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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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429666 135169716 1 NF7C9H10 AB7C9D10 -356.95 1.94 -10.76 -0.9 0
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429667 135169717 1 NH9C10F10 AB9C10D10 -513.29 3.77 -11.29 -1.18 0
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429668 135169718 1 F3N4O6C26H31 A3B4C6D26E31 -375.25 2.82 -9.52 -1.4 0
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429669 135169719 1 OSF3N9H12C20 ABC3D9E12F20 48.86 10.7 -9.33 -1.89 0
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429670 135169720 1 OF3N11H12C19 AB3C11D12E19 66.83 9.19 -8.44 -2.03 0
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429671 135169721 1 ON4H28C45 AB4C28D45 210.57 1.78 -8.32 -1.29 0
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429672 135169722 1 ClN3C12H14 AB3C12D14 49.49 5.02 -8.42 -0.36 0
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429673 135169723 1 N2F10C11H12 A2B10C11D12 -507.53 6.89 -9.35 -1.22 0
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429674 135169724 2 NF4C5H6 AB4C5D6 -397.1 3.49 -9.39 -0.98 0
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429675 135169725 1 OF3N6H7C11 AB3C6D7E11 -69.53 4.97 -9.84 -2.14 0
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429676 135169727 1 ClN4C10H13 AB4C10D13 50.61 4.24 -7.55 0.12 0
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429677 135169728 1 ON2F8C13H16 AB2C8D13E16 -445.7 1.61 -9.23 -0.1 0
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429678 135169729 1 N2H8C11F14 A2B8C11D14 -714.51 3.15 -9.96 -1.15 0
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429679 135169730 1 ON2F10C14H16 AB2C10D14E16 -560.64 2.13 -9.58 -0.83 0
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429680 135169731 1 N3F4H11C15 A3B4C11D15 -106.81 1.78 -9.12 -1.36 0
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429681 135169732 1 ON2F7C13H17 AB2C7D13E17 -399.61 2.51 -9.17 0.22 0
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429682 135169733 1 N2H9C11F13 A2B9C11D13 -668.63 2.2 -9.81 -1.1 0
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429683 135169734 2 NH4C6F8 AB4C6D8 -821.89 4.13 -10.72 -1.68 0
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429684 135169735 1 ClF3O3N6H18C22 AB3C3D6E18F22 -188.18 8.36 -9.11 -1.52 0
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429685 135169736 1 ClO2F3N4H16C21 AB2C3D4E16F21 -139.91 7.23 -8.54 -1.17 0
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429686 135169737 1 ON5H31C50 AB5C31D50 248.02 2.86 -8.12 -1.2 0
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429687 135169738 1 ClO2F3N8H18C23 AB2C3D8E18F23 -88.47 6.39 -9.07 -1.44 0
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429688 135169739 1 ON5H31C50 AB5C31D50 246.53 3.72 -8.25 -1.32 0
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429689 135169740 1 ClON5C9H10 ABC5D9E10 67.54 4.51 -9.02 -1.14 0
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429690 135169741 1 OSF3N9H12C20 ABC3D9E12F20 43.37 9.11 -8.61 -1.69 0
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429691 135169742 1 ClOF3N9H17C24 ABC3D9E17F24 -3.27 7.36 -8.46 -1.66 0
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429692 135169743 1 O2N5H25C44 A2B5C25D44 204.66 3.82 -8.43 -1.48 0
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429693 135169744 1 OSF3N10H17C20 ABC3D10E17F20 2.96 6.98 -8.72 -1.33 0
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429694 135169745 1 O2F3N9H16C23 A2B3C9D16E23 -27.39 2.92 -8.72 -1.36 0
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429695 135169746 1 ClF3O4N8H20C24 AB3C4D8E20F24 -157.53 6.86 -8.2 -1.38 0
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429696 135169747 1 OF3N9H18C24 AB3C9D18E24 25.19 3.56 -8.96 -1.32 0
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429697 135169748 1 ClO2F3N8H14C21 AB2C3D8E14F21 -57.96 4.99 -8.69 -1.73 0
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429698 135169749 1 O2F3N3H16C17 A2B3C3D16E17 -179.33 3.9 -9.09 -1.0 0
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429699 135169750 1 O2N5H29C50 A2B5C29D50 225.48 3.69 -8.3 -1.39 0
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429700 135169751 1 O2N5H25C44 A2B5C25D44 206.5 2.81 -8.41 -1.3 0
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429701 135169752 1 F3N9H20C25 A3B9C20D25 73.03 4.6 -9.23 -1.45 0
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429703 135169754 1 ClN6C11H11 AB6C11D11 107.62 5.12 -8.35 -1.13 0
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429704 135169755 1 ON5H23C38 AB5C23D38 209.97 3.66 -8.41 -1.36 0
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429705 135169756 1 O2N5H29C50 A2B5C29D50 226.53 5.07 -8.2 -1.33 0
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429706 135169757 1 O2N5H25C44 A2B5C25D44 204.12 1.35 -8.47 -1.41 0
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429707 135169758 1 ClON3H14C21 ABC3D14E21 96.83 3.15 -9.12 -1.5 0
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429708 135169759 1 ClOF3N7H19C25 ABC3D7E19F25 -29.22 4.63 -8.89 -1.55 0
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429709 135169760 1 OF3N4H9C13 AB3C4D9E13 -97.46 3.37 -9.62 -1.49 0
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429710 135169761 1 O2F3N4H11C13 A2B3C4D11E13 -159.06 5.65 -9.04 -1.39 0
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429711 135169762 1 OF3N10H15C22 AB3C10D15E22 51.97 7.14 -9.65 -2.04 0
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429712 135169763 1 F3N10H13C20 A3B10C13D20 99.81 8.28 -9.22 -1.39 0
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429713 135169764 1 O2N5H33C56 A2B5C33D56 245.95 2.37 -8.22 -1.12 0
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429714 135169765 1 F3N4H11C13 A3B4C11D13 -50.69 5.02 -8.75 -1.14 0
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429715 135169766 1 BrNOSH8C10 ABCDE8F10 25.12 3.84 -9.0 -1.28 0
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429716 135169767 1 ON4H28C45 AB4C28D45 211.48 3.2 -8.12 -1.21 0
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429717 135169768 1 F3N4H11C14 A3B4C11D14 -41.24 4.73 -8.83 -1.45 0
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429718 135169769 1 ON5H31C50 AB5C31D50 248.73 3.55 -8.24 -1.22 0
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429719 135169770 1 ON2H16C23 AB2C16D23 72.62 3.0 -8.13 -0.83 0
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429720 135169771 1 O2N5H29C50 A2B5C29D50 224.95 2.46 -8.19 -1.43 0
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429721 135169772 1 F3N9H16C23 A3B9C16D23 86.33 3.47 -8.84 -1.76 0
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429722 135169773 1 F3N8H27C28 A3B8C27D28 30.48 7.74 -8.94 -1.43 0
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429723 135169774 1 O2N5H25C44 A2B5C25D44 211.13 2.75 -8.45 -1.44 0
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429724 135169775 1 PF3N8H22C24 AB3C8D22E24 36.45 6.17 -8.64 -1.4 0
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429725 135169776 3 FNH4C5 ABC4D5 -59.86 1.42 -9.06 -1.19 1
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429726 135169777 1 ClSO2F3N8H13C20 ABC2D3E8F13G20 5.88 6.99 0.0 0.0 0
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429727 135169778 1 BrN2C6H9 AB2C6D9 38.08 1.26 -8.75 -0.04 0
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429728 135169779 1 ON5H27C44 AB5C27D44 232.67 3.75 -8.42 -1.35 0
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429729 135169780 1 BrClON2C7H8 ABCD2E7F8 11.72 3.88 -9.19 -0.77 0
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429730 135169781 1 ClO2F3N8H16C22 AB2C3D8E16F22 -70.07 3.3 -8.24 -1.37 1
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429731 135169782 1 ClSO2F3N8H15C21 ABC2D3E8F15G21 -3.8 6.62 0.0 0.0 0
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429732 135169783 1 ClSO2F3N6H16C22 ABC2D3E6F16G22 -94.36 4.34 -8.36 -1.62 0
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429733 135169784 1 ClOF3N9H19C24 ABC3D9E19F24 3.68 9.64 -9.3 -1.55 0
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429734 135169785 1 OF3N8H17C23 AB3C8D17E23 -3.23 7.39 -9.53 -1.59 0
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429735 135169786 1 OF3N3H12C15 AB3C3D12E15 -119.17 5.9 -9.19 -1.16 0
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429736 135169787 1 ClOF3N8H16C22 ABC3D8E16F22 -18.41 7.94 -9.39 -1.3 1
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429737 135169788 1 SO2N5F6H12C19 AB2C5D6E12F19 -224.15 9.25 0.0 0.0 0
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429738 135169789 1 OF6N6H14C20 AB6C6D14E20 -244.46 11.05 -8.95 -1.49 0
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429739 135169790 2 NC5H6 AB5C6 29.79 1.41 -7.85 0.15 0
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429740 135169791 1 N3C6H13 A3B6C13 25.26 2.92 -8.94 0.66 0
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429741 135169792 1 O2F3N4H9C12 A2B3C4D9E12 -142.98 6.91 -9.02 -1.57 0
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429742 135169793 1 O2N4C11H22 A2B4C11D22 -54.18 4.19 -9.32 0.02 0
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429743 135169794 1 OF4N9H13C20 AB4C9D13E20 -23.99 2.29 -9.68 -1.78 0
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429744 135169795 1 OF4N9H13C22 AB4C9D13E22 -2.31 3.96 -8.64 -1.86 1
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429745 135169796 1 N3O3F4H14C17 A3B3C4D14E17 -202.63 4.01 0.0 0.0 0
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429746 135169797 1 ClF3N3H11C15 AB3C3D11E15 -67.07 4.19 -9.16 -1.5 0
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429747 135169798 1 O2F3N7C25H28 A2B3C7D25E28 -124.5 7.22 -8.78 -1.13 0
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429748 135169799 1 F3N6C25H31 A3B6C25D31 -54.18 9.16 -8.36 -1.12 0
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429749 135169800 1 O2N3C15H15 A2B3C15D15 -14.21 6.29 -8.77 -0.68 0
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429750 135169801 1 F3N11H14C20 A3B11C14D20 106.38 14.71 -8.84 -1.62 0
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429751 135169802 1 ClO2F3N8H20C25 AB2C3D8E20F25 -45.94 7.02 -9.68 -1.68 0
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429752 135169803 1 O2F3N3H16C17 A2B3C3D16E17 -181.95 4.39 -9.23 -1.12 0
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429753 135169804 1 O2N3F4H13C16 A2B3C4D13E16 -216.68 4.94 -9.39 -1.47 0
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429754 135169805 1 O2F3N9H14C21 A2B3C9D14E21 4.77 9.11 -9.55 -1.8 0
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429755 135169806 1 F3N9C25H26 A3B9C25D26 118.18 3.26 -8.44 -1.15 0
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429756 135169807 1 ClO3N5C10H14 AB3C5D10E14 -33.47 2.26 -8.59 -0.34 0
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429757 135169808 1 ClON8H15C20 ABC8D15E20 147.04 8.08 -9.03 -1.15 0
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429758 135169810 1 O2F3N8H19C22 A2B3C8D19E22 -56.62 7.87 -7.84 -1.59 0
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429759 135169811 1 OF4N8H16C23 AB4C8D16E23 -26.97 8.65 -9.72 -1.63 0
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429760 135169812 1 ClF3N8H22C25 AB3C8D22E25 34.13 4.13 -8.03 -1.07 0
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429761 135169813 1 SO2F3N7H16C23 AB2C3D7E16F23 -29.11 2.38 -8.38 -1.51 0
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429762 135169814 1 OF3N10H15C19 AB3C10D15E19 25.85 13.21 -9.57 -1.46 0
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429763 135169815 1 SF3N9H20C22 AB3C9D20E22 89.85 4.46 -8.68 -1.24 0
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429764 135169816 1 FON5C11H14 ABC5D11E14 -20.5 5.96 -9.17 -0.23 0
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429765 135169817 1 N5H7C9 A5B7C9 136.01 3.92 -9.69 -1.49 0
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429766 135169818 1 OF3N11H18C19 AB3C11D18E19 211.86 7.96 -8.18 -1.52 0