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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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346684 127271188 1 SO2N4C20H22 AB2C4D20E22 27.66 2.25 -8.81 -0.91 0
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346685 127271189 1 SO2N4C20H22 AB2C4D20E22 25.94 2.69 -8.78 -0.98 0
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346686 127271190 1 FON6C20H23 ABC6D20E23 54.59 5.09 -9.22 -0.89 0
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346687 127271191 1 FO2N4C21H27 AB2C4D21E27 -67.24 6.24 -9.1 -0.82 0
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346688 127271192 1 FO2N4C21H27 AB2C4D21E27 -66.88 3.33 -9.26 -0.92 0
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346689 127271193 1 FO2N4C21H27 AB2C4D21E27 -73.97 2.6 -9.46 -0.94 0
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346690 127271194 1 FO2N4C21H27 AB2C4D21E27 -66.99 6.19 -9.3 -0.76 0
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346691 127271195 1 FON6C20H23 ABC6D20E23 30.39 5.97 -9.46 -1.04 0
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346692 127271196 1 FON6C20H23 ABC6D20E23 55.08 4.77 -9.2 -1.01 0
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346693 127271197 1 FO2N4C21H27 AB2C4D21E27 -66.32 6.21 -9.12 -0.9 0
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346694 127271198 1 FO2N4C21H27 AB2C4D21E27 -66.06 4.35 -9.27 -1.01 0
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346695 127271199 1 FO2N4C21H27 AB2C4D21E27 -73.27 1.41 -9.48 -1.04 0
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346696 127271200 1 FO2N4C21H27 AB2C4D21E27 -66.1 7.1 -9.31 -0.84 0
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346697 127271201 1 ClON6C20H23 ABC6D20E23 67.68 5.25 -9.47 -1.04 0
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346698 127271202 1 ClON6C20H23 ABC6D20E23 94.82 4.33 -9.26 -1.05 0
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346699 127271203 1 ClON7C18H20 ABC7D18E20 130.78 7.17 -9.47 -0.9 0
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346700 127271204 1 ClO2N4C20H25 AB2C4D20E25 -29.2 3.21 -9.5 -1.06 0
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346701 127271205 1 ClO2N5C20H22 AB2C5D20E22 68.4 3.51 -9.45 -1.05 0
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346702 127271206 1 ClO2N4C20H25 AB2C4D20E25 -22.71 6.32 -9.31 -0.85 0
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346703 127271207 1 N3O3C23H33 A3B3C23D33 -97.17 5.6 -8.52 0.41 0
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346704 127271208 1 SO2N6C15H22 AB2C6D15E22 19.12 2.89 -8.82 -1.53 0
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346705 127271209 1 SO3N4C17H26 AB3C4D17E26 -104.55 2.69 -8.68 -0.82 0
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346706 127271210 1 SN2O3C13H26 AB2C3D13E26 -151.83 3.21 -8.72 0.39 0
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346707 127271211 1 SO2N5C16H25 AB2C5D16E25 -33.61 5.0 -8.69 -0.88 0
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346708 127271212 1 SN2O4C16H24 AB2C4D16E24 -141.37 6.15 -8.62 -0.67 0
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346709 127271213 1 FSN3O3C17H24 ABC3D3E17F24 -171.45 4.84 -8.68 -1.09 0
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346710 127271214 1 SN3O3C18H27 AB3C3D18E27 -93.13 1.68 -8.68 -0.94 0
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346711 127271215 1 SN2O3C18H32 AB2C3D18E32 -151.47 1.81 -8.56 0.38 0
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346712 127271216 1 SN3O4C19H29 AB3C4D19E29 -148.1 5.75 -8.79 -1.08 0
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346713 127271217 1 SO2N3C14H29 AB2C3D14E29 -105.09 3.86 -8.67 0.04 0
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346714 127271218 1 SN4O4C16H22 AB4C4D16E22 -157.13 2.48 -8.74 -1.38 0
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346715 127271219 1 SO2N3C18H25 AB2C3D18E25 -50.83 4.14 -8.66 -1.19 0
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346716 127271220 1 SO2N6C15H22 AB2C6D15E22 17.91 5.57 -8.8 -1.81 0
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346717 127271221 1 SN3O3C18H27 AB3C3D18E27 -119.9 8.56 -8.62 -0.62 0
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346718 127271222 1 SO2N3C11H19 AB2C3D11E19 -76.12 4.99 -8.04 -0.2 0
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346719 127271223 1 SN3O5C16H21 AB3C5D16E21 -175.88 7.25 -9.55 -1.26 0
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346720 127271224 1 SN3O5C14H15 AB3C5D14E15 -161.88 5.3 -9.62 -2.09 0
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346721 127271225 1 S2N3O5C14H19 A2B3C5D14E19 -155.08 6.52 -9.44 -1.32 0
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346722 127271226 1 NSO5C20H23 ABC5D20E23 -150.61 6.59 -9.12 -0.46 0
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346723 127271227 1 NS2O3C17H21 AB2C3D17E21 -93.94 4.75 -9.19 -0.51 0
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346724 127271228 1 N2S2O3C8H16 A2B2C3D8E16 -127.38 1.85 -9.13 -0.17 0
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346725 127271229 1 N2S3O4C13H22 A2B3C4D13E22 -163.81 8.74 -9.47 -0.65 0
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346726 127271230 1 FN3O3C17H22 AB3C3D17E22 -106.3 4.26 -9.22 -0.47 0
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346727 127271231 1 ClO2N4C18H21 AB2C4D18E21 -17.56 6.25 -9.47 -0.87 0
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346728 127271232 1 SO2N4C20H26 AB2C4D20E26 -50.99 3.44 -8.16 -0.49 0
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346729 127271233 1 N3O4C20H29 A3B4C20D29 -168.98 2.21 -8.63 0.12 0
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346730 127271234 1 FN3O4C18H26 AB3C4D18E26 -204.6 1.91 -8.8 -0.53 0
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346731 127271235 1 FN3O4C16H20 AB3C4D16E20 -197.04 8.52 -9.0 -0.23 0
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346732 127271236 1 FN3O3C18H24 AB3C3D18E24 -138.65 5.04 -8.87 -0.7 0
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346733 127271237 1 OSN4C17H28 ABC4D17E28 -28.86 3.12 -8.72 -0.5 0