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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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193138 78349903 1 SN3C6H7 AB3C6D7 70.47 6.54 -8.69 -1.88 0
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193139 78349904 1 O3N5C9H17 A3B5C9D17 -121.09 3.68 -8.08 0.03 0
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193140 78349905 1 SP3N7O16C21H42 AB3C7D16E21F42 -880.55 12.36 -8.83 -0.46 0
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193141 78349906 1 O17C56H136 A17B56C136 -1198.43 7.2 -10.56 0.2 0
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193142 78349907 1 SN4O8C16H18 AB4C8D16E18 -229.3 3.83 -9.67 -1.13 1
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193143 78349908 1 N12O15C51H71 A12B15C51D71 -634.5 13.25 0.0 0.0 0
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193144 78349909 1 N12O15C51H70 A12B15C51D70 -668.09 9.15 -8.73 -0.48 0
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193145 78349910 1 S2O3N5C19H29 A2B3C5D19E29 -60.17 4.67 -9.04 -0.05 1
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193146 78349911 1 PN7O19C43H61 AB7C19D43E61 -896.25 5.15 0.0 0.0 0
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193147 78349912 1 PN7O19C43H60 AB7C19D43E60 -896.13 9.83 -9.17 -0.56 0
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193148 78349913 1 ClN3O5C16H18 AB3C5D16E18 -184.73 10.96 -9.63 -0.67 0
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193149 78349914 2 OC10H16 AB10C16 -113.76 5.09 -8.93 0.71 0
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193150 78349915 1 O6C23H36 A6B23C36 -305.47 4.16 -9.0 0.4 1
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193151 78349916 1 P2N6O15C21H23 A2B6C15D21E23 -552.6 6.29 0.0 0.0 0
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193152 78349917 2 NO2C5H9 AB2C5D9 -184.7 6.29 -10.19 0.23 0
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193153 78349918 2 N2C11H13 A2B11C13 83.04 2.98 -7.71 -0.04 0
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193154 78349919 1 N3O4C10H17 A3B4C10D17 -175.68 9.79 -9.91 0.1 0
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193155 78349920 1 PSN4O8C10H15 ABC4D8E10F15 -349.36 6.08 -9.57 -1.2 0
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193156 78350376 1 SO2N3C17H21 AB2C3D17E21 -65.42 8.55 -8.87 -0.68 0
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193157 78350443 1 C17H40 A17B40 -103.21 0.07 -10.52 4.07 1
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193158 78351417 1 ClSN4O5C24H28 ABC4D5E24F28 -114.38 3.74 0.0 0.0 0
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193159 78351418 1 ClSN4O5C24H27 ABC4D5E24F27 -137.67 2.36 -8.89 -1.8 0
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193160 78351419 1 ClSN3O4C21H30 ABC3D4E21F30 -162.36 4.36 -9.36 -0.37 0
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193161 78351420 1 ClSN3O4C26H30 ABC3D4E26F30 -133.91 3.87 -9.27 -0.41 0
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193162 78351421 1 ClSN3O5H18C22 ABC3D5E18F22 -98.13 3.12 -9.36 -1.84 0
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193163 78351422 1 O2N4C25H26 A2B4C25D26 35.66 2.73 -8.51 -0.38 0
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193164 78351423 1 SO3N4C15H16 AB3C4D15E16 -59.72 4.89 -9.48 -0.71 0
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193165 78351535 1 NO3C16H27 AB3C16D27 -173.86 7.94 -10.02 0.04 1
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193166 78351978 1 SO2N3C14H18 AB2C3D14E18 -1.66 4.4 0.0 0.0 0
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193167 78352454 1 FSN5O5C24H28 ABC5D5E24F28 -186.52 6.35 -8.07 -0.8 0
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193168 78352940 1 SN2O5H20C21 AB2C5D20E21 -124.96 7.32 -9.13 -1.63 0
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193169 78352941 1 SN2O5C26H28 AB2C5D26E28 -142.7 6.94 -8.98 -1.45 0
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193170 78352950 1 SN2O5C24H24 AB2C5D24E24 -135.78 7.54 -8.91 -1.59 0
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193171 78353000 1 SN2O6H28C31 AB2C6D28E31 -123.36 5.52 -8.84 -1.6 0
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193172 78353078 1 N2O2S2H14C15 A2B2C2D14E15 1.62 4.35 -8.64 -1.58 0
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193173 78353123 1 S2N3O3H17C18 A2B3C3D17E18 -17.55 5.44 -8.93 -1.77 1
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193174 78353264 1 ON3H16C17 AB3C16D17 65.67 2.36 0.0 0.0 0
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193175 78353277 1 O3N4H14C15 A3B4C14D15 -13.61 6.26 -9.21 -1.33 1
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193176 78353278 1 N3O7H22C23 A3B7C22D23 -194.78 4.34 0.0 0.0 0
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193177 78353279 1 OSN4C9H10 ABC4D9E10 12.34 4.11 -9.25 -1.27 0
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193178 78353280 1 O3N4C19H22 A3B4C19D22 -5.72 5.04 -8.52 -0.55 0
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193179 78353281 1 S2N3O3C14H17 A2B3C3D14E17 -73.87 2.63 -9.13 -1.95 0
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193180 78353282 1 O2S2N4C15H16 A2B2C4D15E16 -22.05 4.24 -9.0 -0.92 0
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193181 78353283 1 SN4O4C14H20 AB4C4D14E20 -139.41 6.48 -8.4 -0.35 0
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193182 78353606 1 SO3N5C17H19 AB3C5D17E19 22.83 9.03 -8.62 -1.32 1
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193183 78354328 1 ClFO3N5C18H20 ABC3D5E18F20 -106.1 2.09 0.0 0.0 0
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193184 78354430 1 SCl2O2N3H23C26 AB2C2D3E23F26 -19.46 9.36 -9.03 -0.99 0
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193185 78354431 1 OSN4C17H20 ABC4D17E20 47.46 7.6 -8.8 -0.57 0
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193186 78354432 1 OSN4C17H26 ABC4D17E26 -18.93 4.97 -8.61 -0.1 0
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193187 78354722 1 SN2O2C26H30 AB2C2D26E30 -52.3 7.18 -9.04 -0.57 1