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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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222850 85332733 1 NO17C20H33 AB17C20D33 -764.97 3.85 -10.32 -0.43 0
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222851 85332735 1 S3N5O8C20H25 A3B5C8D20E25 -190.87 3.6 -9.29 -1.22 0
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222852 85332738 1 N2O3F8H20C26 A2B3C8D20E26 -466.67 5.63 -9.88 -1.16 0
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222853 85332741 4 NO2C7H10 AB2C7D10 -269.66 7.7 -9.92 -0.38 0
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222854 85332766 1 O4N8C29H38 A4B8C29D38 -101.28 5.35 -8.59 -0.72 0
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222855 85332777 1 NO5C35H49 AB5C35D49 -189.33 5.43 -8.55 0.17 0
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222856 85332778 1 SN3O5C30H49 AB3C5D30E49 -237.1 8.9 -8.87 -0.04 0
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222857 85332779 1 IO6C26H29 AB6C26D29 -157.29 3.73 -8.83 -0.88 0
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222858 85332785 1 BClN2O4C32H42 ABC2D4E32F42 -241.08 4.73 -9.41 -0.17 0
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222859 85332789 1 N5O5C32H35 A5B5C32D35 -101.85 4.76 -8.95 -0.73 0
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222861 85332793 1 FN3O5H28C30 AB3C5D28E30 -140.76 3.96 -8.44 -0.76 0
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222862 85332794 1 ClNSO7C28H36 ABCD7E28F36 -261.65 5.15 -9.06 -0.64 0
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222863 85332795 1 SF4N4O5H22C25 AB4C4D5E22F25 -298.97 5.06 -8.9 -1.32 0
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222864 85332796 1 FSO3N4H21C23 ABC3D4E21F23 -60.16 3.28 -9.04 -0.72 0
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222865 85332799 1 N4O5C33H34 A4B5C33D34 -113.37 3.57 -9.25 -1.03 1
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222866 85332808 1 N2O2S3C25H31 A2B2C3D25E31 24.79 13.89 0.0 0.0 0
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222868 85332819 1 SN6O6C27H33 AB6C6D27E33 -132.35 9.04 0.0 0.0 0
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222869 85332821 1 SN4O7C27H44 AB4C7D27E44 -316.48 6.89 -9.67 -0.38 0
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222870 85332822 2 NO2C18H22 AB2C18D22 -173.74 6.17 -9.03 0.05 0
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222871 85332825 1 F2P3N5C12O13H16 A2B3C5D12E13F16 -746.73 8.41 -9.92 -1.3 0
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222873 85332831 1 NO7C33H47 AB7C33D47 -269.38 8.95 -9.01 0.55 0
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222874 85332836 1 N3F4O8C25H25 A3B4C8D25E25 -455.87 1.64 -8.71 -1.29 0
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222875 85332837 1 BrON6C30H35 ABC6D30E35 73.54 2.69 -8.48 -0.52 0
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222877 85332863 1 O7C34H54 A7B34C54 -297.39 6.29 -8.83 -0.04 0
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222878 85332869 1 KS2N3O7C24H30 AB2C3D7E24F30 -237.49 8.45 -9.06 -1.46 0
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222879 85332871 1 F2N4O6C29H38 A2B4C6D29E38 -320.69 1.62 -8.74 -0.73 1
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222880 85332873 1 SN4O6C30H33 AB4C6D30E33 -164.77 7.57 0.0 0.0 0
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222882 85332887 1 FO3N9C30H30 AB3C9D30E30 -4.68 7.64 -8.97 -0.83 0
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222883 85332890 1 SF2N3O6C28H35 AB2C3D6E28F35 -280.75 4.57 -9.17 -0.45 0
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222884 85332895 1 SO4N6C30H40 AB4C6D30E40 -108.48 10.07 -9.25 -1.04 0
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222885 85332898 1 ClSN4O5C29H37 ABC4D5E29F37 -199.8 1.6 -8.92 -0.65 0
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222886 85332907 1 O5N7C30H43 A5B7C30D43 -146.47 11.86 -9.17 -0.38 0
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222887 85332908 1 FNO6C34H44 ABC6D34E44 -266.87 3.45 -8.87 -1.19 0
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222888 85332923 1 NO7C33H61 AB7C33D61 -425.49 6.2 -8.78 0.39 0
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222889 85332929 1 N3O8H31C32 A3B8C31D32 -204.64 3.33 -8.89 -1.34 0
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222890 85332931 1 O7N9C25H47 A7B9C25D47 -370.43 5.06 -9.21 0.07 0
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222892 85332948 1 F3N4O6C29H31 A3B4C6D29E31 -323.63 3.02 -9.26 -1.26 0
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222893 85332949 2 O2N5H14C15 A2B5C14D15 46.29 6.2 -8.83 -0.92 0
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222894 85332954 1 ClN4O4C32H49 AB4C4D32E49 -204.47 9.27 -9.07 0.14 0
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222895 85332971 1 N5O5C33H45 A5B5C33D45 -154.52 2.72 -8.78 -0.15 1
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222896 85332973 1 ClSO5N7C26H33 ABC5D7E26F33 -88.29 12.02 0.0 0.0 0
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222897 85332975 1 N6O7C30H36 A6B7C30D36 -255.55 6.45 -9.18 -0.55 0
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222898 85332979 1 O4N6C33H48 A4B6C33D48 -160.63 6.46 -9.04 0.04 0
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222899 85332980 1 N2O4C37H56 A2B4C37D56 -190.28 3.87 -8.61 0.09 1
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222900 85332984 1 N3O3H28C29 A3B3C28D29 -25.61 4.6 0.0 0.0 0
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222901 85332986 1 NO5C37H55 AB5C37D55 -222.73 4.53 -8.58 0.09 0
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222902 85332998 1 F3N8O8C23H23 A3B8C8D23E23 -406.5 6.94 -9.42 -0.92 0
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222903 85333000 1 F2N2O5H30C35 A2B2C5D30E35 -187.89 2.35 -8.77 -0.87 0
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222904 85333011 1 F2N5O6C30H33 A2B5C6D30E33 -282.94 14.32 -8.59 -0.66 0
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222905 85333013 1 N5O8C30H39 A5B8C30D39 -330.21 3.5 -9.64 -0.53 1