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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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137037 52142629 1 SO2N4C14H20 AB2C4D14E20 -37.51 8.06 -9.54 -1.22 0
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137038 52142907 1 SO3N5C18H25 AB3C5D18E25 -75.67 1.21 -8.95 -0.91 0
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137039 52142908 1 SO3N5C20H27 AB3C5D20E27 -67.78 5.82 -9.0 -0.91 0
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137040 52142941 1 SN3O3C12H19 AB3C3D12E19 -75.49 2.98 -8.83 -0.62 0
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137041 52142942 1 SN3O3C12H19 AB3C3D12E19 -74.45 5.45 -8.83 -0.65 1
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137042 52142943 1 SO2N3C10H18 AB2C3D10E18 -53.43 4.1 0.0 0.0 0
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137043 52143116 1 SO3N4C14H14 AB3C4D14E14 -12.34 10.06 -9.54 -1.6 0
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137044 52143117 1 SO3N4C15H16 AB3C4D15E16 -12.85 7.56 -9.47 -1.43 0
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137045 52143277 1 SO2N5H17C18 AB2C5D17E18 68.08 6.5 -8.98 -0.96 0
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137046 52143348 1 SO3N7C16H19 AB3C7D16E19 -2.85 8.28 -8.87 -0.95 0
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137047 52143479 1 SO2N6C16H20 AB2C6D16E20 19.18 7.84 -9.51 -1.4 0
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137048 52143790 1 SO3N5C13H17 AB3C5D13E17 -40.33 2.23 -9.35 -1.01 0
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137049 52144639 1 SO2N6C17H26 AB2C6D17E26 -20.67 4.98 -8.96 -0.69 1
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137050 52144685 1 SN6C17H27 AB6C17D27 76.66 4.33 0.0 0.0 0
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137051 52144992 1 OSN6C16H26 ABC6D16E26 6.9 2.25 -9.28 -0.79 0
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137052 52144993 1 OSN6C15H24 ABC6D15E24 15.44 3.13 -9.48 -0.87 0
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137053 52145013 1 SO2N7C16H21 AB2C7D16E21 52.44 9.55 -8.47 -1.0 0
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137054 52145152 1 SO3N7C21H27 AB3C7D21E27 -23.31 9.9 -8.98 -0.76 0
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137055 52145334 1 SO2N5C12H17 AB2C5D12E17 -3.75 6.03 -8.95 -0.74 0
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137056 52145352 1 SO2N5C12H17 AB2C5D12E17 -12.9 5.23 -8.99 -0.77 0
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137057 52145598 1 OSN6C16H24 ABC6D16E24 24.37 5.66 -8.69 -0.15 0
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137058 52145684 1 SO2N5C12H15 AB2C5D12E15 14.19 5.85 -8.96 -0.74 0
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137059 52145815 1 NOSC18H23 ABCD18E23 -17.55 1.61 -8.71 -0.54 1
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137060 52146546 1 OSN2C9H15 ABC2D9E15 2.64 3.9 0.0 0.0 0
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137061 52147371 1 SO2F3N6C14H17 AB2C3D6E14F17 -159.79 9.55 -9.26 -0.93 0