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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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163447 57965705 1 BrO3N4C28H29 AB3C4D28E29 -36.7 3.85 -8.57 -0.98 0
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163448 57965708 1 SO3C14H18 AB3C14D18 -99.84 6.99 -9.03 -0.88 0
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163449 57967765 1 N5H33C54 A5B33C54 303.97 3.12 -8.24 -1.15 0
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163450 57968385 1 CoO3H8C11 AB3C8D11 -49.89 17.6 0.0 0.0 0
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163451 57968478 1 SF2O5C6H10 AB2C5D6E10 -319.28 1.28 -11.45 -0.8 0
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163452 57969134 1 ClN2O2H7C8 AB2C2D7E8 -0.78 3.37 -9.73 -1.15 0
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163454 57969350 1 FSiO3N4C32H39 ABC3D4E32F39 -117.69 6.79 -8.62 -0.88 0
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163455 57969371 1 FSiO2N6C30H37 ABC2D6E30F37 -58.21 5.87 -8.62 -0.96 0
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163456 57973453 1 NO2C9H17 AB2C9D17 -105.07 2.97 -8.99 0.96 0
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163457 57982368 1 Cl2O3N4C28H28 A2B3C4D28E28 -63.87 2.61 -8.74 -0.73 0
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163458 57983045 1 BrO3N6C23H29 AB3C6D23E29 -11.73 4.83 -8.78 -1.39 0
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163459 57983878 2 NH18C26 AB18C26 222.64 0.29 -7.98 -0.57 0
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163460 57986174 1 N2F3O3C19H25 A2B3C3D19E25 -303.88 2.93 -9.29 -0.73 0
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163461 57990643 1 FSN2O3H31C32 ABC2D3E31F32 -80.12 2.93 -7.91 -1.15 0
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163462 57992916 1 NSO3C8H19 ABC3D8E19 -145.53 5.18 -9.23 0.76 0
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163463 57994733 1 F3N5O5C27H32 A3B5C5D27E32 -261.14 2.28 -8.2 -0.56 0
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163464 57995733 1 P2O3C52H64 A2B3C52D64 -148.32 1.39 -8.48 -0.04 0
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163465 57995740 1 P2O3C29H36 A2B3C29D36 -146.65 0.95 -8.46 -0.35 0
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163467 57995742 1 P2O3C46H62 A2B3C46D62 -179.13 4.19 -8.59 -0.08 2
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163468 57995748 2 NC7H9 AB7C9 91.16 1.47 -6.48 0.9 0
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163469 57995751 1 O6C11H18 A6B11C18 -287.03 1.43 -10.57 0.08 0
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163470 57996575 1 OF7C36H37 AB7C36D37 -357.13 8.78 -9.43 -0.7 0
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163471 57996989 1 OF6C36H46 AB6C36D46 -379.68 5.32 -9.26 -0.55 0
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163472 57998787 1 NO2C20H25 AB2C20D25 -47.07 4.56 -8.84 -0.09 0
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163474 57999817 1 FSO3N4C18H25 ABC3D4E18F25 -118.73 1.43 -8.59 -1.06 0