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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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295000 117511327 1 BrNO3C14H20 ABC3D14E20 -101.21 3.25 -8.52 -0.23 0
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295001 117511328 1 BrNO3C14H20 ABC3D14E20 -108.71 5.56 -8.83 -0.42 0
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295002 117511336 1 BrNO3C14H20 ABC3D14E20 -94.61 4.15 -8.64 -0.28 0
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295003 117511340 1 BrNO3C14H20 ABC3D14E20 -110.7 5.07 -8.75 -0.13 0
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295004 117511342 1 BrNO3C14H20 ABC3D14E20 -81.81 3.34 -8.64 -0.23 0
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295005 117511399 1 O3F6H12C13 A3B6C12D13 -439.31 2.68 -10.36 -0.9 0
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295006 117511437 1 BrNO2C15H24 ABC2D15E24 -85.75 1.86 -8.97 -0.25 0
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295007 117511448 1 F3O4C16H17 A3B4C16D17 -309.34 9.04 -9.45 -0.9 0
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295008 117511453 1 N2O5C17H18 A2B5C17D18 -149.93 4.92 -8.2 -0.66 0
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295009 117511479 2 NO2C9H11 AB2C9D11 -155.99 3.36 -9.4 -0.44 0
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295010 117511486 2 NO2C9H11 AB2C9D11 -154.97 2.99 -9.16 -0.51 0
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295011 117511599 1 BrFN2O3C12H12 ABC2D3E12F12 -147.59 6.13 -9.59 -0.88 0
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295012 117511625 1 BrO5C13H15 AB5C13D15 -173.14 3.4 -9.4 -0.64 0
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295013 117511672 1 BrO5C13H15 AB5C13D15 -173.88 5.57 -9.39 -1.11 0
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295014 117511680 1 BrO5C13H15 AB5C13D15 -161.42 4.79 -8.96 -0.66 0
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295015 117511777 1 BrO4C14H19 AB4C14D19 -157.94 2.45 -9.26 -0.38 0
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295016 117511830 1 BrO4C14H19 AB4C14D19 -165.16 2.65 -9.64 -0.63 0
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295017 117511838 1 BrN2O3C13H19 AB2C3D13E19 -48.44 3.97 -8.85 -0.29 0
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295018 117511879 1 NF3O4C15H16 AB3C4D15E16 -300.37 10.21 -9.35 -0.79 0
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295019 117511893 1 N3O4C17H21 A3B4C17D21 -98.6 4.02 -8.38 -0.86 0
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295020 117511910 1 FNSO4C15H22 ABCD4E15F22 -201.02 4.99 -9.44 -0.79 0
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295021 117511919 1 NO4C19H25 AB4C19D25 -182.18 6.12 -8.71 -0.15 0
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295022 117511937 1 FNO2S2C15H22 ABC2D2E15F22 -128.24 2.55 -8.95 -0.91 0
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295023 117512014 1 BrFN3O3C11H11 ABC3D3E11F11 -68.88 5.15 -8.85 -1.09 0
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295024 117512049 1 BrNO5C12H14 ABC5D12E14 -172.15 6.82 -9.21 -0.96 0