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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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327176 126689155 1 PC10F15 AB10C15 -734.32 1.24 -10.89 -1.9 0
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327177 126689157 1 FO2N5C27H32 AB2C5D27E32 -73.01 3.9 -8.65 -1.06 0
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327178 126689158 1 BrNF2O4H18C20 ABC2D4E18F20 -194.0 8.61 -9.12 -0.59 0
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327179 126689159 1 BrNF2O4H18C20 ABC2D4E18F20 -202.95 8.93 -9.35 -0.5 0
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327180 126689163 1 SF2O3H4C6 AB2C3D4E6 -184.23 2.45 -9.48 -0.8 0
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327181 126689164 1 BrFON3H13C14 ABCD3E13F14 -40.24 2.38 -8.85 -1.34 0
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327182 126689166 1 FO2N5C27H32 AB2C5D27E32 -72.78 4.68 -8.48 -0.81 0
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327183 126689167 1 FO3N5C27H32 AB3C5D27E32 -68.89 4.01 -8.71 -1.12 0
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327184 126689168 1 BrFN2O2H12C13 ABC2D2E12F13 -95.05 5.2 -9.37 -1.3 0
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327185 126689171 1 FO2N5C25H28 AB2C5D25E28 -46.51 2.12 -8.72 -1.14 -1
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327186 126689173 1 FSO2C6H10 ABC2D6E10 -125.88 3.81 0.0 0.0 0
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327187 126689177 1 FO2N5C25H28 AB2C5D25E28 -46.05 5.46 -8.55 -0.85 0
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327188 126689178 1 FO2N5C24H28 AB2C5D24E28 -60.03 3.71 -8.58 -0.9 0
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327189 126689181 1 O3N6H24C32 A3B6C24D32 112.12 7.13 -8.63 -1.16 0
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327190 126689182 1 FO2N5C26H30 AB2C5D26E30 -64.9 3.36 -8.56 -0.9 0
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327191 126689183 1 F4O6N7C45H45 A4B6C7D45E45 -292.92 1.38 -8.63 -0.96 0
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327192 126689184 1 F2O3N4C19H20 A2B3C4D19E20 -152.21 9.95 -9.25 -0.89 0
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327193 126689185 1 HSC4O4F9 ABC4D4E9 -621.48 1.84 -12.94 -2.19 0
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327194 126689186 1 FSC4O4H11 ABC4D4E11 -257.94 4.49 -11.49 -0.56 0
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327195 126689187 1 FO2N5C23H26 AB2C5D23E26 -60.58 3.04 -8.83 -1.19 0
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327196 126689190 1 FPO3C8H10 ABC3D8E10 -209.56 2.81 -9.42 -0.22 0
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327197 126689191 1 BrN2O2C15H17 AB2C2D15E17 -58.95 6.53 -8.89 -1.01 0
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327198 126689196 1 O2N5C27H33 A2B5C27D33 -26.64 2.93 -8.58 -0.9 0
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327199 126689197 1 NH9C11 AB9C11 71.38 2.84 -9.17 -0.69 0
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327200 126689201 1 PF4H11C14 AB4C11D14 -175.28 2.2 -8.93 -0.28 0
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327201 126689203 1 F3O3N4H27C29 A3B3C4D27E29 -157.0 4.17 -9.35 -1.1 0
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327202 126689206 1 FSC2H3O3 ABC2D3E3 -160.32 2.03 -10.0 -0.78 0
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327203 126689207 1 FO3N5H24C31 AB3C5D24E31 24.91 6.83 -8.59 -1.02 0
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327204 126689212 1 FPO3C12H16 ABC3D12E16 -227.96 3.01 -9.57 -0.29 0
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327205 126689213 1 O3N6H22C31 A3B6C22D31 113.82 10.99 -8.79 -1.24 0
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327206 126689215 1 O2N5C24H29 A2B5C24D29 -13.17 2.52 -8.57 -0.89 0
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327207 126689219 1 ClN5C15H16 AB5C15D16 73.72 6.08 -8.82 -0.76 -1
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327208 126689223 1 FSO2C6H10 ABC2D6E10 -125.85 3.87 0.0 0.0 0
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327209 126689224 1 FSO2C6H11 ABC2D6E11 -145.48 2.59 -8.94 0.2 0
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327210 126689226 1 NaSO5H11C16F18 ABC5D11E16F18 -1159.81 20.87 -9.49 -1.19 0
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327211 126689227 1 SO5H12C16F18 AB5C12D16E18 -1128.63 1.59 -11.2 -0.87 0
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327212 126689230 2 ON3C18H23 AB3C18D23 -21.4 6.69 -8.54 -0.28 0
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327213 126689233 1 O3N5C30H41 A3B5C30D41 -88.42 2.94 -8.33 -0.21 0
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327214 126689235 1 NO2H15C16 AB2C15D16 -21.73 2.37 -8.41 -0.53 0
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327215 126689236 1 O2C9H16 A2B9C16 -17.02 3.43 -9.82 0.65 0
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327216 126689238 1 O2F3N4H21C25 A2B3C4D21E25 -122.5 7.46 -9.32 -1.0 0
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327217 126689246 1 N3O4C14H19 A3B4C14D19 -86.72 9.29 -8.86 -1.01 0
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327218 126689248 1 O2F3N4C25H25 A2B3C4D25E25 -162.77 3.24 -8.72 -1.14 0
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327219 126689251 1 F2O3N4C24H26 A2B3C4D24E26 -174.73 4.26 -9.1 -1.04 0
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327220 126689255 1 FN2O3C11H11 AB2C3D11E11 -71.65 7.31 -9.66 -1.53 0
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327221 126689258 1 F3N4O4C31H31 A3B4C4D31E31 -219.8 3.02 -9.05 -0.92 0
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327222 126689259 1 F3O3N4C25H27 A3B3C4D25E27 -224.53 2.69 -8.87 -0.88 0
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327223 126689261 1 F3N3O5H22C23 A3B3C5D22E23 -294.08 7.5 -9.36 -1.17 0
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327224 126689280 1 FN2O3H7C11 AB2C3D7E11 -47.0 8.03 -9.43 -1.45 0
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327225 126689282 1 O2F3N4H23C24 A2B3C4D23E24 -152.43 6.57 -8.88 -1.15 0