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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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273300 103770856 1 BrFNO3C14H19 ABCD3E14F19 -169.97 1.69 -9.95 -0.97 0
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273301 103770858 1 N4O4C13H22 A4B4C13D22 -101.47 5.83 -10.18 -0.82 0
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273302 103770859 1 N2O2S2C15H20 A2B2C2D15E20 -66.14 3.93 -9.18 -1.23 0
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273303 103770860 1 NSO2C15H23 ABC2D15E23 -103.47 3.2 -8.82 -0.32 0
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273304 103770861 1 BrNO3C15H22 ABC3D15E22 -134.68 1.29 -9.34 -0.44 0
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273305 103770862 1 NSO2C9H19 ABC2D9E19 -122.21 1.45 -9.06 0.06 0
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273306 103770863 1 ClNO4C15H22 ABC4D15E22 -171.66 2.29 -8.87 -0.56 0
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273307 103770866 1 ClNSO4C14H20 ABCD4E14F20 -178.47 5.11 -10.05 -1.24 0
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273308 103770878 1 NSO2C14H21 ABC2D14E21 -91.88 4.04 -9.24 -0.78 0
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273309 103770879 1 ClN2O4C13H17 AB2C4D13E17 -101.57 2.84 -10.21 -2.06 0
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273310 103770882 1 NSO2F3C14H18 ABC2D3E14F18 -250.12 2.44 -10.0 -1.57 0
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273311 103770886 1 NSO2C13H21 ABC2D13E21 -102.06 2.63 -9.3 -0.64 0
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273312 103770887 1 NSO4C15H23 ABC4D15E23 -179.72 3.99 -9.82 -0.91 0
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273313 103770889 1 N3O4C12H19 A3B4C12D19 -94.96 3.87 -10.11 -1.35 0
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273314 103770890 1 O2N3C11H19 A2B3C11D19 -72.22 2.21 -9.86 0.11 0
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273315 103770891 1 NCl2O2C15H19 AB2C2D15E19 -96.14 2.44 -9.66 -1.08 0
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273316 103770892 1 NSO2C15H19 ABC2D15E19 -71.92 1.77 -8.95 -0.87 0
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273317 103770894 1 N3O4C12H19 A3B4C12D19 -99.99 5.74 -10.08 -0.92 0
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273318 103770897 1 SN2O4C14H22 AB2C4D14E22 -176.7 3.91 -9.26 -0.46 0
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273319 103770899 2 NOC8H10 ABC8D10 -63.1 1.39 -9.71 -1.11 0
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273320 103770906 1 NO2C14H29 AB2C14D29 -154.37 5.68 -9.67 1.1 0
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273321 103770908 1 NO2C18H27 AB2C18D27 -106.3 2.37 -9.55 0.14 0
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273322 103770910 1 SN2O4C14H28 AB2C4D14E28 -216.85 5.8 -9.74 0.24 0
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273323 103770911 1 NO3C17H27 AB3C17D27 -155.93 2.94 -8.46 0.44 0
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273324 103770912 1 NO3C16H23 AB3C16D23 -113.94 3.75 -9.36 -0.29 0