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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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447411 135282674 1 ClFNO6C28H33 ABCD6E28F33 -298.49 5.54 -9.28 -1.1 0
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447412 135282678 1 O3N7H29C30 A3B7C29D30 4.38 2.24 -8.38 -0.96 0
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447413 135282685 1 BrClN2O3C13H18 ABC2D3E13F18 -94.33 4.94 -9.87 -1.27 0
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447414 135282692 1 FCl2N3O4H24C28 AB2C3D4E24F28 -129.13 2.15 -9.78 -1.67 0
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447415 135282732 1 Cl2O4N5H25C28 A2B4C5D25E28 -59.81 3.86 -8.77 -1.06 0
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447416 135282735 1 BrFCl2N3O3H19C24 ABC2D3E3F19G24 -106.26 3.16 -9.77 -1.47 0
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447417 135282736 1 BrFCl2N3O3H19C24 ABC2D3E3F19G24 -106.28 3.03 -9.78 -1.47 0
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447418 135282737 1 O3N7C28H29 A3B7C28D29 13.98 1.95 -8.52 -1.08 0
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447419 135282743 1 ClO2N3H4C5 AB2C3D4E5 -51.54 5.32 -10.42 -1.39 0
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447420 135282759 1 FCl2N3O4C29H30 AB2C3D4E29F30 -163.02 5.54 -9.66 -1.05 0
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447421 135282762 1 ClF2N4O5H31C32 AB2C4D5E31F32 -201.76 4.89 -9.82 -1.54 0
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447422 135282764 1 FCl2N4O4C32H35 AB2C4D4E32F35 -153.75 0.75 -8.91 -1.2 0
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447423 135282770 1 Cl2F2O3N5C33H33 A2B2C3D5E33F33 -105.83 3.38 -9.28 -1.22 0
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447424 135282772 1 FCl2N3O3C28H28 AB2C3D3E28F28 -111.87 5.47 -9.02 -1.12 0
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447425 135282779 1 FCl2N4O4C31H33 AB2C4D4E31F33 -147.7 2.8 -9.43 -1.04 0
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447426 135282782 1 ClFO4N5H29C32 ABC4D5E29F32 -56.34 7.07 -9.71 -1.36 0
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447427 135282824 1 SO2N6C29H30 AB2C6D29E30 43.23 5.74 -8.34 -0.72 0
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447428 135282825 1 N3O6C26H37 A3B6C26D37 -248.1 9.12 -9.18 -0.7 0
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447429 135282827 1 N3O6C26H37 A3B6C26D37 -257.97 4.74 -9.26 -0.7 0
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447430 135282832 1 FCl2N5O5H22C29 AB2C5D5E22F29 -106.67 4.73 -9.62 -1.57 0
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447431 135282837 1 O3N5C25H35 A3B5C25D35 -51.42 3.72 -8.39 -0.59 0
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447432 135282838 1 IN2O3C18H29 AB2C3D18E29 -122.89 7.75 -8.85 -0.87 0
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447433 135282844 1 OF3N3C19H24 AB3C3D19E24 -161.75 2.3 -8.9 -0.95 0
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447434 135282847 1 Cl2N2O4H24C27 A2B2C4D24E27 -91.2 5.5 -9.63 -1.38 0
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447435 135282855 1 FCl2N4O4H25C28 AB2C4D4E25F28 -114.92 5.06 -9.55 -1.14 0