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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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191199 78117011 1 SeN2O11C23H26 AB2C11D23E26 -441.48 4.21 -8.54 -1.38 0
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191200 78117012 1 SeN2O11C28H28 AB2C11D28E28 -416.68 7.25 -8.62 -1.6 0
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191201 78117013 1 SeN2O7C20H20 AB2C7D20E20 -234.4 6.95 -8.64 -1.64 2
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191202 78117095 1 MnN2O4C24H30 AB2C4D24E30 -57.36 2.89 0.0 0.0 0
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191203 78117357 1 SiO3C19H32 AB3C19D32 -180.47 1.82 -8.92 0.21 0
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191204 78117358 1 N2O3C16H20 A2B3C16D20 -41.4 1.65 -9.25 -0.76 1
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191205 78117359 1 N2O3C16H21 A2B3C16D21 -31.13 3.25 0.0 0.0 0
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191206 78117386 1 NO2C17H23 AB2C17D23 2.39 2.27 -9.31 0.38 0
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191207 78117806 1 O2C27H36 A2B27C36 -61.94 1.18 -9.49 -1.75 0
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191208 78117807 2 N2O5C12H19 A2B5C12D19 -488.25 3.43 -9.89 -0.09 0
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191209 78118027 1 N4O5C17H22 A4B5C17D22 -184.41 4.5 -8.97 -0.3 0
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191210 78118101 1 NO2C17H23 AB2C17D23 -86.35 6.1 -9.28 0.45 0
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191211 78118102 1 N13O13C75H117 A13B13C75D117 -773.99 16.85 -9.44 0.0 0
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191212 78118193 1 N2O5C18H22 A2B5C18D22 -161.19 2.1 -9.56 -0.03 0
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191213 78118194 1 SN2O4C18H22 AB2C4D18E22 -108.83 3.39 -8.8 -0.66 0
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191214 78118919 2 O3C11H15 A3B11C15 -272.23 7.88 -9.71 -0.63 0
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191215 78118979 1 F5N5O6C20H20 A5B5C6D20E20 -349.91 13.52 -9.77 -1.08 0
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191216 78119784 2 O3C19H26 A3B19C26 -294.55 2.38 -9.0 0.04 0
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191217 78119785 1 NSO11C28H29 ABC11D28E29 -409.1 1.34 -8.56 -1.07 0
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191218 78119786 1 ClNSO11C28H28 ABCD11E28F28 -421.98 4.34 -8.76 -1.14 0
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191219 78119787 1 SN3O3H15C16 AB3C3D15E16 -7.2 5.34 -8.46 -1.43 0
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191220 78119788 1 O41C77H126 A41B77C126 -1833.29 10.29 -8.11 0.17 0
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191221 78119789 1 O2N8C23H28 A2B8C23D28 36.29 5.92 -9.29 -0.72 1
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191222 78119790 1 O2N8C25H29 A2B8C25D29 65.87 3.56 0.0 0.0 0
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191223 78119914 1 N2O2F3C20H23 A2B2C3D20E23 -204.48 8.91 -8.68 -0.23 0