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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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42654 8149820 1 ClOSN3H18C21 ABCD3E18F21 30.59 1.15 -8.54 -1.16 0
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42655 8149822 1 SN3O3C20H23 AB3C3D20E23 -101.06 3.23 -8.7 -1.44 0
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42656 8149825 1 OSN3C18H25 ABC3D18E25 -47.46 2.66 -8.58 -0.83 1
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42657 8149826 1 OSN3C18H26 ABC3D18E26 -27.12 4.77 0.0 0.0 0
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42658 8149827 1 OSN3C18H25 ABC3D18E25 -46.3 2.66 -8.59 -0.85 1
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42659 8149828 1 OSN3C18H26 ABC3D18E26 -32.07 13.15 0.0 0.0 1
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42660 8149830 1 OSN3C18H26 ABC3D18E26 -31.25 7.42 0.0 0.0 0
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42661 8149831 1 OSN3C18H25 ABC3D18E25 -48.3 2.95 -8.51 -0.74 1
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42662 8149832 1 OS2N3C17H20 AB2C3D17E20 25.15 15.35 0.0 0.0 0
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42663 8149833 1 OS2N3C17H19 AB2C3D17E19 7.09 4.45 -8.61 -0.96 1
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42664 8149834 1 OS2N3C17H20 AB2C3D17E20 20.91 14.28 0.0 0.0 0
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42665 8149835 1 OS2N3C17H19 AB2C3D17E19 9.29 4.15 -8.64 -1.04 1
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42666 8149836 1 SN3O4C20H30 AB3C4D20E30 -156.84 19.61 0.0 0.0 0
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42667 8149837 1 SN3O4C20H29 AB3C4D20E29 -165.74 6.58 -9.06 -1.35 0
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42668 8149839 1 ClOSN3C21H24 ABCD3E21F24 -7.01 4.66 -8.78 -0.97 1
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42669 8149842 1 SN3O3C20H30 AB3C3D20E30 -126.42 17.97 0.0 0.0 1
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42670 8149844 1 OS2N3C20H26 AB2C3D20E26 9.2 15.44 0.0 0.0 0
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42671 8149847 1 OS2N3C20H25 AB2C3D20E25 -1.45 4.38 -8.64 -1.03 1
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42672 8149852 1 OSN3C18H28 ABC3D18E28 -40.76 7.0 0.0 0.0 0
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42673 8149853 1 OSN3C18H27 ABC3D18E27 -53.1 0.55 -8.66 -0.92 1
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42674 8149854 1 OSN3C18H28 ABC3D18E28 -39.36 7.42 0.0 0.0 0
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42675 8149855 1 OSN3C18H27 ABC3D18E27 -56.83 3.03 -8.51 -0.74 1
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42676 8149856 1 OS2N3C17H22 AB2C3D17E22 13.21 14.77 0.0 0.0 0
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42677 8149857 1 OS2N3C17H21 AB2C3D17E21 1.91 1.97 -8.74 -1.13 1
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42678 8149858 1 OS2N3C17H22 AB2C3D17E22 13.54 15.41 0.0 0.0 0
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42679 8149859 1 OS2N3C17H21 AB2C3D17E21 -1.36 4.42 -8.61 -0.95 2
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42680 8149860 1 FN4C21H35 AB4C21D35 87.86 14.27 -3.03 -0.65 0
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42681 8149861 1 FN4C21H33 AB4C21D33 -24.7 5.32 -8.65 -0.36 0
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42682 8149862 1 FOSN3H16C17 ABCD3E16F17 -35.44 2.4 -8.72 -1.12 0
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42683 8149863 1 FSN3O4C19H20 ABC3D4E19F20 -171.15 2.75 -9.0 -1.61 0
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42684 8149864 1 FOSN3C20H22 ABCD3E20F22 -64.58 2.41 -8.69 -0.97 0
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42685 8149865 1 FOSN3C20H22 ABCD3E20F22 -64.67 2.59 -8.68 -0.96 0
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42686 8149866 1 FOSN3C20H22 ABCD3E20F22 -63.28 3.15 -8.61 -0.88 0
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42687 8149867 1 FOSN3C20H22 ABCD3E20F22 -63.49 2.82 -8.6 -0.87 2
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42688 8149868 1 FN4C21H35 AB4C21D35 89.52 12.6 -3.0 -0.66 0
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42689 8149869 1 FN4C21H33 AB4C21D33 -24.27 2.56 -8.56 -0.44 0
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42690 8149870 1 ClFOSN3H15C20 ABCDE3F15G20 -13.65 2.27 -8.95 -1.2 0
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42691 8149871 1 FSN3O3C19H20 ABC3D3E19F20 -142.98 2.3 -8.84 -1.5 0
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42692 8149872 1 FSN3O3C19H20 ABC3D3E19F20 -143.45 3.92 -9.02 -1.44 0
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42693 8149874 1 FOS2N3H16C19 ABC2D3E16F19 -8.53 2.95 -8.72 -1.12 1
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42694 8149875 1 ClSN3C14H15 ABC3D14E15 93.05 7.83 0.0 0.0 1
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42695 8149877 1 OSN4C23H27 ABC4D23E27 17.04 13.47 0.0 0.0 1
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42696 8149879 1 OSN4C23H27 ABC4D23E27 15.18 10.1 0.0 0.0 0
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42697 8149880 1 OSN4C23H26 ABC4D23E26 5.6 4.11 -8.53 -0.86 0
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42698 8149882 1 OSN4C23H26 ABC4D23E26 2.3 1.77 -8.49 -0.75 1
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42699 8149883 1 OSN4C23H27 ABC4D23E27 22.1 4.76 0.0 0.0 0
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42700 8149884 1 OSN4C23H26 ABC4D23E26 3.57 2.44 -8.49 -0.71 1
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42701 8149885 1 ClON3C17H19 ABC3D17E19 -1.39 5.11 0.0 0.0 1
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42702 8149886 1 ClOS2N3H19C20 ABC2D3E19F20 47.44 14.09 0.0 0.0 0
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42703 8149887 1 ClOS2N3H18C20 ABC2D3E18F20 32.15 4.86 -8.66 -1.05 1