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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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406792 135078623 1 NOC12H19 ABC12D19 -48.85 4.41 -9.32 1.04 0
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406793 135078625 1 AlOC6H11 ABC6D11 -12.55 1.51 -9.59 1.17 0
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406794 135078628 1 SiO5C15H28 AB5C15D28 -256.27 2.74 -9.42 0.61 0
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406795 135078634 1 BrNSO10C16H22 ABCD10E16F22 -399.64 3.59 -10.06 -1.3 1
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406796 135078664 1 ON2C7H13 AB2C7D13 -23.35 3.61 0.0 0.0 0
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406797 135078665 2 OSiC13H26 ABC13D26 -236.54 0.89 -9.07 1.14 0
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406798 135078666 1 SO2F3N3H10C12 AB2C3D3E10F12 -170.61 5.02 -9.11 -1.19 0
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406799 135078667 1 SF3N3O3H10C13 AB3C3D3E10F13 -212.82 3.67 -9.36 -1.49 0
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406800 135078668 1 SN6C12H14 AB6C12D14 101.17 1.92 -8.73 -0.93 0
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406801 135078669 1 ClN2C19H19 AB2C19D19 53.67 8.34 -8.7 -0.39 0
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406802 135078670 1 NSH13C16 ABC13D16 84.2 2.87 -8.43 -1.04 0
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406803 135078671 1 N2F3H11C12 A2B3C11D12 -106.15 7.74 -9.5 -0.67 0
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406804 135078672 1 FNOH18C19 ABCD18E19 -11.54 1.65 -9.07 -0.34 0
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406805 135078673 1 FNOH18C19 ABCD18E19 -7.69 0.96 -8.77 -0.33 0
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406806 135078674 1 SiO4C19H22 AB4C19D22 -124.38 3.41 -8.62 -0.66 0
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406807 135078675 1 O3C14H24 A3B14C24 -137.81 3.64 -10.03 -0.07 0
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406808 135078676 1 NOSiC19H27 ABCD19E27 -55.71 2.24 -8.71 -0.55 0
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406809 135078677 1 NOSiC15H31 ABCD15E31 -123.14 2.48 -8.77 0.95 0
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406810 135078678 1 NO5C21H23 AB5C21D23 -138.39 2.51 -8.42 -0.78 0
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406811 135078679 1 NO5C21H23 AB5C21D23 -141.8 2.09 -8.44 -0.78 0
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406812 135078680 1 NO5C21H23 AB5C21D23 -142.07 2.27 -8.44 -0.79 0
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406813 135078681 1 ClNO2C18H20 ABC2D18E20 -59.39 4.86 -8.91 -0.05 1
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406814 135078682 1 NO2C16H18 AB2C16D18 -32.7 1.59 0.0 0.0 0
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406815 135078683 1 ClSiH3C4 ABC3D4 49.39 1.64 -10.95 -0.6 0
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406816 135078684 1 NO3C18H27 AB3C18D27 -129.69 2.69 -9.45 -0.3 0
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406817 135078689 1 NSO2C21H25 ABC2D21E25 -61.67 2.77 -8.83 -0.38 0
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406818 135078692 1 LiOC5H9 ABC5D9 -55.91 5.58 -8.95 1.74 0
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406820 135078721 1 SiO6C32H54 AB6C32D54 -343.56 2.53 -8.66 0.31 0
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406821 135078722 1 NOF4H11C18 ABC4D11E18 -157.62 2.97 -9.15 -1.28 0
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406822 135078723 1 BClC14H18 ABC14D18 -20.95 2.27 -9.42 -0.53 0
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406823 135078724 1 NSH13C18 ABC13D18 86.32 1.71 -8.52 -0.95 0
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406824 135078725 1 FO3H9C14 AB3C9D14 -40.81 3.9 -9.21 -0.76 0
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406825 135078726 1 NSO2C14H19 ABC2D14E19 -66.66 4.11 -9.77 -0.32 0
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406826 135078727 1 ClSN2O2H11C13 ABC2D2E11F13 -9.98 4.8 -9.76 -0.99 0
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406827 135078729 1 O2C9H18 A2B9C18 -123.66 2.61 -9.84 0.86 0
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406829 135078733 1 NO2C15H21 AB2C15D21 -54.89 2.97 -9.08 0.36 0
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406830 135078734 1 BSiO3C47H55 ABC3D47E55 -122.56 2.74 -8.63 -0.09 0
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406831 135078735 1 BSiO3F4C41H45 ABC3D4E41F45 -322.16 1.12 -8.75 -0.49 0
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406832 135078736 1 BSiO3F4C49H49 ABC3D4E49F49 -292.42 1.25 -8.84 -0.58 0
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406833 135078738 1 OSiC16H26 ABC16D26 -94.34 1.39 -8.83 0.61 0
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406834 135078739 1 SiN3O4C39H43 AB3C4D39E43 -106.47 2.1 -9.01 -0.92 0
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406835 135078740 1 ClO3C24H25 AB3C24D25 -43.39 2.67 -8.99 -0.27 0
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406836 135078741 1 NSO2C18H27 ABC2D18E27 -62.19 5.99 -9.29 -0.4 0
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406837 135078742 1 ClOSN2H9C10 ABCD2E9F10 16.19 2.32 -8.65 -1.22 0
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406838 135078744 1 SO2N3C16H21 AB2C3D16E21 -14.17 10.52 -10.35 -0.76 0
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406839 135078745 1 GeF20H26C39 AB20C26D39 -920.37 3.9 -8.85 -0.69 0
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406840 135078748 1 GeOC31H32 ABC31D32 51.2 1.73 -9.02 0.27 0
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406841 135078749 1 GeISi4C20H43 ABC4D20E43 7.52 1.32 -5.68 -1.51 0
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406843 135078764 1 NSSiO6C15H31 ABCD6E15F31 -331.78 1.38 -8.82 -0.46 0
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406844 135078771 1 IO2C20H27 AB2C20D27 -27.41 1.03 -8.58 -0.82 0
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406845 135078772 1 ClNO4C20H20 ABC4D20E20 -113.9 4.23 -9.1 -0.98 0
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406846 135078776 1 NSO3C15H21 ABC3D15E21 -107.9 2.28 -8.1 -0.11 0
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406847 135078784 1 OSi2C17H34 AB2C17D34 -115.59 1.28 -8.68 0.28 0
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406848 135078785 1 LiO2C16H21 AB2C16D21 -21.44 7.59 -7.43 0.28 0
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406849 135078788 1 BrNO2C16H22 ABC2D16E22 -100.15 3.82 -9.26 -0.16 0
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406850 135078790 1 NO3C14H27 AB3C14D27 -174.7 1.66 -10.08 0.76 0
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406851 135078792 1 FO3C15H15 AB3C15D15 -102.33 2.77 -10.33 -0.99 0
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406852 135078796 2 NO2C10H14 AB2C10D14 -124.27 2.88 -8.8 -1.07 1
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406853 135078797 1 N2O4C20H29 A2B4C20D29 -133.27 7.44 0.0 0.0 0
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406854 135078798 1 OC14H16 AB14C16 18.76 2.86 -9.03 -0.13 0
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406855 135078799 1 NO2F3H18C19 AB2C3D18E19 -161.93 5.78 -8.64 -0.6 0
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406856 135078800 1 NOF3C20H28 ABC3D20E28 -189.46 3.34 -9.38 0.24 0
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406857 135078801 1 NH29C31 AB29C31 124.93 1.14 -9.27 -0.08 0
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406858 135078802 1 BrN2O3C19H25 AB2C3D19E25 -82.26 3.67 -9.42 -1.24 1
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406859 135078803 1 BrN2O3C19H26 AB2C3D19E26 -89.79 5.95 0.0 0.0 0
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406860 135078804 1 N2O5C21H28 A2B5C21D28 -169.4 1.7 -10.05 -1.2 1
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406861 135078805 1 N2O5C21H29 A2B5C21D29 -177.01 4.67 0.0 0.0 0
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406862 135078806 1 OSnC18H38 ABC18D38 -104.97 3.01 -8.14 0.41 0
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406863 135078807 1 SiO2C21H24 AB2C21D24 -61.51 2.67 -8.93 -0.41 0
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406864 135078808 1 BC15H21 AB15C21 -19.97 0.53 -9.13 -0.17 0
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406865 135078809 1 BrNO3H16C17 ABC3D16E17 -56.34 4.28 -8.76 -0.88 0
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406866 135078810 1 NF3O3H16C18 AB3C3D16E18 -220.98 5.2 -8.85 -1.14 0
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406867 135078811 1 N3O3C4H7 A3B3C4D7 -49.2 3.39 -10.2 -0.38 0
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406868 135078812 1 INO2C13H16 ABC2D13E16 -33.13 1.94 -9.31 -1.03 0
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406870 135078814 1 O7C30H44 A7B30C44 -302.62 3.82 -9.6 0.02 0