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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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194870 78600166 1 SO3N4H20C21 AB3C4D20E21 -2.91 5.06 -8.55 -0.59 0
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194871 78600562 1 BrO2N4C19H19 AB2C4D19E19 54.29 5.04 -9.26 -1.29 0
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194872 78600660 1 N3O3C22H23 A3B3C22D23 -49.91 5.41 -8.84 -0.59 1
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194873 78600876 1 FN2O2C18H20 AB2C2D18E20 -21.25 7.57 0.0 0.0 1
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194874 78600877 1 ClOF2N2H16C17 ABC2D2E16F17 -34.88 7.48 0.0 0.0 1
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194875 78600878 1 ON2C13H19 AB2C13D19 30.37 2.17 0.0 0.0 1
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194876 78600879 1 ClN2O3C18H18 AB2C3D18E18 -6.17 5.63 0.0 0.0 -1
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194877 78600880 1 N2O7C21H21 A2B7C21D21 -213.44 5.44 0.0 0.0 0
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194878 78600940 1 O3N4C24H26 A3B4C24D26 -40.06 2.32 -9.18 -0.98 0
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194879 78600941 1 SN3O5C18H21 AB3C5D18E21 -147.66 6.28 -9.81 -1.08 0
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194880 78601045 1 O2N3C22H23 A2B3C22D23 -9.46 3.2 -8.97 -0.13 0
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194881 78601585 1 O3N4C21H24 A3B4C21D24 -60.36 1.92 -8.31 0.14 1
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194882 78602910 1 FO3N4C23H32 AB3C4D23E32 -148.04 8.95 0.0 0.0 0
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194883 78602911 1 ClNO5C20H28 ABC5D20E28 -217.59 3.05 -9.69 -0.33 0
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194884 78603104 1 OS2N3C20H23 AB2C3D20E23 27.64 2.83 -8.78 -0.88 0
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194885 78603105 1 SN3O3C22H25 AB3C3D22E25 -47.52 4.73 -8.77 -0.72 2
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194886 78603106 1 OSN3C20H33 ABC3D20E33 -34.11 4.13 -9.04 -0.28 1
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194887 78603310 1 SN2O2C16H25 AB2C2D16E25 -49.3 3.75 0.0 0.0 1
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194888 78603663 1 ClN2O4C19H24 AB2C4D19E24 -93.01 4.23 0.0 0.0 0
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194889 78603898 1 NSO3C16H21 ABC3D16E21 -130.91 6.8 -9.32 -0.64 1
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194890 78603899 1 N3O4C21H22 A3B4C21D22 -102.97 3.3 0.0 0.0 2
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194891 78603900 2 N2O2C10H15 A2B2C10D15 -118.34 19.34 -5.62 -0.81 0
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194892 78604150 1 SN2O4C19H22 AB2C4D19E22 -121.43 3.73 -8.95 -0.33 0
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194893 78604755 1 NSO4H19C21 ABC4D19E21 -87.63 3.98 -9.3 -1.46 -1
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194894 78605611 1 NO3C19H24 AB3C19D24 -110.44 3.64 0.0 0.0 0