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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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33764 7888009 1 ClFN2O4H18C20 ABC2D4E18F20 -180.61 9.02 -9.13 -1.2 0
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33765 7888010 1 S2N3O3H19C20 A2B3C3D19E20 -41.95 4.33 -8.39 -1.05 0
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33766 7888011 1 OS2N4H18C20 AB2C4D18E20 49.88 4.71 -8.87 -1.17 0
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33767 7888025 1 N2S2O3H16C20 A2B2C3D16E20 -42.69 5.85 -8.8 -1.27 0
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33768 7888027 1 O2S2N3C20H21 A2B2C3D20E21 -17.89 5.47 -8.41 -0.91 0
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33769 7888029 1 O2S2N3C20H21 A2B2C3D20E21 -16.59 2.53 -8.56 -1.14 0
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33770 7888030 2 NO2C12H14 AB2C12D14 -147.96 3.83 -8.61 -1.06 0
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33771 7888035 1 OS2N3C18H23 AB2C3D18E23 -17.99 4.0 -8.39 -0.68 0
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33772 7888036 1 OS2N3C18H23 AB2C3D18E23 -17.85 4.0 -8.43 -0.72 0
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33773 7888042 1 S2N3O3H19C20 A2B3C3D19E20 -52.84 5.78 -8.43 -0.71 0
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33774 7888048 1 N2O5C19H20 A2B5C19D20 -159.76 6.85 -9.43 -0.96 0
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33775 7888050 2 NO2C12H14 AB2C12D14 -150.28 3.98 -8.6 -1.06 0
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33776 7888061 1 N2S2O3C20H20 A2B2C3D20E20 -48.61 5.75 -8.42 -0.72 0
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33777 7888069 1 S2N3C13H13 A2B3C13D13 67.35 4.15 -8.73 -0.98 0
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33778 7888074 1 N2O4C19H24 A2B4C19D24 -166.82 6.59 -9.71 -0.97 0
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33779 7888077 1 N2F3O4H17C20 A2B3C4D17E20 -258.38 6.7 -9.33 -1.19 0
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33780 7888079 2 NO2C11H12 AB2C11D12 -134.74 6.46 -9.68 -1.02 0
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33781 7888087 2 NO2C12H14 AB2C12D14 -149.93 3.74 -8.88 -1.05 0
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33782 7888090 1 FOS2N3H18C19 ABC2D3E18F19 -26.55 4.25 -8.8 -1.07 0
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33783 7888091 2 OSN2C10H10 ABC2D10E10 -23.0 4.99 -8.84 -1.09 0
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33784 7888092 2 NO2C12H14 AB2C12D14 -141.87 3.95 -9.31 -0.68 0
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33785 7888096 1 OS2N4H18C20 AB2C4D18E20 52.33 8.17 -8.9 -1.15 0
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33786 7888101 1 N2O5C22H24 A2B5C22D24 -172.45 4.3 -8.28 -1.04 0
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33787 7888103 1 ClOS2N4H17C18 ABC2D4E17F18 28.13 6.37 -8.77 -1.0 0
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33788 7888107 1 OS2N4C18H20 AB2C4D18E20 41.82 3.45 -8.77 -1.12 0