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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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294300 117452079 1 ClNO2F3C11H11 ABC2D3E11F11 -223.97 4.24 -9.61 -1.29 0
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294301 117452264 1 ClO2N3C13H16 AB2C3D13E16 -24.82 4.1 -8.63 -0.02 0
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294302 117452282 1 ClNO3C14H16 ABC3D14E16 -83.94 3.96 -9.27 -0.5 0
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294303 117452290 1 ClNO3C14H16 ABC3D14E16 -98.25 6.15 -8.88 -0.56 0
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294304 117452318 1 ClNO3C14H16 ABC3D14E16 -94.98 2.93 -8.97 -0.59 0
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294305 117452360 1 ClNO3C14H16 ABC3D14E16 -90.76 4.3 -9.08 -1.07 0
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294306 117452418 1 ClNO2C15H20 ABC2D15E20 -80.3 2.3 -8.72 -0.18 0
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294307 117452544 1 ClNO2C15H20 ABC2D15E20 -82.24 2.2 -8.62 -0.04 0
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294308 117452632 1 ClNO2C15H20 ABC2D15E20 -72.19 3.56 -8.82 -0.25 0
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294309 117452644 1 ClNO2C15H20 ABC2D15E20 -75.03 5.48 -8.9 -0.23 0
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294310 117452646 1 ClNO2C15H20 ABC2D15E20 -85.63 2.08 -8.71 -0.19 0
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294311 117452647 1 ClNO2C15H20 ABC2D15E20 -84.08 3.72 -8.67 -0.07 0
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294312 117452652 1 ClNO2C15H20 ABC2D15E20 -60.28 4.65 -8.98 -0.34 0
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294313 117452657 1 ClNO2C15H20 ABC2D15E20 -70.97 3.1 -8.81 -0.15 0
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294314 117452743 1 ClNOC16H24 ABCD16E24 -55.86 3.12 -8.96 -0.18 0
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294315 117452800 1 ClNOC16H24 ABCD16E24 -62.11 3.91 -8.71 0.15 0
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294316 117452825 1 ClNOC16H24 ABCD16E24 -54.95 1.04 -8.63 0.06 0
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294317 117452876 1 BrNOF3H7C9 ABCD3E7F9 -140.78 3.45 -9.61 -1.02 0
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294318 117452882 1 BrNF2O2C9H10 ABC2D2E9F10 -145.43 1.79 -9.4 -0.72 0
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294319 117452921 1 BrNO3H8C11 ABC3D8E11 -38.74 6.97 -9.81 -1.34 0
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294320 117452941 1 BrNF3C10H11 ABC3D10E11 -123.27 0.83 -9.48 -0.92 0
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294321 117453006 1 BrNO2C12H12 ABC2D12E12 -17.87 4.47 -9.52 -0.58 0
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294322 117453021 1 BrNO2C12H12 ABC2D12E12 -45.87 3.15 -9.27 -0.46 0
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294323 117453031 1 BrNO2C12H12 ABC2D12E12 -45.86 3.65 -9.43 -0.57 0
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294324 117453043 1 BrNO2C12H12 ABC2D12E12 -0.11 4.24 -8.95 -1.0 0