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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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31726 3288052 1 ClS2N3O3H22C23 AB2C3D3E22F23 -55.13 6.8 -8.9 -1.25 0
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31727 3288058 1 N4O5H20C22 A4B5C20D22 -127.38 7.99 -8.97 -1.33 0
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31728 3288059 1 N2S2O3C18H20 A2B2C3D18E20 -89.36 4.49 -8.39 -1.11 0
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31729 3288060 1 BrSN2O5C19H25 ABC2D5E19F25 -200.3 4.56 -9.29 -1.03 0
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31730 3288062 1 SO2N4C17H20 AB2C4D17E20 -27.58 5.97 -8.53 -1.88 0
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31731 3288065 1 SCl2N3O3H13C16 AB2C3D3E13F16 -40.18 6.79 -8.99 -0.88 0
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31732 3288067 1 NSO2C17H21 ABC2D17E21 -56.97 5.49 -9.04 -0.34 0
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31733 3288072 1 ClN3O6C24H26 AB3C6D24E26 -195.77 2.84 -8.68 -0.64 0
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31734 3288073 1 SO2N3F6C27H27 AB2C3D6E27F27 -316.29 9.01 -8.29 -0.9 1
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31735 3288074 1 ClN2O2C7H8 AB2C2D7E8 9.59 6.83 0.0 0.0 0
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31736 3288075 1 OSN5C25H25 ABC5D25E25 63.48 3.0 -8.56 -0.63 0
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31737 3288077 1 FSN2O2C26H27 ABC2D2E26F27 -72.75 2.17 -9.16 -0.62 0
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31738 3288079 1 ClS2N3O4C26H26 AB2C3D4E26F26 -87.07 7.28 -9.29 -0.85 0
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31739 3288080 1 SO2F3N3H24C26 AB2C3D3E24F26 -184.76 5.66 -8.36 -1.21 0
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31740 3288086 1 SO2N3C22H25 AB2C3D22E25 -36.13 4.91 -8.6 -0.97 0
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31741 3288087 3 NOC7H9 ABC7D9 -54.65 5.27 -9.59 -0.51 0
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31742 3288089 1 ClSO2N3C15H22 ABC2D3E15F22 -89.97 4.63 -8.79 -0.39 0
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31743 3288093 1 NSO3C19H23 ABC3D19E23 -97.78 4.99 -8.91 -0.64 0
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31744 3288095 1 OCl2N2C23H24 AB2C2D23E24 0.79 4.56 -8.82 -0.52 0
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31745 3288096 1 FON2C24H27 ABC2D24E27 -37.21 5.13 -8.87 -0.23 0
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31746 3288098 1 N2O2C27H34 A2B2C27D34 -44.46 4.75 -8.6 -0.02 0
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31747 3288099 1 N2O3C25H30 A2B3C25D30 -66.3 2.22 -8.52 -0.07 0
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31748 3288100 1 ClON2C19H25 ABC2D19E25 -30.92 1.97 -8.68 0.05 0
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31749 3288106 2 N2O2C17H21 A2B2C17D21 -101.1 2.38 -8.12 0.19 0
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31750 3711129 2 ON2C7H8 AB2C7D8 18.98 6.56 -8.28 -0.39 0