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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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133236 51496633 1 NO5C19H23 AB5C19D23 -150.61 3.67 -8.4 -0.14 1
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133237 51496710 1 NO4C25H28 AB4C25D28 -74.35 3.89 0.0 0.0 0
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133238 51496711 1 NO4C25H27 AB4C25D27 -88.57 2.55 -8.59 0.02 0
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133239 51496881 1 ON4H22C23 AB4C22D23 77.85 8.41 -8.84 -1.16 1
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133240 51496882 1 OF3N4H20C22 AB3C4D20E22 -88.07 6.91 0.0 0.0 1
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133241 51496883 1 OSN4C20H21 ABC4D20E21 72.91 5.02 0.0 0.0 0
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133242 51496884 1 OSN4C20H20 ABC4D20E20 83.77 8.35 -8.89 -1.26 0
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133243 51497000 1 ON3C19H27 AB3C19D27 -0.15 2.76 -8.47 0.35 1
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133244 51497001 1 ON3C19H28 AB3C19D28 13.91 3.99 0.0 0.0 0
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133245 51497228 1 N3O3C21H29 A3B3C21D29 -47.61 2.63 -8.23 -0.17 0
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133246 51497477 1 SO4N5C16H21 AB4C5D16E21 -105.18 4.89 -9.37 -0.98 0
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133247 51497478 1 N2S2O6C15H20 A2B2C6D15E20 -227.46 4.13 -8.62 -1.12 0
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133248 51497855 1 ClN2O2C16H17 AB2C2D16E17 -56.59 3.67 -9.28 -1.2 0
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133249 51497856 1 NO4C18H25 AB4C18D25 -175.74 4.53 -8.93 -0.27 0
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133250 51497857 1 NO4C18H25 AB4C18D25 -176.74 1.13 -8.88 -0.21 0
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133251 51497892 2 NOC11H12 ABC11D12 -55.28 4.16 -9.03 -0.5 0
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133252 51498421 1 N2S2O3C14H20 A2B2C3D14E20 -94.36 2.62 -9.24 -0.32 0
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133253 51498973 1 FN2O3C21H23 AB2C3D21E23 -143.33 2.39 -8.1 -0.45 0
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133254 51498974 1 FN2O3C21H23 AB2C3D21E23 -139.68 2.12 -8.26 -0.16 0
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133255 51498975 1 FN2O3C21H23 AB2C3D21E23 -143.25 5.3 -8.27 -0.41 0
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133256 51498989 1 N3O3C22H25 A3B3C22D25 -123.3 10.84 -7.99 -1.06 0
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133257 51498990 1 N3O3C22H25 A3B3C22D25 -122.84 7.89 -7.85 -0.94 0
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133258 51498991 1 O2N3C22H23 A2B3C22D23 -50.96 6.85 -8.03 -0.36 0
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133259 51498992 1 O2N3C22H23 A2B3C22D23 -51.52 7.7 -8.15 -0.46 0
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133260 51499842 1 SO3N4C18H26 AB3C4D18E26 -112.96 4.29 -8.99 -0.67 1