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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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163501 58006346 1 O2N3C18H27 A2B3C18D27 -99.56 3.56 -8.25 0.25 0
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163502 58006923 1 Cl2N2C15H16 A2B2C15D16 22.34 3.41 -9.35 -0.34 0
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163503 58007294 1 BrClSN2O2C24H24 ABCD2E2F24G24 -32.35 2.15 -8.66 -0.74 0
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163504 58009805 1 SF2O3N6H18C19 AB2C3D6E18F19 -78.37 11.1 -9.0 -1.77 0
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163505 58009818 1 O5C12H16 A5B12C16 -206.19 1.67 -9.54 -0.78 0
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163506 58010083 1 ON5C19H25 AB5C19D25 48.94 6.67 -8.55 -1.29 0
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163507 58010494 1 FSO2N3C21H24 ABC2D3E21F24 -75.13 10.79 -8.86 -0.51 0
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163508 58015370 1 BrOSN4H7C12 ABCD4E7F12 48.81 5.44 -9.25 -1.66 0
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163509 58015561 1 ClO3N4H23C26 AB3C4D23E26 1.31 5.73 -8.71 -0.99 0
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163510 58015565 2 ON2C10H10 AB2C10D10 23.37 4.7 -8.65 -0.65 0
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163511 58016332 1 ClO2N4H15C20 AB2C4D15E20 8.76 4.97 -8.99 -0.96 0
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163512 58023173 1 FOSN3H24C25 ABCD3E24F25 -4.03 3.24 -8.66 -0.97 0
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163513 58023174 1 SN2O2H24C25 AB2C2D24E25 -5.73 2.78 -9.01 -1.06 2
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163514 58023235 1 ON4C19H24 AB4C19D24 22.72 3.57 -6.61 -0.48 0
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163515 58023885 1 OF2N4C21H26 AB2C4D21E26 -81.19 1.87 -8.65 -0.62 1
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163516 58023893 1 OF4N4H11C15 AB4C4D11E15 -155.53 4.54 0.0 0.0 0
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163517 58023896 1 N3O3C13H15 A3B3C13D15 -82.72 7.4 -9.12 -0.98 0
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163518 58023898 1 OF2N5H21C23 AB2C5D21E23 -49.02 4.39 -8.68 -1.05 1
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163519 58023901 1 FO2N3C25H27 AB2C3D25E27 -74.67 3.77 0.0 0.0 2
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163521 58023913 1 FO2N3C20H21 AB2C3D20E21 -78.03 1.51 0.0 0.0 2
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163522 58023914 1 ON4C23H28 AB4C23D28 27.46 6.47 -6.79 -0.58 1
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163523 58023917 1 ClO2N4C20H22 AB2C4D20E22 -17.06 5.53 0.0 0.0 0
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163524 58026024 1 F4O7H30C34 A4B7C30D34 -389.35 9.04 -8.68 -0.64 0
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163525 58026959 1 NO2C21H25 AB2C21D25 -56.02 1.49 -7.92 0.08 0
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163527 58029071 2 NH9C14 AB9C14 128.83 1.32 -8.02 -0.74 0