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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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95913 50016686 2 N2O2C14H19 A2B2C14D19 -152.92 5.98 -8.81 0.0 0
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95914 50016750 1 FN6O6C37H45 AB6C6D37E45 -263.05 5.89 -8.73 -0.44 0
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95915 50016751 1 F2O5N6C36H42 A2B5C6D36E42 -265.68 6.32 -8.73 -0.64 0
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95916 50016767 1 F2O5N6C38H44 A2B5C6D38E44 -269.28 13.11 -8.7 -0.3 0
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95917 50016770 1 FO5N6C39H47 AB5C6D39E47 -212.55 7.61 -8.75 -0.8 0
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95918 50016773 1 N6O6C37H52 A6B6C37D52 -247.07 11.95 -8.97 -0.52 0
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95919 50016774 1 N6O6C37H50 A6B6C37D50 -238.28 8.98 -8.73 -0.35 0
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95920 50016776 3 N2O2C13H18 A2B2C13D18 -248.96 10.11 -8.63 -0.34 0
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95921 50016812 1 O4N5C33H47 A4B5C33D47 -182.08 11.77 -8.56 0.01 0
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95922 50016813 1 FO4N5C36H44 AB4C5D36E44 -185.13 5.92 -8.68 -0.36 0
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95923 50016838 1 O5N6C35H50 A5B6C35D50 -228.88 8.1 -8.8 -0.67 0
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95924 50016843 1 O5N6C36H50 A5B6C36D50 -224.87 6.49 -8.9 -0.65 0
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95925 50016865 1 O5N6C36H50 A5B6C36D50 -224.5 9.32 -9.0 -0.31 0
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95926 50016867 1 O5N6C36H50 A5B6C36D50 -214.73 8.04 -8.86 -0.16 0
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95927 50016869 1 O5N6C37H50 A5B6C37D50 -206.7 12.68 -8.55 -0.58 0
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95928 50016872 1 FN6O6C39H47 AB6C6D39E47 -252.52 6.27 -8.9 -0.63 0
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95929 50016873 2 N3O3C20H25 A3B3C20D25 -208.2 6.08 -8.95 -0.49 0
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95930 50016875 1 FN6O6C39H47 AB6C6D39E47 -249.53 2.81 -8.92 -0.49 0
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95931 50016920 1 ClO4N5C34H40 AB4C5D34E40 -143.89 6.26 -8.83 -0.99 0
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95932 50016966 1 O5N6C34H46 A5B6C34D46 -203.35 6.21 -8.94 -0.29 0
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95933 50016994 1 ClO5N6C36H49 AB5C6D36E49 -228.06 10.27 -8.66 -0.29 0
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95934 50016995 1 ClN4O4C28H37 AB4C4D28E37 -161.51 8.42 -8.74 -0.42 0
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95935 50017002 1 O4N5C34H47 A4B5C34D47 -168.78 9.53 -8.77 -0.27 0
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95936 50017009 1 N5O5C32H43 A5B5C32D43 -196.17 4.25 -9.14 -0.66 0
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95937 50017017 1 FO4N5C35H42 AB4C5D35E42 -183.44 7.91 -8.76 -0.45 0