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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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79077 49746718 1 SO5N6H12C15 AB5C6D12E15 46.44 3.03 -10.37 -2.07 0
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79078 49746719 1 SO4N6H16C17 AB4C6D16E17 -6.14 8.6 -9.66 -1.2 0
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79079 49746721 1 SN5O5C17H17 AB5C5D17E17 -30.02 5.13 -9.08 -1.33 0
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79080 49746722 1 SN5O5H15C17 AB5C5D15E17 -26.18 5.29 -9.35 -1.32 0
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79081 49746723 1 S2O3N5H11C13 A2B3C5D11E13 55.8 3.72 -9.6 -1.42 0
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79082 49746724 1 SO3N6H12C14 AB3C6D12E14 57.72 2.85 -10.29 -1.45 0
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79083 49746731 1 SO3N5H15C16 AB3C5D15E16 41.13 2.94 -9.71 -1.29 0
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79084 49746739 1 SO4N5C17H17 AB4C5D17E17 -2.79 7.46 -9.31 -1.18 0
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79085 49746748 1 SF3O4N5H12C16 AB3C4D5E12F16 -157.13 1.94 -10.31 -1.4 0
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79086 49746750 1 SO4N5H15C17 AB4C5D15E17 6.39 1.16 -10.34 -1.2 0
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79087 49746752 1 ClSO3N5H14C16 ABC3D5E14F16 28.3 4.05 -9.84 -1.26 0
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79088 49746755 1 SO3N5C12H13 AB3C5D12E13 35.39 3.66 -10.18 -1.29 0
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79089 49746762 1 SCl2O3N5H13C16 AB2C3D5E13F16 23.74 3.05 -9.99 -1.36 0
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79090 49746766 1 SO3N5C19H19 AB3C5D19E19 26.58 6.18 -9.78 -1.32 0
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79091 49746770 1 BrS2O3N5H10C13 AB2C3D5E10F13 64.66 3.16 -9.81 -1.43 0
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79092 49746771 1 S2N5O5H13C15 A2B5C5D13E15 -24.47 1.8 -10.02 -1.56 0
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79093 49746773 1 SO3N5C15H19 AB3C5D15E19 -3.12 2.99 -10.16 -1.28 0
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79094 49746774 1 SN5O5H15C17 AB5C5D15E17 -31.22 3.47 -10.28 -1.52 0
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79095 49746775 1 SO3N5H17C18 AB3C5D17E18 50.39 6.59 -9.62 -1.12 0
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79096 49746776 1 O2N9H13C17 A2B9C13D17 172.31 5.86 -10.3 -1.48 0
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79097 49746778 2 ON3H8C10 AB3C8D10 116.52 3.24 -9.14 -1.23 0
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79098 49746779 1 O2N6H16C19 A2B6C16D19 106.13 4.29 -8.45 -1.58 0
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79099 49746785 1 O4N5C21H21 A4B5C21D21 -6.75 4.57 -8.75 -1.41 0
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79100 49746798 2 OSN3H7C9 ABC3D7E9 113.38 3.79 -8.84 -1.54 0
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79101 49746800 1 SO2N5C19H19 AB2C5D19E19 73.54 3.29 -9.21 -1.48 0