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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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81800 49855174 1 N2S4O11C42H47 A2B4C11D42E47 -356.68 4.61 0.0 0.0 1
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81801 49855176 1 S2N3O5C37H44 A2B3C5D37E44 -125.14 3.93 0.0 0.0 0
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81802 49855180 1 ClFSO3N5H17C18 ABCD3E5F17G18 -81.32 6.28 -8.72 -0.62 0
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81803 49855183 1 ClSO3N5C19H20 ABC3D5E19F20 -47.39 5.52 -8.6 -0.52 0
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81805 49855185 1 ClSO4N5C19H20 ABC4D5E19F20 -75.5 7.16 -8.48 -0.48 0
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81806 49855186 1 ClSO3N5C20H22 ABC3D5E20F22 -52.21 5.69 -8.5 -0.34 0
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81807 49855189 2 N2O3C13H16 A2B3C13D16 -233.3 2.65 -9.04 -0.02 0
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81808 49855190 1 SF3O3N6C24H31 AB3C3D6E24F31 -255.42 5.12 -8.96 -0.89 0
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81809 49855191 1 FSO2N6C18H23 ABC2D6E18F23 -97.09 7.84 -8.86 -0.95 0
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81810 49855192 1 S2F3O3N5C17H18 A2B3C3D5E17F18 -211.95 3.42 -8.94 -1.28 0
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81811 49855193 1 O2S2F3N5C18H20 A2B2C3D5E18F20 -185.63 4.87 -8.62 -0.94 0
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81812 49855195 1 SO2F3N6C22H29 AB2C3D6E22F29 -211.95 6.92 -8.84 -0.78 0
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81813 49855196 1 ClSO4N5H18C23 ABC4D5E18F23 -12.34 4.89 -8.82 -1.54 0
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81814 49855200 1 SN4O5H22C23 AB4C5D22E23 -73.48 5.14 -9.01 -1.31 0
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81815 49855201 1 SN2O4C23H24 AB2C4D23E24 -80.5 7.22 -8.92 -0.65 0
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81816 49855202 1 SF3O4C22H25 AB3C4D22E25 -307.45 5.16 -8.99 -0.59 0
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81817 49855203 1 NSCl2O4C22H23 ABC2D4E22F23 -129.31 7.06 -9.1 -0.82 0
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81818 49855205 1 ClON6C19H21 ABC6D19E21 24.43 5.24 -9.02 -0.89 0
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81819 49855206 1 ClON6C18H19 ABC6D18E19 41.79 6.32 -8.91 -0.82 0
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81820 49855207 1 ClSN3O4H12C18 ABC3D4E12F18 -23.82 6.79 -9.52 -1.78 0
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81821 49855209 1 NSO6C21H21 ABC6D21E21 -196.85 10.53 -8.46 -0.82 0
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81822 49855211 1 NSO7H19C20 ABC7D19E20 -216.84 12.51 -8.71 -1.03 0
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81823 49855213 1 N2O5C17H18 A2B5C17D18 -176.06 5.78 -9.27 -1.46 0
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81824 49855214 1 SN2O8H14C18 AB2C8D14E18 -171.68 10.57 -8.72 -2.0 0
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81825 49855216 1 N2O9C22H24 A2B9C22D24 -353.61 4.74 -8.92 -1.27 0