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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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425019 135124876 1 SO5N6C32H40 AB5C6D32E40 -114.96 8.85 -9.09 -0.95 0
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425020 135124877 1 SO5N6C32H40 AB5C6D32E40 -116.11 10.15 -9.12 -0.9 0
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425021 135124885 1 FN2O5H31C33 AB2C5D31E33 -133.06 1.52 -8.84 -1.14 0
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425022 135124886 1 BrClNOC5H5 ABCDE5F5 6.26 1.58 -9.15 -0.82 0
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425023 135124891 1 S2N4O5C30H36 A2B4C5D30E36 -120.68 7.91 -9.01 -0.58 0
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425024 135124893 1 N2O3C13H24 A2B3C13D24 -170.12 6.76 -9.33 0.56 0
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425025 135124901 1 SO2F3N5H24C26 AB2C3D5E24F26 -124.32 7.58 -8.68 -0.87 0
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425026 135124903 1 ClO2N5C19H20 AB2C5D19E20 36.07 9.06 -9.6 -0.8 0
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425027 135124905 1 ClO2N5C19H20 AB2C5D19E20 23.99 10.62 -9.42 -0.69 0
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425028 135124906 1 S2N5O5C27H31 A2B5C5D27E31 -97.85 7.97 -9.25 -1.2 0
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425029 135124910 1 OF2N5C27H29 AB2C5D27E29 -49.21 4.35 -8.37 -0.8 0
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425030 135124911 1 O2F3H15C18 A2B3C15D18 -185.27 4.74 -10.07 -0.75 0
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425031 135124914 1 SF3O5N6C28H29 AB3C5D6E28F29 -201.15 7.42 -8.39 -0.96 0
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425032 135124917 1 F2N3O6H35C37 A2B3C6D35E37 -155.76 6.88 -8.36 -1.45 0
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425033 135124918 1 O2N5C25H27 A2B5C25D27 23.59 5.17 -8.42 -1.04 0
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425034 135124920 1 SO3N4C19H24 AB3C4D19E24 -63.6 7.21 -9.28 -0.81 0
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425035 135124922 1 SN3O3C17H25 AB3C3D17E25 -93.81 1.51 -9.23 -0.2 0
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425036 135124923 1 SN3O3C17H25 AB3C3D17E25 -93.84 2.53 -9.24 -0.21 0
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425037 135124924 1 N3O3C19H21 A3B3C19D21 -102.82 2.66 -8.55 -0.38 0
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425038 135124925 3 ON2C6H6 AB2C6D6 19.01 4.16 -8.71 -0.77 0
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425039 135124931 1 ClN3O4C24H24 AB3C4D24E24 -82.06 5.1 -8.94 -1.07 0
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425040 135124936 1 O2N3C23H23 A2B3C23D23 -30.56 3.96 -8.74 -0.75 0
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425041 135124942 2 ON2C11H11 AB2C11D11 -14.05 5.28 -8.85 -1.04 0
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425042 135124945 1 SF2O2N6C20H20 AB2C2D6E20F20 -19.1 3.43 -8.97 -2.05 0
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425043 135124947 1 SF2O2N6H18C20 AB2C2D6E18F20 -13.16 2.24 -9.66 -2.07 0