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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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78902 49742676 1 SO3N4C17H18 AB3C4D17E18 -53.85 4.21 -9.11 -1.7 0
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78903 49742677 1 SO3N4H14C18 AB3C4D14E18 -10.79 3.16 -8.94 -2.03 0
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78904 49742678 1 N2O4C23H24 A2B4C23D24 -121.76 4.37 -8.9 -0.85 0
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78905 49742679 1 SN2O3H16C17 AB2C3D16E17 -73.52 8.16 -8.8 -1.13 0
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78906 49742688 1 N2O3C18H20 A2B3C18D20 -96.53 5.99 -8.86 -0.8 0
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78907 49742689 1 N2F3O4H15C19 A2B3C4D15E19 -272.21 4.31 -8.97 -1.18 0
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78908 49742690 1 N3O3H15C16 A3B3C15D16 -40.67 4.8 -9.02 -1.45 0
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78909 49742691 2 ON3H9C10 AB3C9D10 41.78 4.0 -9.09 -1.65 0
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78910 49742693 1 SO2N4H20C21 AB2C4D20E21 -11.31 8.13 -8.85 -1.72 0
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78911 49742694 1 O2N3H21C23 A2B3C21D23 -15.06 4.08 -8.87 -1.19 0
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78912 49742695 1 O2N3H21C22 A2B3C21D22 -27.08 3.97 -8.92 -0.88 0
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78913 49742697 1 SN2O2C19H24 AB2C2D19E24 -91.77 4.52 -8.85 -0.81 0
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78914 49742698 1 N3O3C17H19 A3B3C17D19 -119.25 5.55 -8.98 -0.95 0
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78915 49742699 1 N2O3C22H22 A2B3C22D22 -90.74 6.39 -8.87 -0.81 0
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78916 49742700 3 NOC7H7 ABC7D7 -87.12 5.64 -8.95 -0.89 0
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78917 49742701 2 NO2C12H13 AB2C12D13 -138.85 7.52 -8.77 -0.71 0
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78918 49742702 1 N2O3H18C19 A2B3C18D19 -64.22 6.36 -8.8 -1.29 0
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78919 49742703 1 O2N4H20C21 A2B4C20D21 -16.29 5.17 -9.0 -0.96 0
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78920 49742705 1 N3O4H17C20 A3B4C17D20 -47.35 6.47 -8.93 -1.41 0
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78921 49742708 1 N3O3C19H19 A3B3C19D19 -95.5 10.27 -8.6 -1.39 0
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78922 49742709 2 NO2H10C11 AB2C10D11 -93.43 6.04 -8.84 -1.25 0
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78923 49742710 1 N3O3C19H19 A3B3C19D19 -70.61 2.58 -8.98 -0.95 0
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78924 49742713 1 SO2N6C16H18 AB2C6D16E18 5.43 8.51 -8.82 -1.25 0
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78925 49742716 1 O2N3C23H23 A2B3C23D23 -39.35 6.35 -8.7 -0.62 0
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78926 49742720 3 NOC7H7 ABC7D7 -99.1 10.23 -8.77 -0.79 0