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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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77052 48425753 1 SN3O3C14H21 AB3C3D14E21 -110.87 3.78 -9.34 -0.69 0
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77053 48425754 1 N3O4C21H27 A3B4C21D27 -122.97 1.76 -8.72 -0.48 0
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77054 48425755 1 ClO2N4C16H19 AB2C4D16E19 -42.73 5.35 -9.32 -0.5 0
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77055 48425756 1 ClO2N4C16H19 AB2C4D16E19 -36.09 3.7 -9.27 -0.46 0
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77056 48425757 1 ClO2N4C16H19 AB2C4D16E19 -43.01 6.13 -9.08 -0.52 0
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77057 48425758 1 FO2N4C16H19 AB2C4D16E19 -81.13 4.77 -9.19 -0.59 0
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77058 48425759 1 O3N4C14H24 A3B4C14D24 -103.42 5.11 -9.84 -0.16 0
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77059 48425760 1 SN2O2C13H26 AB2C2D13E26 -127.53 3.45 -8.53 0.71 0
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77060 48425761 1 SN2O2C12H24 AB2C2D12E24 -124.95 4.43 -8.69 0.38 0
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77061 48425762 1 N2F3O3C15H19 A2B3C3D15E19 -273.33 4.18 -9.53 -0.56 0
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77062 48425763 1 N2O4C11H20 A2B4C11D20 -184.52 2.66 -9.57 0.65 0
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77063 48425764 1 O2N4C17H22 A2B4C17D22 -54.08 1.77 -9.6 -1.02 0
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77064 48425765 2 O2N3C8H12 A2B3C8D12 -154.15 5.79 -9.16 -0.63 0
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77065 48425766 2 ON2C6H10 AB2C6D10 -60.3 4.05 -9.62 0.47 0
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77066 48425767 1 ClN2O3C15H21 AB2C3D15E21 -128.97 4.45 -9.15 -0.05 0
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77067 48425768 1 N3O3C17H21 A3B3C17D21 -85.38 2.71 -9.28 -0.62 0
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77068 48425769 1 SN2O2F3C9H15 AB2C2D3E9F15 -264.11 6.0 -9.73 -0.76 0
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77069 48425770 1 SN3O4C13H25 AB3C4D13E25 -197.01 8.6 -9.22 0.6 0
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77070 48425771 1 N2O3C13H24 A2B3C13D24 -163.16 3.52 -9.64 0.91 0
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77071 48425772 1 N2F3O3C11H19 A2B3C3D11E19 -312.76 4.6 -9.78 0.69 0
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77072 48425773 1 SN3O3C14H17 AB3C3D14E17 -65.86 1.37 -9.24 -1.21 0
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77073 48425774 1 N2O3C17H26 A2B3C17D26 -138.92 3.8 -8.36 0.47 0
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77074 48425775 1 F2N2O3C14H18 A2B2C3D14E18 -200.27 4.83 -9.12 -0.26 0
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77075 48425776 1 FN2O3C15H21 AB2C3D15E21 -170.32 5.55 -9.0 -0.16 0
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77076 48425777 1 SO2N3C17H21 AB2C3D17E21 -48.06 3.41 -9.12 -0.74 0