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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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294125 117427363 1 ClNO3C13H16 ABC3D13E16 -140.73 5.75 -9.01 -0.26 0
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294126 117427373 1 ClNO3C13H16 ABC3D13E16 -109.73 1.47 -8.65 -0.48 0
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294127 117427378 1 ClNO3C13H16 ABC3D13E16 -109.73 3.48 -8.99 -0.47 0
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294128 117427386 1 ClNO3C13H16 ABC3D13E16 -119.7 3.82 -9.12 -0.62 0
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294129 117427399 1 ClNO3C13H16 ABC3D13E16 -123.42 6.17 -9.07 -0.3 0
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294130 117427405 1 ClNO3C13H16 ABC3D13E16 -122.11 4.33 -8.86 -0.16 0
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294131 117427455 1 ClNO3C13H16 ABC3D13E16 -101.15 4.08 -8.98 -0.45 0
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294132 117427476 1 ClNO3C13H16 ABC3D13E16 -92.66 5.53 -8.97 -0.79 0
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294133 117427479 1 ClNO3C13H16 ABC3D13E16 -105.39 5.39 -9.33 -0.91 0
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294134 117427485 1 ClNO3C13H16 ABC3D13E16 -114.81 5.69 -9.0 -0.41 0
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294135 117427487 1 ClNO3C13H16 ABC3D13E16 -57.12 3.8 -8.79 -0.19 0
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294136 117427506 1 ClNO3C13H16 ABC3D13E16 -108.88 2.41 -8.65 -0.55 0
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294137 117427528 1 ClNO3C13H16 ABC3D13E16 -89.31 5.77 -9.13 -0.89 0
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294138 117427560 1 ClOSN3C11H12 ABCD3E11F12 20.27 4.39 -8.66 -0.71 0
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294139 117427612 1 ClNO2C14H20 ABC2D14E20 -77.63 0.83 -8.72 -0.1 0
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294140 117427670 1 ClNO2C14H20 ABC2D14E20 -70.52 2.62 -8.5 -0.12 0
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294141 117427676 1 ClNO2C14H20 ABC2D14E20 -78.49 3.11 -8.3 -0.02 0
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294142 117427683 1 ClNO2C14H20 ABC2D14E20 -73.33 5.51 -8.51 -0.13 0
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294143 117427717 1 ClNO2C14H20 ABC2D14E20 -61.77 2.54 -8.72 -0.1 0
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294144 117427770 1 ClNO2C14H20 ABC2D14E20 -78.44 4.78 -8.38 -0.07 0
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294145 117427830 1 ClNO2C14H20 ABC2D14E20 -81.02 5.13 -8.32 -0.02 0
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294146 117427846 1 ClNO2C14H20 ABC2D14E20 -88.07 5.31 -8.53 -0.09 0
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294147 117427898 1 ClNO2C14H20 ABC2D14E20 -83.89 0.73 -8.57 -0.06 0
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294148 117428183 1 BrFNOH9C11 ABCDE9F11 -48.61 3.8 -9.07 -0.6 0
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294149 117428184 1 BrFNOH9C11 ABCDE9F11 -48.68 2.66 -9.05 -0.65 0