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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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180301 76611967 1 NO8C36H43 AB8C36D43 -302.83 7.34 -8.92 -0.69 0
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180302 76612263 1 O2C7H10 A2B7C10 -75.67 4.89 -10.66 0.63 0
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180303 76612264 1 ClFN3O5H25C30 ABC3D5E25F30 -151.85 7.4 -9.03 -1.0 0
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180304 76612265 1 NO2C7H9 AB2C7D9 -74.28 3.28 -10.73 -0.31 0
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180305 76612671 1 SiO3C19H38 AB3C19D38 -234.23 4.23 -9.06 0.59 0
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180306 76612672 1 SO3C14H18 AB3C14D18 -91.55 5.9 -8.92 -0.25 0
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180307 76612845 1 BN2O4C23H31 AB2C4D23E31 -145.92 5.89 -8.77 0.05 0
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180308 76613073 1 BrO3N8C22H31 AB3C8D22E31 -96.14 2.9 -8.57 -0.39 0
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180309 76613096 1 SO3N5C21H27 AB3C5D21E27 -58.28 3.74 -9.35 -0.64 -1
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180310 76613304 1 BrClN2O3C20H21 ABC2D3E20F21 -60.16 4.96 0.0 0.0 0
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180311 76613503 2 NO2C11H13 AB2C11D13 -106.48 4.22 -8.95 -0.5 0
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180312 76613701 1 SN4O5C29H32 AB4C5D29E32 -129.32 3.54 -8.74 -0.91 0
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180313 76613938 1 SK2N2O6H10C13 AB2C2D6E10F13 -209.21 15.5 -8.5 -0.5 0
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180314 76614176 1 NO3C11H15 AB3C11D15 -113.52 4.74 -9.23 -0.29 0
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180315 76614177 1 SN2O3C12H18 AB2C3D12E18 -101.96 3.63 -8.46 -0.48 0
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180316 76614412 1 NO2C15H23 AB2C15D23 -90.17 3.12 -8.75 0.44 0
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180317 76615073 1 BrO2S2N6H15C18 AB2C2D6E15F18 104.52 5.03 -8.76 -1.63 0
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180318 76615074 1 KCl2N3S3O4H16C19 AB2C3D3E4F16G19 -89.87 8.26 -6.68 -0.73 0
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180319 76615448 1 BN6O6C29H45 AB6C6D29E45 -243.22 1.91 -9.33 -1.07 0
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180320 76615626 1 BN6O7C31H47 AB6C7D31E47 -261.89 4.47 -9.16 -1.02 0
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180321 76615872 1 O2N5C28H31 A2B5C28D31 -4.67 3.94 -8.38 -0.31 0
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180322 76615873 2 FON2C14H18 ABC2D14E18 -124.48 5.55 -8.82 -0.27 0
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180323 76615889 1 O2N3C26H33 A2B3C26D33 -56.14 5.87 -8.54 -0.05 -1
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180324 76616751 1 NO2C8H14 AB2C8D14 -80.16 3.11 0.0 0.0 0
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180325 76616870 1 ClF3O6N7C34H41 AB3C6D7E34F41 -373.17 5.31 -8.95 -0.86 0