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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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40978 8145053 1 SO2N3C19H28 AB2C3D19E28 -56.04 5.11 0.0 0.0 0
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40979 8145055 1 ClSN2O2C19H19 ABC2D2E19F19 -2.5 4.38 -8.83 -0.43 1
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40980 8145058 1 SO2N4C20H27 AB2C4D20E27 8.04 5.95 0.0 0.0 1
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40981 8145060 1 FSO2N4C18H24 ABC2D4E18F24 -59.12 4.57 0.0 0.0 0
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40982 8145063 1 OSN2H18C19 ABC2D18E19 9.82 6.45 -8.86 -0.66 0
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40983 8145066 1 FSO2N4C18H23 ABC2D4E18F23 -75.06 5.9 -8.22 -0.79 0
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40984 8145069 1 OSN2H18C19 ABC2D18E19 10.87 8.41 -9.16 -0.7 0
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40985 8145070 1 NO6C22H25 AB6C22D25 -196.49 3.92 -9.51 -0.13 0
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40986 8145071 1 ClFN2O2H18C22 ABC2D2E18F22 -66.61 5.69 -9.03 -0.48 0
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40987 8145072 1 NO6C22H25 AB6C22D25 -196.18 2.48 -9.67 -0.38 1
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40988 8145073 1 SO2N4C19H27 AB2C4D19E27 -20.36 5.36 0.0 0.0 0
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40989 8145076 1 OS2N3H17C19 AB2C3D17E19 65.64 7.0 -9.15 -0.58 1
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40990 8145077 1 SO2N4C21H29 AB2C4D21E29 2.52 5.22 0.0 0.0 0
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40991 8145078 1 SO2N4C21H28 AB2C4D21E28 -16.09 3.47 -8.21 -0.14 0
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40992 8145079 1 NO6C22H25 AB6C22D25 -196.5 3.86 -9.49 -0.14 0
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40993 8145086 1 SN3O5C19H25 AB3C5D19E25 -138.4 2.98 -8.53 -0.5 1
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40994 8145090 1 S2N3O3C15H20 A2B3C3D15E20 -45.17 7.49 0.0 0.0 0
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40995 8145091 1 S2N3O3C15H19 A2B3C3D15E19 -58.3 5.61 -8.68 -1.21 1
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40996 8145092 1 O2S2N3H18C21 A2B2C3D18E21 78.92 6.51 0.0 0.0 1
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40997 8145094 1 ClSO3N4C18H24 ABC3D4E18F24 -67.55 6.92 0.0 0.0 0
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40998 8145095 1 ClSO3N4C18H23 ABC3D4E18F23 -63.5 10.81 -8.23 -1.32 1
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40999 8145096 1 SO2N4C19H27 AB2C4D19E27 -24.45 4.55 0.0 0.0 0
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41000 8145097 1 SO2N4C19H26 AB2C4D19E26 -26.46 7.09 -8.25 -1.08 1
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41001 8145100 1 N3O4C22H32 A3B4C22D32 -153.92 3.6 0.0 0.0 0
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41002 8145105 1 SO2N3C22H29 AB2C3D22E29 -63.43 3.55 -7.84 -0.17 1