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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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85650 49877876 1 ClNSO3H12C16 ABCD3E12F16 -51.32 2.35 -8.95 -0.76 0
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85651 49877879 1 ISN2O3H17C22 ABC2D3E17F22 51.08 3.9 -8.67 -1.51 0
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85652 49877880 1 BrClFON2H15C23 ABCDE2F15G23 21.09 3.44 -9.25 -1.58 0
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85653 49877881 1 BrFION2H15C23 ABCDE2F15G23 45.98 3.02 -9.2 -1.59 0
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85654 49877882 1 BrFON2H18C24 ABCD2E18F24 19.25 2.33 -8.99 -1.43 0
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85655 49877883 1 BrON2H17C23 ABC2D17E23 72.66 4.16 -8.87 -1.16 0
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85656 49877884 1 ClFON2H24C27 ABCD2E24F27 -8.94 3.08 -9.02 -1.42 0
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85657 49877885 1 OF2N2H22C26 AB2C2D22E26 -37.51 3.63 -9.0 -1.48 0
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85658 49877886 1 ClON2H27C28 ABC2D27E28 27.6 3.7 -8.74 -1.23 0
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85659 49877887 1 ON2C29H30 AB2C29D30 29.24 3.58 -8.59 -1.08 0
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85660 49877889 1 FON2H27C28 ABC2D27E28 -8.56 4.85 -8.83 -1.27 0
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85661 49877894 1 SN3O7H23C28 AB3C7D23E28 -86.57 7.66 -8.86 -1.86 0
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85662 49877899 1 ON2H20C24 AB2C20D24 62.26 2.16 -8.86 -1.16 0
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85663 49877900 1 O3N5H15C17 A3B5C15D17 39.31 10.17 -9.27 -1.28 0
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85664 49877905 1 BrN3O4H24C29 AB3C4D24E29 -35.4 5.05 -8.8 -1.19 0
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85665 49877906 1 ION3H16C24 ABC3D16E24 116.52 1.07 -8.78 -1.24 0
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85666 49877907 1 BrN3O4H14C22 AB3C4D14E22 35.48 11.48 -9.19 -1.58 0
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85667 49877912 1 ON4H22C26 AB4C22D26 114.35 3.4 -8.91 -0.9 0
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85668 49877915 1 O5N7C17H19 A5B7C17D19 -81.03 10.47 -8.79 -0.97 0
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85669 49877926 1 BrSN3O6C30H34 ABC3D6E30F34 -176.15 8.21 -8.55 -1.16 0
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85670 49877931 1 BrO2N4C14H15 AB2C4D14E15 8.09 6.04 -8.81 -1.31 1
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85671 49877946 1 O2N4C20H27 A2B4C20D27 53.41 23.91 0.0 0.0 1
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85672 49877947 1 O2N4C14H23 A2B4C14D23 28.61 6.48 0.0 0.0 0
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85673 49877950 1 BrSN2O6C27H27 ABC2D6E27F27 -158.01 4.48 -8.75 -1.23 0
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85674 49877951 1 BrSN2O6C27H27 ABC2D6E27F27 -156.63 6.08 -8.73 -1.17 0