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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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92805 49989663 2 N3O3C19H26 A3B3C19D26 -254.57 10.7 -8.41 0.0 0
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92806 49989665 6 NOC6H8 ABC6D8 -256.03 9.89 -8.2 -0.06 0
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92807 49989672 1 FO5N6C37H51 AB5C6D37E51 -285.57 9.81 -8.74 -0.28 0
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92809 49989683 1 FO5N6C41H49 AB5C6D41E49 -235.4 14.6 -8.68 -0.84 0
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92810 49989684 1 F2O5N6C40H46 A2B5C6D40E46 -266.65 9.48 -8.95 -0.92 0
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92811 49989685 1 O5N6C40H48 A5B6C40D48 -182.6 3.4 -8.76 -0.56 0
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92812 49989686 1 FO5N6C40H47 AB5C6D40E47 -226.47 5.3 -8.9 -0.64 0
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92813 49989701 2 N3O3C21H26 A3B3C21D26 -226.13 10.9 -8.51 -0.44 0
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92814 49989707 1 O5N6C41H50 A5B6C41D50 -185.31 12.67 -8.72 -0.4 0
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92815 49989709 1 FO5N6C41H49 AB5C6D41E49 -232.3 3.92 -8.64 -0.62 0
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92816 49989714 1 FO5N6C41H51 AB5C6D41E51 -250.64 5.76 -8.73 -0.28 0
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92817 49989716 1 FO5N6C40H49 AB5C6D40E49 -243.13 7.47 -8.7 -0.56 0
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92818 49989722 1 FO5N6C40H47 AB5C6D40E47 -230.05 10.56 -8.91 -0.69 0
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92819 49989723 1 F2O5N6C40H46 A2B5C6D40E46 -270.26 9.99 -8.96 -0.86 0
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92821 49989725 1 FO5N6C41H49 AB5C6D41E49 -240.03 13.33 -8.68 -0.55 0
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92822 49989729 1 O5N6C41H56 A5B6C41D56 -229.15 7.89 -8.81 -0.63 0
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92823 49989743 3 N2O2C13H18 A2B2C13D18 -271.47 7.02 -8.34 -0.39 0
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92824 49989744 2 N3O3C21H26 A3B3C21D26 -230.02 8.83 -8.26 -0.56 0
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92825 49989747 1 O5N6C37H50 A5B6C37D50 -220.19 9.75 -8.65 -0.3 0
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92826 49989748 1 ClO5N6C41H49 AB5C6D41E49 -194.78 3.72 -8.83 -0.58 0
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92827 49989749 1 O5N6C36H48 A5B6C36D48 -218.48 12.35 -8.62 -0.05 0
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92828 49989750 1 O5N6C39H54 A5B6C39D54 -233.4 10.44 -8.44 -0.26 0
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92831 49989767 1 O5N6C41H56 A5B6C41D56 -237.46 10.64 -8.94 -0.22 0
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92832 49989794 1 FN6O6C41H49 AB6C6D41E49 -266.81 10.68 -8.72 -0.47 0
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92833 49989803 1 ClO5N6C41H51 AB5C6D41E51 -215.25 7.49 -8.8 -0.64 0