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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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304982 124766386 1 ClN2O4C18H21 AB2C4D18E21 -145.44 3.19 -9.72 -0.56 0
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304983 124766388 2 NO3H13C14 AB3C13D14 -165.19 3.08 -8.89 -0.19 0
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304984 124766389 1 FN2O4C17H19 AB2C4D17E19 -202.95 4.11 -9.7 -0.55 0
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304987 124766400 1 N3O4C21H21 A3B4C21D21 -68.34 4.58 -8.64 -0.29 0
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304988 124766401 1 N3O4C21H21 A3B4C21D21 -73.96 1.3 -8.51 -0.41 0
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304989 124766402 1 S2N3O6C25H33 A2B3C6D25E33 -215.28 6.26 -8.76 -1.48 0
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304990 124766403 1 S2N3O6C25H33 A2B3C6D25E33 -214.78 6.44 -8.76 -1.51 0
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304991 124766404 1 N3O4C25H29 A3B4C25D29 -99.27 4.35 -9.61 -0.27 0
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304992 124766405 1 N3O4C25H29 A3B4C25D29 -99.78 7.61 -9.5 0.09 0
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304993 124766406 1 N3O4C25H29 A3B4C25D29 -101.36 1.29 -9.7 -0.03 0
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304994 124766407 1 N3O4C25H29 A3B4C25D29 -100.85 5.05 -9.62 0.05 0
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304995 124766408 1 N3O4C25H29 A3B4C25D29 -96.58 3.59 -9.54 0.0 0
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304996 124766409 1 N3O4C25H29 A3B4C25D29 -98.33 2.5 -9.58 -0.06 0
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304999 124766412 1 FO5N6C28H33 AB5C6D28E33 -139.15 1.74 -8.73 -0.41 0
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305000 124766413 1 FO5N6C28H33 AB5C6D28E33 -137.79 6.82 -8.94 -0.72 0
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305001 124766414 2 NO3H13C14 AB3C13D14 -170.45 2.73 -8.97 -0.38 0
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305002 124766415 2 NO3H13C14 AB3C13D14 -151.55 4.11 -8.92 -0.11 0
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305003 124766416 4 NO3C7H7 AB3C7D7 -352.42 10.96 -9.16 -1.76 0
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305004 124766417 4 NO3C7H7 AB3C7D7 -358.87 10.79 -9.19 -1.76 0
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305005 124766418 4 NO3C7H7 AB3C7D7 -355.72 8.16 -9.19 -1.78 0
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305006 124766419 4 NO3C7H7 AB3C7D7 -355.8 7.98 -9.24 -1.82 1
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305007 124766420 1 NO3C18H36 AB3C18D36 -147.07 3.47 0.0 0.0 1
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305008 124766421 1 NO3C18H36 AB3C18D36 -148.08 3.55 0.0 0.0 0
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305012 124766426 1 ON2C18H22 AB2C18D22 -2.25 2.48 -7.92 0.28 0
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305013 124766427 1 N2O9C17H20 A2B9C17D20 -301.79 11.0 -9.24 -0.93 0