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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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151136 53790834 1 SN3O5C26H37 AB3C5D26E37 -180.85 7.23 -8.62 -0.04 0
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151137 53790835 1 ClF2N2O5H13C15 AB2C2D5E13F15 -186.88 4.39 -10.54 -1.94 0
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151138 53790836 1 N2O5C15H22 A2B5C15D22 -211.12 3.88 -8.3 -0.02 0
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151139 53790837 1 O2S2Cl3N3H18C21 A2B2C3D3E18F21 -7.58 5.43 -9.06 -1.63 0
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151140 53790838 2 ON2C12H18 AB2C12D18 -56.28 3.07 -7.95 0.35 0
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151141 53790839 1 N4H16C17 A4B16C17 85.74 8.5 -9.09 -0.83 0
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151142 53790840 1 SN2O7C30H46 AB2C7D30E46 -302.74 4.93 -10.1 -0.68 -1
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151143 53790841 1 N2O3C25H35 A2B3C25D35 -52.94 1.92 0.0 0.0 0
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151144 53790842 1 N2O3C21H26 A2B3C21D26 -85.48 1.79 -8.83 -0.36 0
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151145 53790843 1 N2O3C38H40 A2B3C38D40 -46.16 5.78 -8.7 -0.98 0
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151146 53790845 1 NSO3H13C15 ABC3D13E15 -76.51 7.93 -8.8 -1.14 0
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151147 53790846 2 N2H17C25 A2B17C25 277.19 1.41 -8.68 -0.9 0
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151148 53790847 1 O3C27H34 A3B27C34 -126.8 7.27 -8.96 -0.88 0
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151149 53790848 1 O5C22H28 A5B22C28 -195.44 3.68 -9.42 -0.56 0
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151150 53790849 1 NO4C20H31 AB4C20D31 -104.53 3.48 -10.18 -1.11 0
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151151 53790850 1 ClFON6H20C21 ABCD6E20F21 56.48 6.05 -8.9 -1.35 0
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151152 53790851 1 OSN5C13H23 ABC5D13E23 11.81 4.9 -8.6 -0.32 0
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151153 53790852 1 N2O4C15H20 A2B4C15D20 -135.83 3.2 -9.3 -0.16 0
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151154 53790853 1 BrCl2O5H19C20 AB2C5D19E20 -161.38 5.05 -9.31 -1.34 0
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151155 53790855 1 BrNOF2H4C7 ABCD2E4F7 -103.54 3.47 -10.34 -1.23 0
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151156 53790856 1 NI2O3C10H11 AB2C3D10E11 -91.7 4.46 -8.89 -2.66 0
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151157 53790857 1 SN2Cl3O3H19C23 AB2C3D3E19F23 -76.16 9.06 -8.92 -0.8 0
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151158 53790858 1 N4C27H34 A4B27C34 65.82 1.45 -7.92 0.26 1
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151159 53790859 1 N2O4H17C21 A2B4C17D21 -74.8 6.22 0.0 0.0 0
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151160 53790860 1 BrSC22H25 ABC22D25 51.1 3.55 -8.88 -1.53 0