5.56E-08 -1.20E-09 3.02E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 105 103.55 355.47 74.25 1.72E-03 0 4.94E-08 -4.01E-09 2.87E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 110 103.6 12.51 73.69 1.76E-03 0 5.11E-08 1.16E-08 2.93E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 115 103.65 15.18 72.37 1.81E-03 0 5.61E-08 1.56E-08 2.99E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 120 103.7 345.75 67.72 2.08E-03 0 8.11E-08 -2.11E-08 3.34E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 125 103.75 56.29 77.05 1.72E-03 0 2.26E-08 3.47E-08 2.90E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 130 103.8 19.15 70.89 1.50E-03 0 4.91E-08 1.74E-08 2.45E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 135 103.85 24.83 64.65 1.52E-03 0 6.28E-08 2.97E-08 2.39E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 140 103.9 19.98 64.19 1.61E-03 0 6.99E-08 2.60E-08 2.52E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 145 103.95 6.22 64.68 1.46E-03 0 6.56E-08 7.31E-09 2.28E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 4 150 104 33.88 79.99 8.22E-04 0 1.26E-08 8.63E-09 1.40E-07 03/08/97 Yes Yes 919 172 1060 C 12 H 5 0 104 1.19 50.04 5.86E-04 0 3.99E-08 8.48E-10 7.79E-08 03/08/97 Yes Yes 921 172 1060 C 12 H 5 5 104.05 6.77 62.69 1.06E-03 0 5.14E-08 6.23E-09 1.64E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 10 104.1 0.24 74.9 1.04E-03 0 2.88E-08 1.25E-10 1.74E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 15 104.15 25.5 79.75 8.99E-04 0 1.53E-08 7.47E-09 1.53E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 20 104.2 357.38 74.04 9.09E-04 0 2.65E-08 -1.24E-09 1.52E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 25 104.25 358.91 73.11 1.06E-03 0 3.26E-08 -6.36E-10 1.75E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 30 104.3 13.47 76.23 1.12E-03 0 2.75E-08 6.72E-09 1.88E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 35 104.35 3.16 69.42 1.27E-03 0 4.72E-08 2.66E-09 2.06E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 40 104.4 0.08 73.71 1.40E-03 0 4.17E-08 5.73E-11 2.33E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 45 104.45 19.56 81.29 1.21E-03 0 1.83E-08 6.64E-09 2.07E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 50 104.5 17.88 81.88 8.98E-04 0 1.28E-08 4.23E-09 1.54E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 55 104.55 347.56 70.18 9.03E-04 0 3.17E-08 -7.16E-09 1.47E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 60 104.6 6.52 79.03 1.03E-03 0 2.07E-08 2.41E-09 1.75E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 65 104.65 38.2 75.66 9.53E-04 0 1.97E-08 1.58E-08 1.60E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 70 104.7 18.99 74.94 9.88E-04 0 2.57E-08 9.06E-09 1.65E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 75 104.75 26.79 73.4 9.33E-04 0 2.52E-08 1.30E-08 1.55E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 80 104.8 316.68 79.36 8.99E-04 0 1.28E-08 -1.24E-08 1.53E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 85 104.85 238.22 69.37 1.01E-03 0 -1.98E-08 -3.27E-08 1.63E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 90 104.9 51.16 82.12 8.68E-04 0 7.92E-09 1.01E-08 1.49E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 95 104.95 17.03 77.24 8.29E-04 0 1.86E-08 5.82E-09 1.40E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 100 105 356.58 81.37 8.64E-04 0 1.37E-08 -8.38E-10 1.48E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 105 105.05 358.3 78.98 8.64E-04 0 1.75E-08 -5.33E-10 1.47E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 110 105.1 6.81 77.28 9.05E-04 0 2.10E-08 2.56E-09 1.53E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 115 105.15 356.12 78.09 9.44E-04 0 2.06E-08 -1.43E-09 1.60E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 120 105.2 6.22 73.32 1.10E-03 0 3.32E-08 3.70E-09 1.82E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 125 105.25 5.6 73.97 1.25E-03 0 3.64E-08 3.65E-09 2.08E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 130 105.3 7.93 77.18 1.23E-03 0 2.87E-08 4.09E-09 2.08E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 135 105.35 15.69 73.37 1.19E-03 0 3.48E-08 9.99E-09 1.98E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 140 105.4 12.21 68.85 1.32E-03 0 4.93E-08 1.09E-08 2.13E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 145 105.45 7.21 70.14 1.34E-03 0 4.77E-08 6.17E-09 2.18E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 5 150 105.5 87.04 80.07 8.62E-04 0 8.16E-10 1.61E-08 1.47E-07 03/08/97 Yes Yes 921 172 1060 C 12 H 6 0 105.5 7.23 53.44 6.83E-04 0 4.28E-08 5.55E-09 9.51E-08 03/08/97 Yes Yes 923 172 1060 C 12 H 6 5 105.55 12.56 63.48 1.60E-03 0 7.40E-08 1.68E-08 2.48E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 10 105.6 15.44 73.37 1.72E-03 0 5.04E-08 1.42E-08 2.86E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 15 105.65 9.57 75.3 1.62E-03 0 4.30E-08 7.41E-09 2.72E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 20 105.7 22.59 76.58 1.49E-03 0 3.39E-08 1.44E-08 2.52E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 25 105.75 27.4 76.29 1.23E-03 0 2.74E-08 1.45E-08 2.07E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 30 105.8 10.88 75.11 1.13E-03 0 3.03E-08 5.95E-09 1.90E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 35 105.85 11.68 72.8 1.29E-03 0 3.98E-08 8.41E-09 2.14E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 40 105.9 20.91 68.96 1.87E-03 0 6.64E-08 2.60E-08 3.02E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 45 105.95 11.41 64.03 2.90E-03 0 1.32E-07 2.72E-08 4.51E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 50 106 14.1 64.86 3.80E-03 0 1.66E-07 4.26E-08 5.96E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 55 106.05 14.64 77 2.93E-03 0 6.76E-08 1.81E-08 4.95E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 60 106.1 4.73 76.88 2.23E-03 0 5.34E-08 4.52E-09 3.76E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 65 106.15 10.79 74.54 2.13E-03 0 5.91E-08 1.15E-08 3.55E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 70 106.2 17.51 73.9 1.82E-03 0 5.10E-08 1.65E-08 3.03E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 75 106.25 12.82 71.11 1.72E-03 0 5.75E-08 1.34E-08 2.82E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 80 106.3 25.48 70.78 1.68E-03 0 5.28E-08 2.57E-08 2.74E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 85 106.35 28.97 67.95 1.57E-03 0 5.47E-08 3.10E-08 2.52E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 90 106.4 19.07 70.3 1.56E-03 0 5.26E-08 1.86E-08 2.54E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 95 106.45 22.45 69.88 1.44E-03 0 4.86E-08 2.05E-08 2.35E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 100 106.5 20.44 66.46 1.33E-03 0 5.28E-08 2.01E-08 2.11E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 105 106.55 15.04 64.63 1.28E-03 0 5.63E-08 1.55E-08 2.01E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 110 106.6 20.53 61.9 1.47E-03 0 6.87E-08 2.63E-08 2.24E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 115 106.65 23.46 61.03 1.77E-03 0 8.36E-08 3.71E-08 2.69E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 120 106.7 24.74 62.73 2.05E-03 0 9.07E-08 4.27E-08 3.17E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 125 106.75 22.2 67.56 2.08E-03 0 7.79E-08 3.25E-08 3.33E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 130 106.8 13.61 64.34 2.29E-03 0 1.02E-07 2.53E-08 3.58E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 135 106.85 18.06 58.34 2.78E-03 0 1.47E-07 4.92E-08 4.11E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 140 106.9 22.03 45.08 4.03E-03 0 2.80E-07 1.16E-07 4.95E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 145 106.95 24.51 37.62 6.00E-03 0 4.58E-07 2.14E-07 6.35E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 6 150 107 39.92 48.91 3.96E-03 0 2.12E-07 1.81E-07 5.17E-07 03/08/97 Yes Yes 923 172 1060 C 12 H 7 0 107 15.54 33.02 2.61E-03 0 2.24E-07 6.36E-08 2.46E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 5 107.05 21.81 40.35 4.72E-03 0 3.55E-07 1.45E-07 5.30E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 10 107.1 28.01 48.59 3.85E-03 0 2.39E-07 1.30E-07 5.01E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 15 107.15 31.99 46.4 3.38E-03 0 2.10E-07 1.34E-07 4.25E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 20 107.2 33.94 52.11 2.29E-03 0 1.23E-07 8.50E-08 3.13E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 25 107.25 24.66 45.71 3.44E-03 0 2.31E-07 1.09E-07 4.27E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 30 107.3 23.87 46.46 4.29E-03 0 2.87E-07 1.30E-07 5.40E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 35 107.35 27.39 43.13 5.79E-03 0 3.98E-07 2.11E-07 6.87E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 40 107.4 31.05 42.43 7.70E-03 0 5.17E-07 3.18E-07 9.01E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 45 107.45 30.44 47.29 7.48E-03 0 4.64E-07 2.79E-07 9.53E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 50 107.5 27.94 53.25 6.48E-03 0 3.63E-07 1.97E-07 9.00E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 55 107.55 29.77 50.19 7.22E-03 0 4.26E-07 2.49E-07 9.62E-07 03/08/97 Yes Yes 925 172 1060 C 12 H 7 60 107.6 22.98 46.78 9.88E-03 0 6.61E-07 2.86E-07 1.25E-06 03/08/97 Yes Yes 925 172 1060 C 12 H 7 65 107.65 18.2 51.65 1.49E-02 0 9.28E-07 3.12E-07 2.02E-06 03/08/97 Yes Yes 925 172 1060 C 12 H 7 70 107.7 32.9 74.7 1.41E-02 0 3.32E-07 2.20E-07 2.36E-06 03/08/97 Yes Yes 925 172 1060 C 12 H 7 75 107.75 52.38 79.63 8.09E-03 0 9.43E-08 1.25E-07 1.38E-06 03/08/97 Yes Yes 925 172 1060 C 12 H 7 80 107.8 25.78 45.28 6.53E-03 0 4.39E-07 2.17E-07 8.05E-07 03/08/97 Yes Yes 925 172 1060 C 13 H 1 0 107.5 184.81 19.1 2.69E-02 0 -2.69E-06 -2.31E-07 1.53E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 5 107.55 187.13 73.48 3.18E-02 0 -9.52E-07 -1.22E-07 5.29E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 10 107.6 355.94 19.64 3.13E-01 0 3.12E-05 -2.27E-06 1.83E-05 03/08/97 Yes Yes 927 172 1060 C 13 H 1 15 107.65 0.98 59.71 1.99E-01 0 1.06E-05 1.85E-07 2.97E-05 03/08/97 Yes Yes 927 172 1060 C 13 H 1 20 107.7 167.36 43.64 7.33E-02 0 -5.49E-06 1.26E-06 8.77E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 25 107.75 132.01 78.61 2.51E-02 0 -3.52E-07 3.99E-07 4.26E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 30 107.8 79.98 79.03 2.36E-02 0 8.28E-08 4.79E-07 4.01E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 35 107.85 85.07 70.18 2.40E-02 0 7.41E-08 8.78E-07 3.91E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 40 107.9 115.04 60.35 2.52E-02 0 -5.59E-07 1.22E-06 3.79E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 45 107.95 109.39 76.01 2.02E-02 0 -1.72E-07 5.00E-07 3.40E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 50 108 325.1 20.69 1.00E-01 0 8.14E-06 -5.81E-06 6.13E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 55 108.05 136.07 63.87 4.93E-02 0 -1.66E-06 1.63E-06 7.67E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 60 108.1 51.28 -0.9 1.80E-02 0 1.20E-06 1.53E-06 -4.92E-08 03/08/97 Yes Yes 927 172 1060 C 13 H 1 65 108.15 336.56 13.41 1.36E-01 0 1.29E-05 -5.70E-06 5.46E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 70 108.2 335.25 46.49 7.95E-02 0 5.27E-06 -2.49E-06 1.00E-05 03/08/97 Yes Yes 927 172 1060 C 13 H 1 75 108.25 331.87 45.78 2.18E-01 0 1.42E-05 -7.78E-06 2.71E-05 03/08/97 Yes Yes 927 172 1060 C 13 H 1 80 108.3 154.7 43.38 1.78E-01 0 -1.24E-05 5.98E-06 2.11E-05 03/08/97 Yes Yes 927 172 1060 C 13 H 1 85 108.35 334.8 28.17 2.12E-01 0 1.79E-05 -8.63E-06 1.73E-05 03/08/97 Yes Yes 927 172 1060 C 13 H 1 90 108.4 358.27 36.8 3.89E-01 0 3.30E-05 -1.02E-06 4.04E-05 03/08/97 Yes Yes 927 172 1060 C 13 H 1 95 108.45 119.76 56.77 1.32E-01 0 -3.80E-06 6.80E-06 1.91E-05 03/08/97 Yes Yes 927 172 1060 C 13 H 1 100 108.5 172.57 66.77 5.23E-02 0 -2.17E-06 2.90E-07 8.33E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 105 108.55 305.1 87.28 3.86E-02 0 1.11E-07 -1.62E-07 6.68E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 110 108.6 44.42 83.95 3.36E-02 0 2.69E-07 2.69E-07 5.80E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 115 108.65 47.06 81.11 3.15E-02 0 3.51E-07 3.86E-07 5.39E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 120 108.7 15.1 82.34 3.30E-02 0 4.50E-07 1.24E-07 5.66E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 125 108.75 38 72.54 3.78E-02 0 9.49E-07 7.58E-07 6.26E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 130 108.8 62.06 72.86 3.78E-02 0 5.54E-07 1.07E-06 6.27E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 1 135 108.85 124.75 83.55 2.37E-02 0 -1.61E-07 2.38E-07 4.09E-06 03/08/97 Yes Yes 927 172 1060 C 13 H 2 0 108.87 7.41 62.36 1.49E-02 0 7.25E-07 9.64E-08 2.28E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 5 108.92 26.58 78.63 3.25E-02 0 6.08E-07 3.11E-07 5.53E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 10 108.97 5.46 79.42 4.14E-02 0 8.02E-07 7.84E-08 7.05E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 15 109.02 27.38 78.89 4.94E-02 0 8.96E-07 4.75E-07 8.40E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 20 109.07 6.16 86.11 4.96E-02 0 3.55E-07 3.92E-08 8.57E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 25 109.12 345.5 82.93 4.92E-02 0 6.22E-07 -1.64E-07 8.47E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 30 109.17 353.72 74.3 5.29E-02 0 1.51E-06 -1.70E-07 8.83E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 35 109.22 27.75 79.29 5.45E-02 0 9.51E-07 5.11E-07 9.28E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 40 109.27 52.65 77.09 5.28E-02 0 7.58E-07 1.02E-06 8.92E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 45 109.32 18.65 81.78 5.16E-02 0 7.41E-07 2.56E-07 8.85E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 50 109.37 0.67 83.7 4.97E-02 0 5.78E-07 6.93E-09 8.57E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 55 109.42 65.51 88.72 4.50E-02 0 4.40E-08 9.88E-08 7.79E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 60 109.47 59.99 88.04 3.47E-02 0 6.31E-08 1.12E-07 6.02E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 65 109.52 2.43 79.3 3.25E-02 0 6.38E-07 2.77E-08 5.53E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 70 109.57 19.95 76.04 3.46E-02 0 8.32E-07 3.09E-07 5.82E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 75 109.62 216.64 87.27 2.67E-02 0 -1.08E-07 -8.20E-08 4.62E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 80 109.67 265.95 81.18 1.70E-02 0 -1.96E-08 -2.83E-07 2.92E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 85 109.72 50.01 76.61 1.89E-02 0 2.99E-07 3.65E-07 3.20E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 90 109.77 27.33 76.55 3.07E-02 0 6.73E-07 3.56E-07 5.18E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 95 109.82 18.39 79.58 3.68E-02 0 6.70E-07 2.28E-07 6.27E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 100 109.87 33.85 80.17 3.72E-02 0 5.60E-07 3.84E-07 6.36E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 105 109.92 16.57 81.84 3.36E-02 0 4.85E-07 1.48E-07 5.77E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 110 109.97 17.15 81.17 3.22E-02 0 5.00E-07 1.58E-07 5.51E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 115 110.02 48.47 82.2 2.80E-02 0 2.67E-07 3.09E-07 4.81E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 120 110.07 6.89 73.95 2.78E-02 0 8.10E-07 1.00E-07 4.63E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 125 110.12 356.58 81.98 2.95E-02 0 4.36E-07 -2.67E-08 5.07E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 130 110.17 22.75 85.67 2.44E-02 0 1.81E-07 7.75E-08 4.23E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 135 110.22 16.88 79.09 2.48E-02 0 4.77E-07 1.48E-07 4.23E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 140 110.27 14.92 75.6 2.39E-02 0 6.10E-07 1.66E-07 4.02E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 145 110.32 1.66 83.11 2.05E-02 0 2.60E-07 7.69E-09 3.52E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 2 150 110.37 154.08 78.85 1.01E-02 0 -1.87E-07 9.28E-08 1.72E-06 03/08/97 Yes Yes 929 172 1060 C 13 H 3 0 110.37 336.29 57.35 3.43E-03 0 1.80E-07 -8.08E-08 5.01E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 3 5 110.42 336 72.32 8.91E-03 0 2.62E-07 -1.19E-07 1.47E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 10 110.47 2.31 77.2 1.24E-02 0 2.90E-07 1.20E-08 2.09E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 15 110.52 12.99 74.46 1.67E-02 0 4.61E-07 1.09E-07 2.78E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 20 110.57 354.87 75.39 1.96E-02 0 5.23E-07 -4.80E-08 3.29E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 25 110.62 350.1 79.33 1.99E-02 0 3.85E-07 -6.88E-08 3.39E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 30 110.67 341.38 83.54 1.75E-02 0 1.98E-07 -6.83E-08 3.02E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 35 110.72 39.04 79.12 1.57E-02 0 2.44E-07 2.02E-07 2.67E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 40 110.77 344.92 86.18 1.14E-02 0 7.76E-08 -2.14E-08 1.97E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 45 110.82 330.72 81.09 9.71E-03 0 1.39E-07 -7.98E-08 1.66E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 50 110.87 166.01 80.15 7.17E-03 0 -1.26E-07 3.21E-08 1.22E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 55 110.92 168.09 78.43 5.83E-03 0 -1.21E-07 2.62E-08 9.91E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 3 60 110.97 351.89 62.02 1.62E-02 0 7.96E-07 -1.16E-07 2.47E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 65 111.02 1.98 68.23 3.35E-02 0 1.32E-06 4.66E-08 5.40E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 70 111.07 350.24 75.29 3.97E-02 0 1.05E-06 -1.86E-07 6.66E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 75 111.12 340.07 75.33 4.04E-02 0 1.02E-06 -3.78E-07 6.77E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 80 111.17 10.39 75.42 3.61E-02 0 9.47E-07 1.77E-07 6.05E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 85 111.22 50.46 83.16 2.46E-02 0 1.97E-07 2.45E-07 4.23E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 90 111.27 161.4 82.47 1.25E-02 0 -1.65E-07 5.68E-08 2.15E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 95 111.32 334.34 76.04 8.46E-03 0 1.95E-07 -9.59E-08 1.42E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 100 111.37 9.8 78.66 8.02E-03 0 1.65E-07 2.91E-08 1.36E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 105 111.42 25.06 79.7 6.27E-03 0 1.08E-07 5.15E-08 1.07E-06 03/08/97 Yes Yes 931 172 1060 C 13 H 3 110 111.47 17.75 75.58 5.89E-03 0 1.48E-07 4.85E-08 9.89E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 3 115 111.52 28.34 83.31 4.82E-03 0 5.25E-08 2.89E-08 8.31E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 3 120 111.57 42.85 79.77 3.95E-03 0 5.45E-08 5.17E-08 6.74E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 3 125 111.62 79.43 77.23 3.12E-03 0 1.34E-08 7.36E-08 5.28E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 3 130 111.67 53.76 83.48 2.39E-03 0 1.70E-08 2.38E-08 4.12E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 3 135 111.72 29.82 79.12 2.63E-03 0 4.56E-08 2.67E-08 4.48E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 3 140 111.77 41.89 73.42 3.52E-03 0 7.94E-08 7.28E-08 5.85E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 3 145 111.82 62.04 76.89 4.04E-03 0 4.56E-08 8.78E-08 6.82E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 3 150 111.87 113.56 69.89 3.00E-03 0 -4.37E-08 1.02E-07 4.88E-07 03/08/97 Yes Yes 931 172 1060 C 13 H 4 0 111.87 355 64.96 1.60E-03 0 7.16E-08 -6.41E-09 2.52E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 5 111.92 42.8 70.26 3.79E-03 0 9.96E-08 9.43E-08 6.19E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 10 111.97 50.92 71.07 4.89E-03 0 1.06E-07 1.34E-07 8.02E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 15 112.02 51.3 70.76 5.49E-03 0 1.20E-07 1.53E-07 8.98E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 20 112.07 39 77.55 5.98E-03 0 1.06E-07 8.81E-08 1.01E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 25 112.12 53.24 74.87 6.86E-03 0 1.14E-07 1.56E-07 1.15E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 30 112.17 41.27 73.41 7.48E-03 0 1.70E-07 1.53E-07 1.24E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 35 112.22 48.66 76.32 8.18E-03 0 1.36E-07 1.58E-07 1.38E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 40 112.27 51.79 77.12 8.25E-03 0 1.21E-07 1.57E-07 1.39E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 45 112.32 60.19 72.71 7.46E-03 0 1.17E-07 2.09E-07 1.24E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 50 112.37 68.44 73.98 6.14E-03 0 6.61E-08 1.71E-07 1.02E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 55 112.42 45.72 67.05 6.92E-03 0 2.00E-07 2.10E-07 1.11E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 60 112.47 39.94 71.36 7.06E-03 0 1.84E-07 1.57E-07 1.16E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 65 112.52 33.92 78.27 5.90E-03 0 1.06E-07 7.26E-08 1.00E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 70 112.57 46.93 76.23 5.60E-03 0 9.66E-08 1.06E-07 9.44E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 75 112.62 48.77 73.87 5.79E-03 0 1.12E-07 1.31E-07 9.64E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 80 112.67 55.81 76.91 5.59E-03 0 7.54E-08 1.14E-07 9.43E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 85 112.72 52.16 70.84 6.02E-03 0 1.29E-07 1.69E-07 9.86E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 90 112.77 25.55 73.5 6.61E-03 0 1.80E-07 8.79E-08 1.10E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 95 112.82 42.49 78.69 6.38E-03 0 9.79E-08 9.17E-08 1.08E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 100 112.87 44.46 70.88 7.08E-03 0 1.76E-07 1.76E-07 1.16E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 105 112.92 63.04 66.32 9.14E-03 0 1.77E-07 3.55E-07 1.45E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 110 112.97 96.38 81.35 7.62E-03 0 -1.35E-08 1.24E-07 1.31E-06 03/08/97 Yes Yes 933 172 1060 C 13 H 4 115 113.02 69.81 79.51 5.49E-03 0 3.66E-08 1.02E-07 9.36E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 120 113.07 39.77 74.39 5.46E-03 0 1.20E-07 1.02E-07 9.12E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 125 113.12 43.25 86.58 5.40E-03 0 2.49E-08 2.40E-08 9.35E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 130 113.17 112.45 63.19 4.11E-03 0 -7.50E-08 1.86E-07 6.35E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 135 113.22 83.48 76.93 2.54E-03 0 6.92E-09 6.19E-08 4.29E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 140 113.27 61.11 78.81 1.90E-03 0 1.89E-08 3.50E-08 3.23E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 145 113.32 57.57 74.99 1.67E-03 0 2.45E-08 3.95E-08 2.79E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 4 150 113.37 120.92 68.52 1.10E-03 0 -2.19E-08 3.74E-08 1.77E-07 03/08/97 Yes Yes 933 172 1060 C 13 H 5 0 113.37 8.49 58.38 8.89E-04 0 4.89E-08 7.45E-09 1.31E-07 03/08/97 Yes Yes 935 172 1060 C 13 H 5 5 113.42 54.3 69.12 2.04E-03 0 4.50E-08 6.41E-08 3.30E-07 03/08/97 Yes Yes 935 172 1060 C 13 H 5 10 113.47 100.09 68.8 1.95E-03 0 -1.31E-08 7.53E-08 3.15E-07 03/08/97 Yes Yes 935 172 1060 C 13 H 5 15 113.52 196.79 82.91 1.65E-03 0 -2.07E-08 -6.38E-09 2.84E-07 03/08/97 Yes Yes 935 172 1060 C 13 H 5 20 113.57 165.59 55.23 2.86E-03 0 -1.68E-07 4.41E-08 4.08E-07 03/08/97 Yes Yes 935 172 1060 C 13 H 5 25 113.62 155.24 16.88 8.55E-03 0 -7.88E-07 3.71E-07 4.30E-07 03/08/97 Yes Yes 935 172 1060 C 13 H 5 30 113.67 136.82 42.27 1.25E-02 0 -7.16E-07 6.87E-07 1.46E-06 03/08/97 Yes Yes 935 172 1060 C 13 H 5 35 113.72 349.75 38.6 8.44E-02 0 6.89E-06 -1.27E-06 9.13E-06 03/08/97 Yes Yes 935 172 1060 C 13 H 5 40 113.77 316.13 59.6 1.81E-01 0 7.00E-06 -6.88E-06 2.70E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 45 113.82 111.21 64.65 7.77E-02 0 -1.28E-06 3.36E-06 1.22E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 50 113.87 193.07 41.23 1.94E-02 0 -1.50E-06 -3.57E-07 2.21E-06 03/08/97 Yes Yes 935 172 1060 C 13 H 5 55 113.92 48.56 4.27 1.09E-01 0 7.61E-06 8.81E-06 1.40E-06 03/08/97 Yes Yes 935 172 1060 C 13 H 5 60 113.97 56.85 9.95 1.13E-01 0 6.47E-06 1.01E-05 3.39E-06 03/08/97 Yes Yes 935 172 1060 C 13 H 5 65 114.02 353.82 68.2 4.53E-02 0 1.77E-06 -1.96E-07 7.29E-06 03/08/97 Yes Yes 935 172 1060 C 13 H 5 70 114.07 308.14 67.5 7.60E-02 0 1.90E-06 -2.48E-06 1.22E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 75 114.12 28.12 40.74 1.82E-01 0 1.29E-05 7.03E-06 2.05E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 80 114.17 28.27 74.96 2.02E-01 0 4.90E-06 2.70E-06 3.39E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 85 114.22 262.61 56.64 1.62E-01 0 -1.22E-06 -9.60E-06 2.35E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 90 114.27 296.74 45.13 2.43E-01 0 8.20E-06 -1.66E-05 2.99E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 95 114.32 90.25 73.45 1.77E-01 0 -2.33E-08 5.47E-06 2.94E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 100 114.37 66.65 41.27 4.26E-01 0 1.34E-05 3.19E-05 4.87E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 105 114.42 242.6 76.45 2.56E-01 0 -2.92E-06 -5.77E-06 4.31E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 110 114.47 206.42 43.23 7.45E-02 0 -5.16E-06 -2.62E-06 8.85E-06 03/08/97 Yes Yes 935 172 1060 C 13 H 5 115 114.52 148.85 30.93 6.10E-02 0 -4.75E-06 2.94E-06 5.43E-06 03/08/97 Yes Yes 935 172 1060 C 13 H 5 120 114.57 324.61 21.27 4.11E-01 0 3.31E-05 -2.41E-05 2.59E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 125 114.62 330.31 51.54 6.45E-01 0 3.70E-05 -2.16E-05 8.76E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 130 114.67 133.3 39.92 2.93E-01 0 -1.63E-05 1.77E-05 3.26E-05 03/08/97 Yes Yes 935 172 1060 C 13 H 5 135 114.72 153.88 43.57 3.86E-02 0 -2.67E-06 1.34E-06 4.62E-06 03/08/97 Yes Yes 935 172 1060 C 13 H 5 140 114.77 283.57 44.07 6.36E-03 0 1.14E-07 -4.82E-07 7.67E-07 03/08/97 Yes Yes 935 172 1060 C 13 H 5 145 114.82 311.38 67.1 2.96E-03 0 8.07E-08 -9.37E-08 4.72E-07 03/08/97 Yes Yes 935 172 1060 C 13 H 5 150 114.87 144.07 82.34 1.58E-03 0 -1.81E-08 1.34E-08 2.71E-07 03/08/97 Yes Yes 935 172 1060 C 13 H 6 0 114.87 334.55 61.08 1.11E-03 0 5.14E-08 -2.50E-08 1.68E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 5 114.92 27.6 71.26 2.27E-03 0 6.85E-08 3.66E-08 3.72E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 10 114.97 50.72 73.82 2.55E-03 0 4.76E-08 5.95E-08 4.24E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 15 115.02 51.55 74.9 2.40E-03 0 4.13E-08 5.31E-08 4.02E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 20 115.07 32.54 77.07 2.43E-03 0 4.86E-08 3.17E-08 4.10E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 25 115.12 40.21 76.85 2.49E-03 0 4.60E-08 3.97E-08 4.21E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 30 115.17 48.84 76 2.61E-03 0 4.41E-08 5.16E-08 4.39E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 35 115.22 47.23 80.25 2.53E-03 0 3.08E-08 3.41E-08 4.32E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 40 115.27 49.3 79.63 2.45E-03 0 3.05E-08 3.63E-08 4.18E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 45 115.32 46.28 76.95 2.51E-03 0 4.15E-08 4.44E-08 4.24E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 50 115.37 63.76 76.53 2.43E-03 0 2.65E-08 5.49E-08 4.09E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 55 115.42 51.82 76.01 2.32E-03 0 3.68E-08 4.79E-08 3.91E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 60 115.47 69.88 80.23 2.17E-03 0 1.34E-08 3.75E-08 3.71E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 65 115.52 61.38 74.8 2.21E-03 0 2.95E-08 5.52E-08 3.70E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 70 115.57 49.2 74.45 2.31E-03 0 4.29E-08 5.09E-08 3.86E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 75 115.62 45.99 77.5 2.34E-03 0 3.73E-08 3.95E-08 3.96E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 80 115.67 53.09 79.16 2.32E-03 0 2.78E-08 3.79E-08 3.95E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 85 115.72 93.52 78.01 2.16E-03 0 -2.93E-09 4.86E-08 3.66E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 90 115.77 80.44 76.88 2.12E-03 0 8.48E-09 5.15E-08 3.58E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 95 115.82 46.92 78.07 2.03E-03 0 3.05E-08 3.33E-08 3.45E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 100 115.87 56.13 74.64 2.22E-03 0 3.47E-08 5.29E-08 3.71E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 105 115.92 86.34 75.31 2.33E-03 0 4.00E-09 6.39E-08 3.90E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 110 115.97 91.19 75.13 2.27E-03 0 -1.29E-09 6.33E-08 3.81E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 115 116.02 104.62 70.31 2.04E-03 0 -1.84E-08 7.21E-08 3.33E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 120 116.07 138.74 71.51 1.16E-03 0 -2.94E-08 2.63E-08 1.91E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 125 116.12 300.28 64.43 6.87E-04 0 1.59E-08 -2.78E-08 1.07E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 130 116.17 35.51 74.35 1.80E-03 0 4.19E-08 3.06E-08 3.01E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 135 116.22 96.13 69.72 2.85E-03 0 -1.12E-08 1.07E-07 4.63E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 140 116.27 94.6 65.46 3.10E-03 0 -1.10E-08 1.39E-07 4.89E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 145 116.32 93.37 67.14 2.95E-03 0 -7.14E-09 1.24E-07 4.71E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 6 150 116.37 129.08 67.79 1.82E-03 0 -4.60E-08 5.79E-08 2.92E-07 03/08/97 Yes Yes 937 172 1060 C 13 H 7 0 116.37 38.56 67.22 1.05E-03 0 3.38E-08 2.76E-08 1.68E-07 03/08/97 Yes Yes 939 172 1060 C 13 H 7 5 116.42 96.61 68.58 2.58E-03 0 -1.15E-08 1.01E-07 4.16E-07 03/08/97 Yes Yes 939 172 1060 C 13 H 7 10 116.47 109.78 64 3.35E-03 0 -5.26E-08 1.50E-07 5.21E-07 03/08/97 Yes Yes 939 172 1060 C 13 H 7 15 116.52 116.64 69.2 3.10E-03 0 -5.23E-08 1.07E-07 5.02E-07 03/08/97 Yes Yes 939 172 1060 C 13 H 7 20 116.57 101.07 80.89 2.66E-03 0 -8.58E-09 4.48E-08 4.56E-07 03/08/97 Yes Yes 939 172 1060 C 13 H 7 25 116.62 316.18 69.49 3.28E-03 0 8.78E-08 -8.62E-08 5.32E-07 03/08/97 Yes Yes 939 172 1060 C 13 H 7 30 116.67 53.32 77.64 4.39E-03 0 5.95E-08 8.17E-08 7.43E-07 03/08/97 Yes Yes 939 172 1060 C 13 H 7 35 116.72 92.83 70.59 3.52E-03 0 -6.11E-09 1.27E-07 5.75E-07 03/08/97 Yes Yes 939 172 1060 C 13 H 7 40 116.77 92.71 86.51 2.80E-03 0 -8.53E-10 1.84E-08 4.84E-07 03/08/97 Yes Yes 939 172 1060 C 13 H 7 45 116.82 153.5 78.5 1.95E-03 0 -3.69E-08 1.88E-08 3.32E-07 03/08/97 Yes Yes 939 172 1060 C 14 H 1 0 117 46.58 0 2.80E+02 0 3.60E-08 -2.16E-07 3.69E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 5 117.05 58.24 5 3.04E+02 0 2.96E-07 -4.43E-07 1.39E-06 03/08/97 1 Yes 941 172 1060 C 14 H 1 10 117.1 55.74 10 8.58E+01 0 3.98E-08 5.48E-07 1.29E-06 03/08/97 1 Yes 941 172 1060 C 14 H 1 15 117.15 81.62 15 2.24E+02 0 -4.25E-08 -4.22E-08 6.57E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 20 117.2 71.86 20 2.85E+01 0 1.24E-07 6.91E-08 7.06E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 25 117.25 81.94 25 1.30E+02 0 -5.08E-08 6.26E-08 9.19E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 30 117.3 59.16 30 1.57E+02 0 -2.31E-07 1.02E-07 6.90E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 35 117.35 77.61 35 2.99E+02 0 3.08E-08 -5.78E-08 4.80E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 40 117.4 75.71 40 2.96E+02 0 2.90E-08 -6.15E-08 4.28E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 45 117.45 77.68 45 2.76E+02 0 5.90E-09 -5.79E-08 4.25E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 50 117.5 79.78 50 3.20E+02 0 3.43E-08 -2.93E-08 4.06E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 55 117.55 71.91 55 1.48E+01 0 7.39E-08 1.99E-08 3.82E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 60 117.6 74.09 60 2.71E+02 0 1.71E-09 -6.36E-08 3.55E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 65 117.65 69.14 65 2.78E+02 0 1.16E-08 -8.94E-08 3.79E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 70 117.7 74.91 70 3.10E+02 0 4.48E-08 -5.48E-08 4.24E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 75 117.75 74.22 75 4.35E+01 0 5.92E-08 5.74E-08 4.72E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 80 117.8 83.39 80 2.31E+02 0 -2.00E-08 -2.56E-08 4.53E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 85 117.85 81.93 85 3.06E+02 0 1.98E-08 -2.80E-08 3.91E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 90 117.9 76.28 90 2.86E+02 0 1.68E-08 -5.94E-08 4.05E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 95 117.95 79.4 95 2.94E+02 0 1.93E-08 -4.39E-08 4.11E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 100 118 85.44 100 2.75E+02 0 1.58E-09 -1.94E-08 3.92E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 105 118.05 83.25 105 2.30E+02 0 -1.65E-08 -1.97E-08 3.49E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 110 118.1 74.08 110 2.66E+02 0 -3.99E-09 -5.47E-08 3.07E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 115 118.15 74.09 115 2.77E+02 0 6.69E-09 -5.45E-08 3.08E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 120 118.2 84.09 120 3.52E+02 0 2.28E-08 -3.08E-09 3.64E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 125 118.25 76.56 125 2.68E+02 0 -2.24E-09 -5.65E-08 3.79E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 130 118.3 79.41 130 2.27E+02 0 -3.23E-08 -3.58E-08 4.16E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 135 118.35 71.68 135 3.48E+02 0 1.01E-07 -2.19E-08 5.10E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 140 118.4 69.21 140 2.82E+02 0 2.60E-08 -1.24E-07 5.35E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 145 118.45 71.84 145 1.15E+02 0 -3.07E-08 6.88E-08 3.69E-07 03/08/97 1 Yes 941 172 1060 C 14 H 1 150 118.5 74.77 150 1.47E+02 0 -2.36E-08 1.59E-08 1.70E-07 03/08/97 1 Yes 941 172 1060 C 14 H 2 0 118.5 54.89 0 3.32E+02 0 6.25E-08 -3.38E-08 1.64E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 5 118.55 67.29 5 2.65E+02 0 -8.86E-09 -1.05E-07 4.02E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 10 118.6 85.48 10 2.06E+02 0 -1.70E-08 -8.39E-09 3.93E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 15 118.65 85.89 15 3.12E+02 0 1.01E-08 -1.14E-08 3.40E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 20 118.7 86.89 20 3.08E+02 0 5.57E-09 -7.39E-09 2.70E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 25 118.75 76.16 25 3.78E+00 0 3.79E-08 2.35E-09 2.51E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 30 118.8 71.94 30 2.93E+02 0 2.16E-08 -5.19E-08 2.75E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 35 118.85 86.86 35 2.18E+02 0 -6.18E-09 -5.09E-09 2.37E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 40 118.9 76.78 40 3.19E+02 0 2.78E-08 -2.49E-08 2.56E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 45 118.95 75.29 45 2.99E+02 0 2.45E-08 -4.48E-08 3.11E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 50 119 75.55 50 3.00E+02 0 2.49E-08 -4.45E-08 3.18E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 55 119.05 79.88 55 1.14E+01 0 3.86E-08 7.67E-09 3.58E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 60 119.1 72.15 60 1.54E+02 0 -7.40E-08 3.58E-08 4.20E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 65 119.15 72.93 65 2.33E+02 0 -3.88E-08 -5.25E-08 3.41E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 70 119.2 77.15 70 3.21E+02 0 2.81E-08 -2.38E-08 2.61E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 75 119.25 77.12 75 2.65E+02 0 -1.68E-09 -2.30E-08 1.59E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 80 119.3 67.67 80 1.33E+02 0 -8.30E-09 9.28E-09 5.06E-08 03/08/97 1 Yes 943 172 1060 C 14 H 2 85 119.35 60.97 85 3.52E+02 0 3.07E-08 -4.47E-09 9.12E-08 03/08/97 1 Yes 943 172 1060 C 14 H 2 90 119.4 70.8 90 3.14E+02 0 3.45E-08 -3.67E-08 2.32E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 95 119.45 82.74 95 3.07E+02 0 1.36E-08 -1.82E-08 2.83E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 100 119.5 79.4 100 2.44E+02 0 -1.28E-08 -2.78E-08 2.62E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 105 119.55 66.39 105 3.01E+02 0 2.78E-08 -4.83E-08 2.04E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 110 119.6 81.62 110 3.15E+01 0 2.07E-08 1.26E-08 2.71E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 115 119.65 74.03 115 2.17E+02 0 -3.58E-08 -2.82E-08 2.59E-07 03/08/97 1 Yes 943 172 1060 C 14 H 2 120 119.7 64.18 120 2.80E+02 0 8.60E-09 -4.84E-08 1.62E-07 03/08/97 1 Yes 943 172 1060 C 14 H 3 0 119.9 44.24 0 3.23E+02 0 7.02E-08 -5.52E-08 1.41E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 5 119.95 67.24 5 2.92E+00 0 9.14E-08 4.70E-09 3.57E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 10 120 72.71 10 3.49E+02 0 8.07E-08 -1.57E-08 4.32E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 15 120.05 67.58 15 3.22E+02 0 7.87E-08 -6.27E-08 3.95E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 20 120.1 76.42 20 3.21E+02 0 4.56E-08 -3.85E-08 4.00E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 25 120.15 77.81 25 3.56E+02 0 5.16E-08 -4.24E-09 3.91E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 30 120.2 75.92 30 3.36E+02 0 5.90E-08 -2.65E-08 4.19E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 35 120.25 81.39 35 1.54E+01 0 3.85E-08 1.09E-08 4.31E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 40 120.3 70.97 40 3.04E+02 0 4.50E-08 -6.96E-08 3.86E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 45 120.35 55.41 45 3.05E+02 0 7.34E-08 -1.07E-07 3.04E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 50 120.4 56.49 50 3.10E+02 0 8.17E-08 -1.01E-07 3.17E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 55 120.45 66.83 55 3.53E+02 0 9.39E-08 -1.16E-08 3.61E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 60 120.5 74.8 60 3.26E+02 0 5.09E-08 -3.47E-08 3.65E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 65 120.55 66.89 65 3.18E+02 0 6.25E-08 -5.89E-08 3.27E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 70 120.6 58.5 70 3.30E+02 0 1.02E-07 -6.09E-08 3.15E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 75 120.65 62.04 75 3.24E+02 0 8.55E-08 -6.34E-08 3.25E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 80 120.7 62.91 80 3.25E+02 0 8.14E-08 -5.79E-08 3.17E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 85 120.75 62.54 85 3.24E+02 0 8.12E-08 -6.14E-08 3.18E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 90 120.8 68.97 90 3.26E+02 0 6.07E-08 -4.23E-08 3.12E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 95 120.85 71.91 95 3.50E+02 0 5.98E-08 -1.11E-08 3.04E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 100 120.9 79.08 100 1.44E+02 0 -3.18E-08 2.36E-08 3.33E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 105 120.95 74.55 105 1.46E+02 0 -4.62E-08 3.23E-08 3.30E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 110 121 74.91 110 3.04E+02 0 2.98E-08 -4.51E-08 3.23E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 115 121.05 62.63 115 3.12E+02 0 7.21E-08 -8.07E-08 3.37E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 120 121.1 72.36 120 3.25E+02 0 5.98E-08 -4.28E-08 3.76E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 125 121.15 72.37 125 3.10E+02 0 4.23E-08 -5.24E-08 3.43E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 130 121.2 72.1 130 3.38E+02 0 6.10E-08 -2.52E-08 3.32E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 135 121.25 76.79 135 1.53E+01 0 4.78E-08 1.33E-08 3.45E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 140 121.3 41.19 140 3.30E+02 0 2.35E-07 -1.39E-07 3.89E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 145 121.35 46.04 145 3.26E+02 0 1.75E-07 -1.22E-07 3.59E-07 03/08/97 1 Yes 945 172 1060 C 14 H 3 150 121.4 70.38 150 1.64E+02 0 -3.88E-08 1.17E-08 1.86E-07 03/08/97 1 Yes 945 172 1060 C 14 H 4 0 121.4 20.55 0 5.10E+01 0 1.08E-07 1.35E-07 1.04E-07 03/08/97 1 Yes 947 172 1060 C 14 H 4 5 121.45 42.9 5 5.02E+01 0 1.00E-07 1.23E-07 2.38E-07 03/08/97 1 Yes 947 172 1060 C 14 H 4 10 121.5 82.97 10 2.38E+02 0 -1.10E-08 -1.80E-08 2.79E-07 03/08/97 1 Yes 947 172 1060 C 14 H 4 15 121.55 64.03 15 2.52E+02 0 -1.68E-08 -5.19E-08 1.80E-07 03/08/97 1 Yes 947 172 1060 C 14 H 4 20 121.6 71.01 20 1.84E+01 0 4.99E-08 1.69E-08 2.49E-07 03/08/97 1 Yes 947 172 1060 C 14 H 4 25 121.65 79.25 25 6.77E+01 0 1.36E-08 3.34E-08 3.04E-07 03/08/97 1 Yes 947 172 1060 C 14 H 4 30 121.7 71.15 30 3.49E+02 0 8.00E-08 -1.57E-08 3.89E-07 03/08/97 1 Yes 947 172 1060 C 14 H 4 35 121.75 69.17 35 3.41E+02 0 1.31E-07 -4.63E-08 5.93E-07 03/08/97 1 Yes 947 172 1060 C 14 H 4 40 121.8 76.84 40 2.68E+02 0 -3.62E-09 -1.25E-07 8.57E-07 03/08/97 1 Yes 947 172 1060 C 14 H 4 45 121.85 64.08 45 2.31E+02 0 -1.10E-07 -1.37E-07 5.84E-07 03/08/97 1 Yes 947 172 1060 C 14 H 4 50 121.9 88.99 50 2.24E+02 0 -1.71E-09 -1.54E-09 2.36E-07 03/08/97 1 Yes 947 172 1060 C 14 H 5 0 121.94 45.06 0 2.51E+01 0 4.51E-08 2.14E-08 8.12E-08 03/08/97 1 Yes 949 172 1060 C 14 H 5 5 121.99 44.3 5 3.39E+02 0 2.02E-07 -7.89E-08 3.45E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 10 122.04 57.48 10 2.81E+02 0 3.33E-08 -1.77E-07 4.52E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 15 122.09 83.8 15 3.21E+02 0 2.87E-08 -2.39E-08 5.57E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 20 122.14 26.93 20 4.09E+01 0 1.53E-06 1.36E-06 1.68E-06 03/08/97 1 Yes 949 172 1060 C 14 H 5 25 122.19 68.47 25 1.90E+02 0 -8.98E-07 -1.61E-07 3.78E-06 03/08/97 1 Yes 949 172 1060 C 14 H 5 30 122.24 29.63 30 2.15E+02 0 -9.34E-07 -6.78E-07 1.07E-06 03/08/97 1 Yes 949 172 1060 C 14 H 5 35 122.29 54.96 35 1.28E+01 0 1.57E-07 3.65E-08 3.74E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 40 122.34 63.52 40 1.64E+01 0 9.81E-08 2.95E-08 3.36E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 45 122.39 54.21 45 3.09E+01 0 1.69E-07 1.03E-07 4.47E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 50 122.44 84.58 50 3.50E+02 0 4.48E-08 -7.71E-09 7.85E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 55 122.49 58.43 55 2.39E+02 0 -1.02E-07 -1.70E-07 5.18E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 60 122.54 85.76 60 1.71E+02 0 -2.02E-08 2.92E-09 4.64E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 65 122.59 61.94 65 1.30E+02 0 -8.06E-08 9.68E-08 3.82E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 70 122.64 64.53 70 1.26E+02 0 -4.15E-08 5.79E-08 2.41E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 75 122.69 82.53 75 1.36E+02 0 -1.17E-08 1.15E-08 2.04E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 80 122.74 79.58 80 2.05E+02 0 -1.64E-08 -7.87E-09 1.62E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 85 122.79 64.13 85 2.60E+02 0 -7.16E-09 -4.25E-08 1.43E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 90 122.84 73.25 90 2.79E+02 0 4.39E-09 -2.81E-08 1.51E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 95 122.89 82.12 95 3.13E+02 0 9.40E-09 -1.01E-08 1.61E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 100 122.94 74.25 100 3.15E+02 0 2.29E-08 -2.36E-08 1.89E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 105 122.99 78.89 105 2.96E+02 0 1.43E-08 -2.98E-08 2.71E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 110 123.04 83.86 110 1.39E+02 0 -1.38E-08 1.20E-08 2.73E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 115 123.09 81.76 115 2.64E+02 0 -2.44E-09 -2.43E-08 2.69E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 120 123.14 70.84 120 2.81E+02 0 1.15E-08 -5.98E-08 2.81E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 125 123.19 71.4 125 2.91E+02 0 2.25E-08 -6.05E-08 3.08E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 130 123.24 85.69 130 2.81E+02 0 2.76E-09 -1.38E-08 2.95E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 135 123.29 86.69 135 2.44E+02 0 -4.36E-09 -9.02E-09 2.77E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 140 123.34 86.03 140 3.05E+02 0 6.56E-09 -9.95E-09 2.79E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 145 123.39 80.18 145 3.39E+02 0 2.88E-08 -1.11E-08 2.91E-07 03/08/97 1 Yes 949 172 1060 C 14 H 5 150 123.44 81.92 150 2.19E+02 0 -1.57E-08 -1.30E-08 2.33E-07 03/08/97 1 Yes 949 172 1060 C 14 H 6 0 123.44 54.27 0 3.55E+02 0 4.61E-08 -4.46E-09 1.05E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 5 123.49 73.33 5 3.36E+02 0 4.34E-08 -2.04E-08 2.61E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 10 123.54 77.98 10 3.20E+02 0 3.18E-08 -2.72E-08 3.19E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 15 123.59 84.12 15 3.01E+02 0 9.62E-09 -1.66E-08 2.98E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 20 123.64 84.96 20 3.22E+02 0 1.13E-08 -9.05E-09 2.65E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 25 123.69 78.55 25 6.87E+00 0 3.50E-08 4.20E-09 2.84E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 30 123.74 79.51 30 3.23E+02 0 2.88E-08 -2.23E-08 3.18E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 35 123.79 75.87 35 2.79E+02 0 7.47E-09 -4.79E-08 3.08E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 40 123.84 82.83 40 3.05E+02 0 1.22E-08 -1.79E-08 2.77E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 45 123.89 82.64 45 3.13E+02 0 1.49E-08 -1.66E-08 2.78E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 50 123.94 80.63 50 3.31E+02 0 2.59E-08 -1.49E-08 2.95E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 55 123.99 83.82 55 3.46E+02 0 2.17E-08 -5.43E-09 3.35E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 60 124.04 86.86 60 3.10E+02 0 8.16E-09 -9.76E-09 3.54E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 65 124.09 85.15 65 3.04E+02 0 9.61E-09 -1.53E-08 3.46E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 70 124.14 83.83 70 3.10E+02 0 1.43E-08 -1.78E-08 3.42E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 75 124.19 88.06 75 3.07E+02 0 4.31E-09 -5.89E-09 3.41E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 80 124.24 85.61 80 3.27E+02 0 1.39E-08 -9.02E-09 3.48E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 85 124.29 80.49 85 3.34E+02 0 3.56E-08 -1.78E-08 3.87E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 90 124.34 82.98 90 3.43E+02 0 3.14E-08 -9.62E-09 4.34E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 95 124.39 86.58 95 3.26E+02 0 1.26E-08 -8.57E-09 4.12E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 100 124.44 85.4 100 3.28E+02 0 1.43E-08 -9.15E-09 3.42E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 105 124.49 84.84 105 4.20E+00 0 1.70E-08 1.23E-09 3.12E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 110 124.54 84.86 110 3.41E+02 0 1.53E-08 -5.77E-09 3.00E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 115 124.59 83.87 115 3.50E+02 0 2.00E-08 -3.64E-09 3.07E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 120 124.64 85.42 120 3.54E+02 0 1.57E-08 -1.56E-09 3.21E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 125 124.69 88.9 125 7.63E+00 0 3.47E-09 5.28E-10 3.08E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 130 124.74 85.05 130 3.12E+02 0 1.07E-08 -1.23E-08 3.00E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 135 124.79 85.14 135 3.56E+02 0 1.54E-08 -1.16E-09 2.96E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 140 124.84 82.09 140 5.39E+00 0 2.62E-08 2.53E-09 3.12E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 145 124.89 82.44 145 3.17E+02 0 1.92E-08 -1.82E-08 3.22E-07 03/08/97 1 Yes 951 172 1060 C 14 H 6 150 124.94 78.89 150 1.82E+02 0 -2.60E-08 -1.14E-09 2.18E-07 03/08/97 1 Yes 951