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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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177810 76233978 1 S2N3O3C21H25 A2B3C3D21E25 -50.32 5.49 -9.05 -1.34 0
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177811 76233979 1 SN3O3H17C21 AB3C3D17E21 9.48 8.2 -9.33 -1.58 0
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177812 76234262 1 SO4N5C23H27 AB4C5D23E27 -74.67 4.51 -8.49 -1.74 0
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177813 76234595 1 NO5H23C25 AB5C23D25 -139.5 4.71 -8.82 -1.65 0
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177814 76234653 1 F2N5O5C23H29 A2B5C5D23E29 -270.97 2.6 -9.78 -0.92 0
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177815 76234707 1 N4O5C21H28 A4B5C21D28 -161.0 11.01 -9.06 -0.84 0
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177816 76234708 1 N5O5C25H33 A5B5C25D33 -178.65 5.76 -8.69 -0.55 0
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177817 76234926 1 FO4N6C23H27 AB4C6D23E27 -135.54 3.63 -9.6 -0.94 0
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177818 76235261 1 FSN3O4C20H24 ABC3D4E20F24 -141.39 2.43 -9.45 -1.2 0
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177819 76235343 2 O2N3C12H15 A2B3C12D15 -89.75 4.83 -9.01 -0.49 0
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177820 76235344 1 O3N5C23H35 A3B5C23D35 -130.76 6.58 -9.12 -0.31 0
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177821 76236427 1 O2S2N7H13C16 A2B2C7D13E16 115.84 15.07 -9.47 -2.11 0
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177822 76237299 1 F2N3O4C20H23 A2B3C4D20E23 -188.65 6.33 -8.97 -0.8 0
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177823 76237533 1 ClSN2F3O3H18C19 ABC2D3E3F18G19 -232.75 4.25 -9.86 -1.26 0
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177824 76237892 1 BrN2O4H9C15 AB2C4D9E15 -19.13 7.7 -9.92 -2.28 0
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177825 76237893 1 N3O4H25C26 A3B4C25D26 -60.83 3.63 -8.73 -0.64 0
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177826 76237894 1 N2O5C21H22 A2B5C21D22 -164.99 2.98 -8.55 -1.15 0
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177827 76238433 1 NSO4H19C22 ABC4D19E22 -66.82 2.44 -8.34 -1.16 0
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177828 76238434 2 NO3C12H12 AB3C12D12 -117.38 4.05 -8.41 -0.71 0
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177829 76238625 1 SO2F3N4C15H15 AB2C3D4E15F15 -192.51 9.83 -9.47 -1.56 0
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177830 76238774 1 N5O5C23H29 A5B5C23D29 -176.76 5.36 -9.49 -0.39 0
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177831 76238856 2 SN2O2C10H10 AB2C2D10E10 -29.09 9.41 -9.05 -1.64 0
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177832 76239041 1 N2O5C19H20 A2B5C19D20 -161.87 4.38 -8.84 -0.73 1
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177833 76239333 1 ClS2O4N5C15H17 AB2C4D5E15F17 -72.75 5.55 0.0 0.0 0
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177834 76239576 1 SO3N7C19H31 AB3C7D19E31 -75.9 2.63 -9.11 -0.59 0