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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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146165 53646364 1 S3N5O7H37C38 A3B5C7D37E38 -113.86 8.8 -8.79 -1.63 0
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146166 53646365 1 ClN2O3H9C11 AB2C3D9E11 -96.05 6.95 -9.3 -0.71 0
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146167 53646366 2 ClN2O3C8H8 AB2C3D8E8 -110.73 8.27 -9.91 -1.44 0
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146168 53646367 1 BrNS2F3H5C6 ABC2D3E5F6 -104.13 2.69 -9.07 -1.53 0
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146169 53646397 1 O4H26C27 A4B26C27 -126.89 7.61 -8.74 -1.03 0
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146170 53646512 2 NO3C16H24 AB3C16D24 -322.02 1.82 -10.05 -0.25 0
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146171 53647455 1 SO2N4C18H22 AB2C4D18E22 8.86 4.25 -8.78 0.17 0
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146172 53647511 1 SN2C5H10 AB2C5D10 10.23 7.0 -8.49 0.32 0
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146173 53647840 1 S2O6H32C33 A2B6C32D33 -134.95 7.03 -8.61 -0.25 0
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146174 53648108 1 PSC3O4H9 ABC3D4E9 -185.31 5.6 -9.97 -0.46 0
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146175 53648109 1 N2O2H22C23 A2B2C22D23 -6.13 4.2 -8.4 -0.27 0
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146176 53648157 1 NOC17H21 ABC17D21 -20.5 4.02 -8.87 0.32 0
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146177 53648484 1 O7H12C16 A7B12C16 -225.65 5.89 -9.45 -1.35 0
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146178 53648654 1 O5N6H24C25 A5B6C24D25 2.25 11.09 -9.41 -1.07 0
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146179 53648655 1 O8C25H44 A8B25C44 -442.33 5.1 -10.66 -0.22 0
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146180 53648733 1 O2H14C15 A2B14C15 -9.05 0.72 -8.92 0.04 0
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146181 53648736 1 N2O5C25H32 A2B5C25D32 -184.33 1.34 -8.06 -0.06 0
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146182 53648737 1 N2O5C25H32 A2B5C25D32 -181.16 3.18 -8.28 -0.22 0
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146183 53648795 2 NO3C18H20 AB3C18D20 -147.99 2.36 -7.88 -1.08 0
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146184 53648848 1 N2O2S3C10H18 A2B2C3D10E18 -52.47 4.87 -9.19 -1.56 0
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146185 53648849 1 FSiO4C18H29 ABC4D18E29 -269.68 1.76 -8.78 -0.69 0
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146186 53648850 1 O4N5C24H31 A4B5C24D31 -117.77 4.63 -8.58 -0.34 0
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146187 53648851 1 N2O4C15H16 A2B4C15D16 -54.64 3.07 -9.7 -1.42 0
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146188 53648852 1 O3C27H40 A3B27C40 -197.25 3.35 -9.23 0.72 0
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146189 53648853 1 NOF3C10H10 ABC3D10E10 -144.73 4.03 -9.56 -0.81 0
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146190 53648854 1 NO2C24H31 AB2C24D31 -44.65 3.17 -8.42 -0.28 0
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146191 53648855 1 N5O6C22H33 A5B6C22D33 -255.57 4.36 -9.12 -0.34 0
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146192 53649114 1 F2N2S2O3H12C18 A2B2C2D3E12F18 -143.87 5.68 -9.2 -1.41 0
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146193 53649115 1 ON2H14C17 AB2C14D17 34.86 6.73 -9.16 -1.02 0
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146194 53649116 2 NOC7H8 ABC7D8 -39.96 7.54 -9.16 -0.61 0
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146195 53649117 1 ClBr2N3O3C34H42 AB2C3D3E34F42 -110.89 4.71 -9.2 -0.89 0
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146196 53649118 1 OC26H28 AB26C28 83.24 1.5 -8.63 -0.22 0
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146197 53649447 1 O2N3C13H13 A2B3C13D13 -12.16 4.84 -8.45 -0.8 0
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146198 53649871 1 FNSO2C20H22 ABCD2E20F22 -98.91 3.84 -8.96 -0.38 0
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146199 53649872 2 NO2C6H10 AB2C6D10 -189.02 6.28 -9.26 1.02 0
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146200 53649931 1 O2N6C15H26 A2B6C15D26 -30.48 5.0 -9.22 -0.02 0
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146201 53650006 2 C4N5H9 A4B5C9 93.55 7.22 -9.18 0.36 0
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146202 53650048 1 N2O5C24H30 A2B5C24D30 -192.6 3.7 -9.13 -0.4 0
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146203 53650089 1 ClON3C14H20 ABC3D14E20 -32.36 2.98 -9.23 -0.09 0
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146204 53650588 1 NO4C11H15 AB4C11D15 -168.11 3.57 -10.19 -1.24 0
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146205 53650721 1 O3C21H26 A3B21C26 -104.79 2.84 -8.81 -0.07 0
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146206 53650762 1 O3N5H19C25 A3B5C19D25 77.58 3.41 -8.77 -1.31 1
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146207 53650810 1 N2C3H7 A2B3C7 38.96 2.97 0.0 0.0 0
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146208 53651090 1 NSO2F3H12C17 ABC2D3E12F17 -165.71 3.7 -8.39 -1.08 0
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146209 53651091 1 IN4H23C32 AB4C23D32 230.63 4.0 -7.94 -1.54 0
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146210 53651092 2 OC9H12 AB9C12 -72.67 3.1 -8.14 0.35 0
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146211 53651168 1 SN3O4H17C19 AB3C4D17E19 -56.71 2.67 -8.78 -1.16 1
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146212 53651169 1 N5O6C29H42 A5B6C29D42 -142.71 5.55 0.0 0.0 0
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146213 53651543 1 SSiN4O6C29H46 ABC4D6E29F46 -266.68 6.24 -8.6 -0.53 0
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146214 53651544 1 ClS2N3O5C21H22 AB2C3D5E21F22 -125.89 2.61 -8.78 -1.65 0