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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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129382 51072449 1 SO2N3C18H23 AB2C3D18E23 -17.66 6.37 -8.75 -0.62 0
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129383 51072451 1 ClOSN2C13H17 ABCD2E13F17 -25.85 2.9 -8.75 -0.78 0
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129384 51072453 1 N2O3C14H20 A2B3C14D20 -122.46 4.5 -9.61 0.13 0
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129385 51072454 1 OSN3C19H19 ABC3D19E19 24.09 2.75 -9.05 -0.49 0
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129386 51072459 1 ClNOSC9H10 ABCDE9F10 -32.18 0.9 -8.98 -0.38 0
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129387 51072462 1 NO2C15H17 AB2C15D17 -38.29 3.47 -9.34 0.05 0
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129388 51072463 1 NO2C17H19 AB2C17D19 -19.9 3.47 -9.3 0.01 0
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129389 51072464 2 ON2C9H9 AB2C9D9 23.97 6.38 -9.49 -0.83 0
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129390 51072465 1 SO2N3C18H19 AB2C3D18E19 8.77 3.44 -9.16 -0.92 0
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129391 51072470 1 ClNOSC9H10 ABCDE9F10 -33.69 3.89 -9.1 -0.4 0
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129392 51072472 1 ClNOSC9H10 ABCDE9F10 -33.41 3.44 -8.91 -0.42 0
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129393 51072474 1 N3O4C17H23 A3B4C17D23 -79.66 6.12 -9.22 -1.31 0
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129394 51072475 1 ON2C15H22 AB2C15D22 -19.59 6.47 -8.2 -0.17 0
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129395 51072481 1 FNOC12H16 ABCD12E16 -94.33 2.17 -9.77 -0.22 0
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129396 51072482 1 O2S2N3C13H17 A2B2C3D13E17 -72.11 4.23 -8.87 -0.43 0
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129397 51072483 1 NF3O3C14H16 AB3C3D14E16 -249.4 8.81 -8.96 -0.55 0
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129398 51072484 1 NF3O3C15H18 AB3C3D15E18 -262.31 8.81 -8.9 -0.48 0
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129399 51072487 1 N2O4C17H20 A2B4C17D20 -119.42 1.42 -9.74 -0.17 0
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129400 51072491 1 NS2O3C15H17 AB2C3D15E17 -92.03 3.59 -9.18 -0.67 0
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129401 51072492 1 NOSC12H19 ABCD12E19 -54.57 3.98 -9.17 -0.29 0
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129402 51072493 1 SN2O3C18H24 AB2C3D18E24 -98.3 5.18 -9.15 -0.09 0
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129403 51072494 1 OS2N4H12C16 AB2C4D12E16 90.47 4.51 -9.34 -1.4 0
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129404 51072498 1 SN2O2C11H12 AB2C2D11E12 -3.91 1.64 -9.15 -0.46 0
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129405 51072499 1 OS2N3C16H17 AB2C3D16E17 20.44 5.42 -9.04 -0.62 0
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129406 51072501 1 O3N4C15H16 A3B4C15D16 -58.23 4.28 -9.09 -0.63 0