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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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37228 8018534 1 ClN2O2F3H12C17 AB2C2D3E12F17 -176.95 4.72 -9.43 -1.09 0
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37229 8018535 1 FNO4H16C23 ABC4D16E23 -105.77 2.66 -9.27 -1.47 0
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37230 8018556 1 SO2N4C20H22 AB2C4D20E22 -14.69 8.77 -9.0 -0.67 0
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37231 8018583 1 FNO3H12C17 ABC3D12E17 -84.42 4.71 -10.39 -1.36 1
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37232 8018595 1 BrO2N3C16H25 AB2C3D16E25 -76.66 4.04 0.0 0.0 0
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37233 8018598 1 SN3O3H13C18 AB3C3D13E18 -10.98 6.55 -9.33 -1.88 0
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37234 8018608 1 N2O3H20C23 A2B3C20D23 -28.46 9.09 -8.92 -1.14 0
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37235 8018611 1 SN3O3H17C21 AB3C3D17E21 -21.53 4.19 -8.57 -1.52 0
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37236 8018615 1 SN3O5C19H19 AB3C5D19E19 -123.68 6.82 -9.29 -1.74 0
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37237 8018616 1 N2O3C19H24 A2B3C19D24 -109.52 2.42 -9.8 -1.59 0
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37238 8018617 1 SN2O5C21H24 AB2C5D21E24 -162.48 9.56 -9.35 -0.75 0
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37239 8018619 1 SN2O5C21H24 AB2C5D21E24 -162.24 7.63 -9.23 -0.61 0
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37240 8018676 1 SN2O5C14H18 AB2C5D14E18 -205.23 3.24 -8.63 -0.59 0
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37241 8018681 1 NCl2O2H9C15 AB2C2D9E15 -18.32 2.5 -9.69 -1.51 0
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37242 8018685 1 NO8C15H17 AB8C15D17 -308.67 2.28 -9.48 -1.11 1
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37243 8018690 1 N2O3C19H25 A2B3C19D25 -67.82 1.53 0.0 0.0 0
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37244 8018703 1 SN3O4C21H23 AB3C4D21E23 -19.11 1.19 -8.1 -1.32 1
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37245 8018717 1 SN2O3C19H25 AB2C3D19E25 -54.5 4.28 0.0 0.0 0
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37246 8018718 1 NCl2O4C12H13 AB2C4D12E13 -169.16 5.13 -9.15 -0.6 0
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37247 8018731 1 N2O3C19H24 A2B3C19D24 -98.89 5.81 -9.61 -0.71 0
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37248 8018732 1 N2O3C19H24 A2B3C19D24 -99.08 5.14 -9.49 -0.56 0
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37249 8018736 1 NF2O6C13H13 AB2C6D13E13 -331.37 4.58 -10.12 -1.04 0
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37250 8018749 2 NO2H10C11 AB2C10D11 -65.71 8.59 -8.99 -1.18 0
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37251 8018753 1 SN2O4H16C18 AB2C4D16E18 -49.92 4.14 -8.77 -0.77 0
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37252 8018771 1 FN2O3H15C18 AB2C3D15E18 -87.21 2.93 -9.81 -1.65 0