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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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137988 52296351 1 N2O3C21H24 A2B3C21D24 -57.65 6.57 -8.98 -0.45 0
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137989 52296352 1 N2O3C21H24 A2B3C21D24 -63.27 4.28 -9.27 -0.49 1
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137990 52296353 1 SO4N6C19H27 AB4C6D19E27 -87.88 9.21 0.0 0.0 0
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137991 52296354 1 SN3O6C17H21 AB3C6D17E21 -221.25 7.81 -9.01 -0.71 0
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137992 52296355 1 SN3O6C17H21 AB3C6D17E21 -222.22 11.2 -9.12 -0.64 0
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137993 52296356 1 O3N4H18C20 A3B4C18D20 62.96 4.73 -8.98 -1.12 0
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137994 52297009 1 S2N3O3C16H17 A2B3C3D16E17 6.79 6.09 -8.87 -2.03 0
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137995 52297042 1 ION2C19H29 ABC2D19E29 -41.88 3.79 -8.48 -0.88 0
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137996 52297227 1 SO3N4C22H24 AB3C4D22E24 -46.33 6.37 -8.84 -0.81 -1
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137997 52297228 1 O4N5H22C23 A4B5C22D23 -32.39 3.78 0.0 0.0 0
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137998 52297296 1 NSO6C16H21 ABC6D16E21 -236.65 4.71 -9.56 -1.4 0
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137999 52297554 1 FO3N4C23H35 AB3C4D23E35 -186.98 4.0 -8.24 -0.05 0
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138000 52297728 2 NO2C11H14 AB2C11D14 -136.72 4.84 -9.05 -0.3 0
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138001 52297904 1 ClOSN2H17C18 ABCD2E17F18 12.94 4.62 -9.27 -1.12 1
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138002 52298157 1 BrSN2O4C18H24 ABC2D4E18F24 -102.58 6.66 0.0 0.0 0
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138003 52298555 1 NO4C19H25 AB4C19D25 -184.33 3.79 -8.65 -0.18 0
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138004 52298709 1 O3N5C20H21 A3B5C20D21 54.6 8.86 -9.11 -1.2 1
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138005 52299173 1 N2O2C20H31 A2B2C20D31 -55.02 2.87 0.0 0.0 0
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138006 52299174 2 NOC10H15 ABC10D15 -62.55 2.59 -9.03 0.4 1
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138007 52299175 1 N2O2C20H31 A2B2C20D31 -54.24 2.04 0.0 0.0 0
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138008 52299176 2 NOC10H15 ABC10D15 -60.48 2.57 -8.98 0.44 1
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138009 52299326 1 N2C16H21 A2B16C21 60.3 3.66 0.0 0.0 0
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138010 52299603 1 FNO2C17H18 ABC2D17E18 -88.91 4.65 -9.42 -0.08 0
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138011 52299819 1 O2N5C21H27 A2B5C21D27 -59.38 4.1 -8.77 -0.57 0
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138012 52299820 1 O2F3N3C22H24 A2B3C3D22E24 -202.57 6.06 -8.39 -0.67 0