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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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83026 49857030 1 N2O2C21H32 A2B2C21D32 -79.04 3.09 -8.67 -0.2 0
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83027 49857031 1 N2O2C25H32 A2B2C25D32 -44.51 4.71 -8.89 -0.17 0
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83028 49857032 2 NOC11H17 ABC11D17 -83.85 6.8 -8.66 -0.14 0
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83029 49857033 1 N2O2C23H36 A2B2C23D36 -91.96 2.62 -8.59 -0.22 0
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83030 49857035 1 N2O2C21H32 A2B2C21D32 -79.75 2.67 -8.85 -0.2 0
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83031 49857036 1 N2O2C21H32 A2B2C21D32 -77.88 3.53 -8.85 -0.2 0
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83032 49857037 1 ClO3N7C23H24 AB3C7D23E24 22.19 8.17 -8.38 -1.31 0
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83033 49857038 1 ClO3N6C22H23 AB3C6D22E23 -12.97 8.54 -8.28 -1.58 0
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83034 49857039 1 ClO2N7H18C19 AB2C7D18E19 58.9 6.47 -8.26 -1.53 0
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83035 49857040 1 ClO3N6C23H23 AB3C6D23E23 -5.25 4.94 -8.36 -1.44 0
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83036 49857041 1 ClO2N7C23H24 AB2C7D23E24 49.01 10.11 -8.32 -1.44 0
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83037 49857042 1 ClO3N6C22H23 AB3C6D22E23 -6.26 8.74 -8.39 -1.49 0
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83038 49857043 1 F3O3N6H19C21 A3B3C6D19E21 -151.67 4.24 -8.58 -1.55 0
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83039 49857045 1 N3O3H17C18 A3B3C17D18 -43.82 4.99 -9.23 -1.32 0
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83040 49857046 1 F3N4O4H21C25 A3B4C4D21E25 -206.01 6.58 -8.72 -1.23 0
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83041 49857048 1 N4O5C30H32 A4B5C30D32 -79.14 10.11 -9.27 -1.4 0
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83042 49857049 1 N2O3H18C23 A2B3C18D23 -16.04 6.11 -9.17 -1.13 0
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83043 49857050 1 N2O3H20C24 A2B3C20D24 -21.28 5.66 -8.96 -0.91 0
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83044 49857051 1 BrN2O3H15C22 AB2C3D15E22 -0.98 7.24 -9.52 -1.2 0
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83045 49857053 1 F2O2N5H21C22 A2B2C5D21E22 -97.98 3.71 -8.74 -0.51 0
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83046 49857055 1 OF3N5H18C20 AB3C5D18E20 -91.63 5.1 -9.12 -0.51 0
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83047 49857056 1 OF3N5C22H22 AB3C5D22E22 -111.43 3.94 -8.81 -0.44 0
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83048 49857058 3 O2H4C7 A2B4C7 -160.78 4.89 -8.86 -1.58 0
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83049 49857064 1 NSeO3H15C16 ABC3D15E16 3.15 3.28 -9.06 -0.99 0
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83050 49857067 1 N2O8C21H26 A2B8C21D26 -262.46 2.53 -9.77 -0.84 1