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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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294025 117422752 1 ClNO3C13H14 ABC3D13E14 -74.49 2.9 -9.43 -0.58 0
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294026 117422830 1 ClNO3C13H14 ABC3D13E14 -89.67 4.09 -9.09 -1.21 0
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294027 117422832 1 ClNO3C13H14 ABC3D13E14 -84.5 4.37 -9.07 -1.15 0
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294028 117422833 1 ClNO3C13H14 ABC3D13E14 -93.58 6.44 -9.19 -0.52 0
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294029 117422836 1 ClNO3C13H14 ABC3D13E14 -95.23 5.09 -9.07 -0.48 0
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294030 117422845 1 ClNO3C13H14 ABC3D13E14 -93.41 3.46 -9.2 -0.59 0
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294031 117422939 1 ClNO2C14H18 ABC2D14E18 -37.25 3.58 -8.8 -0.28 0
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294032 117422945 1 ClNO2C14H18 ABC2D14E18 -29.3 4.29 -8.57 -0.23 0
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294033 117422965 1 ClNO2C14H18 ABC2D14E18 -54.98 3.41 -8.97 -0.28 0
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294034 117423036 1 ClNO2C14H18 ABC2D14E18 -72.6 3.26 -8.78 -0.33 0
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294035 117423210 1 ClNO2C14H18 ABC2D14E18 -31.79 6.04 -8.48 -0.26 0
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294036 117423231 1 ClNO2C14H18 ABC2D14E18 -68.78 2.57 -8.95 -0.42 0
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294037 117423591 1 ClNSC14H18 ABCD14E18 21.0 2.68 -8.52 -0.26 0
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294038 117423637 1 BrNF3C9H9 ABC3D9E9 -120.6 2.59 -9.65 -0.97 0
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294039 117424269 1 FO4C14H17 AB4C14D17 -199.85 6.96 -9.01 -0.4 0
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294040 117424431 1 O5C14H20 A5B14C20 -203.61 5.0 -8.5 -0.17 0
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294041 117424523 2 NOC8H8 ABC8D8 -42.15 3.05 -8.82 -0.73 0
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294042 117424538 1 ON4C15H16 AB4C15D16 51.93 4.53 -8.23 -0.38 0
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294043 117424815 1 SO3C14H20 AB3C14D20 -115.03 3.73 -8.36 0.14 0
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294044 117425014 1 ClN2O4H9C11 AB2C4D9E11 -65.18 10.4 -7.93 -1.21 0
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294045 117425022 1 ClN2O4H9C11 AB2C4D9E11 -83.9 4.4 -8.44 -2.02 0
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294046 117425174 1 ClSF2O2C10H11 ABC2D2E10F11 -191.31 4.12 -10.05 -1.37 0
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294047 117425230 1 ClN2O3C12H13 AB2C3D12E13 -43.29 3.84 -8.7 -0.62 0
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294048 117425329 1 ClO3C14H17 AB3C14D17 -118.74 3.37 -9.55 -0.56 0
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294049 117425370 1 ClO3C14H17 AB3C14D17 -154.32 5.89 -9.24 -0.41 0