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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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258850 103157234 1 BrClNOC14H19 ABCDE14F19 -54.52 2.84 -8.65 -0.35 0
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258851 103157236 1 BrNOF2C14H18 ABCD2E14F18 -138.87 1.1 -9.14 -0.81 0
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258852 103157238 1 ClON2C15H19 ABC2D15E19 -26.4 7.01 -9.01 -0.64 0
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258853 103157244 1 N2O4C11H20 A2B4C11D20 -195.49 3.6 -9.36 0.62 0
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258854 103157245 1 N2O2C11H22 A2B2C11D22 -116.19 3.69 -9.68 1.05 0
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258855 103157253 1 N2O4C11H20 A2B4C11D20 -183.68 8.76 -10.07 0.66 0
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258856 103157254 1 NOC14H29 ABC14D29 -103.11 3.17 -8.99 2.51 0
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258857 103157255 1 N2O4C13H24 A2B4C13D24 -202.47 8.55 -9.86 0.48 0
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258858 103157256 2 NO2C7H13 AB2C7D13 -210.92 3.43 -8.95 0.64 0
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258859 103157261 1 FNO2C15H22 ABC2D15E22 -130.99 4.82 -8.11 0.0 0
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258860 103157266 1 N2O4C13H26 A2B4C13D26 -214.47 3.25 -9.38 0.66 0
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258861 103157267 1 NO2C12H25 AB2C12D25 -134.43 3.07 -9.35 2.22 0
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258862 103157269 1 NO2C12H25 AB2C12D25 -134.87 4.46 -9.39 2.22 0
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258863 103157270 1 N2O4C9H18 A2B4C9D18 -190.76 4.07 -9.68 0.7 0
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258864 103157275 1 NO2C11H23 AB2C11D23 -128.0 2.74 -9.37 2.11 0
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258865 103157277 1 NO2C11H23 AB2C11D23 -128.89 4.1 -9.24 2.36 0
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258866 103157284 1 N2O4C9H18 A2B4C9D18 -199.01 4.17 -9.92 0.81 0
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258867 103157290 1 N2O2C11H22 A2B2C11D22 -123.44 3.03 -9.72 1.0 0
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258868 103157292 2 NO2C5H10 AB2C5D10 -195.58 3.39 -9.25 0.65 0
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258869 103157294 2 NO2C7H13 AB2C7D13 -209.88 3.83 -9.23 0.68 0
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258870 103157295 1 N2O2C11H22 A2B2C11D22 -124.43 2.54 -9.12 1.12 0
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258871 103157298 1 NO3C17H27 AB3C17D27 -123.46 3.05 -8.34 0.22 0
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258872 103157299 2 NO2C7H14 AB2C7D14 -217.51 3.9 -9.48 0.7 0
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258873 103157301 1 N2O4C11H22 A2B4C11D22 -206.48 4.43 -9.92 0.82 0
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258874 103157302 1 FNOC16H24 ABCD16E24 -101.22 1.75 -9.31 -0.05 0