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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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76402 48424877 1 O2F3N3C20H24 A2B3C3D20E24 -181.22 5.04 -9.26 -1.04 0
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76403 48424878 1 FNO3C23H26 ABC3D23E26 -114.19 1.52 -9.3 -0.19 0
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76404 48424880 1 N2O5C20H24 A2B5C20D24 -157.47 5.85 -8.77 -0.33 0
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76405 48424882 1 N2O4C21H26 A2B4C21D26 -144.95 1.0 -8.9 -0.11 0
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76406 48424884 1 NO2C19H27 AB2C19D27 -76.38 2.87 -8.83 0.51 0
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76407 48424885 1 N3O5C22H33 A3B5C22D33 -240.31 2.72 -9.38 0.26 0
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76408 48424886 2 NO2C9H16 AB2C9D16 -206.48 3.38 -9.37 0.72 0
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76409 48424887 1 N3O3C17H25 A3B3C17D25 -121.06 2.31 -9.0 0.35 0
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76410 48424888 1 N2O2C13H24 A2B2C13D24 -88.26 3.57 -8.93 1.11 0
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76411 48424889 2 NO2C11H14 AB2C11D14 -154.16 3.97 -8.88 0.11 0
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76412 48424890 1 NO3C18H27 AB3C18D27 -121.35 4.86 -8.68 0.3 0
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76413 48424891 1 ClO2N3C20H30 AB2C3D20E30 -59.77 1.93 -8.6 -0.03 0
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76414 48424893 1 NO3C16H23 AB3C16D23 -106.83 3.65 -8.09 0.28 0
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76415 48424894 1 N3O4C20H25 A3B4C20D25 -137.23 1.62 -9.3 -0.26 0
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76416 48424895 1 N2O3C16H24 A2B3C16D24 -104.55 2.87 -9.26 -0.22 0
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76417 48424896 1 N3O4C21H27 A3B4C21D27 -142.44 3.05 -9.14 -0.11 0
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76418 48424898 1 NO2C13H23 AB2C13D23 -103.48 3.0 -9.63 1.13 0
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76419 48424900 1 ClNO4C17H22 ABC4D17E22 -136.36 6.74 -9.04 -0.38 0
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76420 48424901 2 NO3C10H11 AB3C10D11 -192.41 2.34 -8.55 -0.17 0
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76421 48424903 1 N2F3O3C21H31 A2B3C3D21E31 -287.12 5.13 -8.72 0.5 0
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76422 48424904 1 N2O2F3C19H27 A2B2C3D19E27 -239.54 4.71 -8.82 -0.05 0
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76423 48424905 1 N2F3O3C20H29 A2B3C3D20E29 -275.32 6.13 -8.74 -0.06 0
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76424 48424906 1 SF3N3O4C12H22 AB3C3D4E12F22 -330.92 6.78 -9.05 0.33 0
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76425 48424907 1 O2F3N4C17H27 A2B3C4D17E27 -225.07 5.87 -8.95 0.56 0
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76426 48424908 1 N2F3O4C15H27 A2B3C4D15E27 -342.35 3.59 -9.07 0.51 0