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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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383796 134975731 1 INO4C11H20 ABC4D11E20 -197.25 2.43 -10.06 -1.69 0
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383797 134975732 1 OC14H20 AB14C20 -49.36 3.01 -9.46 0.17 0
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383798 134975733 1 PSF3O3H16C17 ABC3D3E16F17 -206.94 4.33 -9.39 -1.25 0
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383800 134975735 1 RbC10H15 AB10C15 -53.05 9.18 -6.38 1.61 0
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383801 134975736 1 NPC16H32 ABC16D32 -33.06 1.49 -7.96 1.3 0
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383802 134975737 2 OC7H10 AB7C10 -74.73 3.14 -9.48 0.2 0
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383804 134975739 1 SO3C13H14 AB3C13D14 -94.66 6.31 -9.46 -0.26 0
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383805 134975740 1 IO4H11C13 AB4C11D13 -102.7 1.73 -9.34 -1.43 0
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383806 134975741 1 OC15H24 AB15C24 -50.71 2.73 -9.85 1.47 0
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383807 134975743 1 OC12H20 AB12C20 -31.77 2.85 -9.63 0.32 0
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383808 134975744 1 NC9H11 AB9C11 43.95 2.66 -8.48 1.21 0
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383809 134975746 1 PC12H20 AB12C20 1.45 0.92 0.0 0.0 0
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383810 134975748 1 OC16H22 AB16C22 -34.7 1.54 -8.52 0.16 0
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383811 134975749 1 P2N4C11H28 A2B4C11D28 -21.87 1.37 -7.0 1.91 0
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383812 134975751 1 SC11H18 AB11C18 -8.47 1.67 -8.4 0.53 0
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383813 134975752 1 NOSC13H29 ABCD13E29 -85.9 4.41 -7.81 0.81 0
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383814 134975753 1 LiN2C10H19 AB2C10D19 11.43 6.3 -6.76 2.11 0
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383815 134975755 1 LiNC9H10 ABC9D10 53.79 7.03 -6.93 0.88 0
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383816 134975759 1 LiNOSC7H12 ABCDE7F12 -59.99 4.83 -7.25 0.75 0
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383817 134975760 1 OC13H20 AB13C20 -46.59 3.08 -9.2 0.77 0
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383818 134975761 1 O2C11H20 A2B11C20 -117.29 1.7 -10.23 0.43 0
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383819 134975763 2 OC5H8 AB5C8 -76.65 3.51 -9.16 0.59 0
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383820 134975764 1 SiO2C12H22 AB2C12D22 -122.65 2.2 -8.97 0.86 0
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383821 134975765 1 SiO2C11H20 AB2C11D20 -123.22 0.08 -9.23 0.62 0
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383822 134975768 1 NO3C15H27 AB3C15D27 -186.53 2.98 -9.28 0.75 0
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383824 134975773 1 LiNO3C10H16 ABC3D10E16 -142.77 12.26 -6.72 0.28 0
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383825 134975774 1 NO3C10H17 AB3C10D17 -144.12 2.91 -8.53 0.55 0
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383826 134975775 1 NOSeC12H23 ABCD12E23 -65.02 5.26 -7.7 -0.18 0
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383827 134975778 1 OC14H20 AB14C20 11.1 5.59 -8.54 -0.48 0
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383828 134975782 1 OC12H16 AB12C16 17.39 5.42 -8.59 -0.53 0
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383829 134975785 1 NCl2C13H13 AB2C13D13 40.98 3.71 -9.71 -0.33 0
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383830 134975788 1 NOH13C14 ABC13D14 -0.76 3.61 -8.84 -0.06 0
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383831 134975793 1 ON3C13H17 AB3C13D17 46.62 4.6 -9.48 -0.55 0
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383832 134975794 1 OPC15H21 ABC15D21 -20.12 2.36 -8.71 0.28 0
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383833 134975797 1 LiNC9H16 ABC9D16 17.79 7.14 -6.22 2.34 0
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383834 134975798 1 LiOSiC8H15 ABCD8E15 -71.92 6.52 -6.69 1.3 0
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383835 134975799 1 LiC5H7 AB5C7 33.88 6.55 -7.2 2.58 0
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383836 134975802 1 OC15H24 AB15C24 -64.39 2.06 -8.88 1.36 0
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383837 134975803 1 NC12H17 AB12C17 12.19 1.45 -8.51 0.4 0
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383838 134975805 1 NO2C12H21 AB2C12D21 -121.61 6.1 -9.53 1.01 0
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383839 134975810 1 OC7H12 AB7C12 -57.09 0.9 -8.91 1.4 0
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383840 134975813 1 NC10H19 AB10C19 -18.47 1.66 -8.15 1.48 0
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383841 134975814 2 O2C6H9 A2B6C9 -182.71 5.37 -10.36 -0.86 0
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383842 134975819 1 LiO2C6H11 AB2C6D11 -74.35 6.37 -7.45 1.7 0
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383843 134975824 1 O2C13H14 A2B13C14 -25.95 3.94 -8.7 -0.26 0
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383844 134975829 1 FePC10H11 ABC10D11 91.78 1.94 -8.91 -0.14 0
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383845 134975830 1 KNPC11H13 ABCD11E13 10.72 7.47 -6.32 0.16 -1
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383846 134975831 1 NPC11H13 ABC11D13 53.03 4.26 0.0 0.0 0
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383847 134975839 1 LiNC15H24 ABC15D24 58.28 20.37 -5.0 0.18 0
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383848 134975842 1 O2C13H20 A2B13C20 -95.32 0.69 -9.53 0.18 0
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383850 134975848 2 OC3H5 AB3C5 -77.04 1.35 -9.15 0.97 0
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383851 134975854 1 O2N3C14H23 A2B3C14D23 -104.61 8.49 -9.39 0.0 0
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383852 134975855 2 ON2C5H5 AB2C5D5 -38.89 6.47 -9.23 -0.7 0
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383853 134975856 1 C13H20 A13B20 18.06 0.08 -8.59 1.3 0
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383854 134975859 1 PH15C17 AB15C17 75.52 1.81 -9.1 0.21 1
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383855 134975860 1 RbC5H5 AB5C5 -8.82 9.56 -7.01 1.46 0
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383856 134975864 1 O2C13H22 A2B13C22 -81.85 2.05 -10.21 0.11 0
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383857 134975865 1 O2C7H12 A2B7C12 -85.49 0.41 -8.66 0.88 0
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383858 134975867 1 OC14H16 AB14C16 -10.37 1.02 -8.93 0.4 0
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383859 134975870 1 OC11H14 AB11C14 2.13 4.41 -9.61 0.04 0
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383860 134975872 1 OSiC12H24 ABC12D24 -92.12 0.67 -9.2 0.93 0
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383861 134975873 2 OC7H10 AB7C10 -65.49 2.52 -9.92 0.55 0
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383862 134975879 1 OC15H28 AB15C28 -74.1 1.93 -9.51 2.27 0
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383863 134975881 1 NOC11H15 ABC11D15 -15.84 2.02 -8.38 0.33 0
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383864 134975884 1 OC12H24 AB12C24 -88.92 2.1 -8.47 1.48 0
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383865 134975886 1 BrClC12H14 ABC12D14 15.94 2.45 -9.49 -0.34 0
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383866 134975887 1 SO2Cl3C9H9 AB2C3D9E9 -86.73 5.61 -10.41 -0.8 0
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383867 134975888 1 Cl3O3C8H13 A3B3C8D13 -172.71 2.41 -10.08 -0.56 0
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383868 134975890 1 LiOSiC11H21 ABCD11E21 -52.24 6.17 -7.07 1.65 0
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383870 134975895 1 NSi2C11H19 AB2C11D19 -44.24 0.58 -7.67 0.39 0
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383871 134975898 1 O3C16H22 A3B16C22 -121.63 2.92 -9.6 -0.24 0
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383872 134975899 1 N3O3C7H11 A3B3C7D11 -54.02 1.84 -10.41 -0.96 0
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383873 134975900 1 S2O3H12C13 A2B3C12D13 -50.44 3.42 -8.55 -1.38 0
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383874 134975901 1 NSO2C14H19 ABC2D14E19 -69.79 7.35 -8.01 -0.5 0
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383875 134975902 1 SC13H20 AB13C20 65.09 0.71 -8.62 0.15 0
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383876 134975904 1 LiO2C6H11 AB2C6D11 -72.93 4.78 -7.38 1.81 0
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383877 134975905 1 SO2C7H10 AB2C7D10 -92.35 5.11 -9.5 -0.39 0
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383878 134975906 1 LiNC10H12 ABC10D12 45.1 4.7 -7.04 0.47 0
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383879 134975907 1 LiNOSiC8H14 ABCDE8F14 -69.94 10.58 -6.57 1.55 0
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383880 134975909 1 SO2C15H16 AB2C15D16 -26.71 3.43 -8.65 -0.32 0
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383881 134975910 1 OC13H18 AB13C18 -45.9 2.91 -9.35 0.36 0
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383882 134975911 1 NO2C12H19 AB2C12D19 -93.42 6.08 -9.7 0.62 0
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383883 134975912 1 NO3C13H23 AB3C13D23 -170.33 3.96 -9.32 1.09 0
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383884 134975914 1 LiO2C7H11 AB2C7D11 -115.75 3.97 -7.49 1.81 0
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383885 134975915 1 O2Cl3C7H11 A2B3C7D11 -141.53 3.06 -11.16 -0.6 0
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383886 134975917 1 SO3C8H12 AB3C8D12 -95.52 2.29 -8.87 -0.12 1
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383887 134975919 1 BrPN4C9H21 ABC4D9E21 -44.61 6.23 0.0 0.0 0
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383888 134975921 1 NCl2H11C13 AB2C11D13 69.09 3.59 -9.95 -0.45 0
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383889 134975922 1 NSH15C16 ABC15D16 68.4 3.22 -9.12 -0.49 0
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383890 134975926 1 BO2N3C6H11 AB2C3D6E11 -35.96 4.91 0.0 0.0 0
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383891 134975928 1 NC11H17 AB11C17 1.27 2.19 -8.12 1.44 0
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383892 134975929 1 BrOC13H13 ABC13D13 1.43 1.0 -9.28 -0.01 0
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383893 134975930 1 LiOSC8H11 ABCD8E11 -19.12 6.33 -7.56 1.27 0
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383894 134975931 1 SSiC11H20 ABC11D20 -34.94 1.92 -8.48 0.2 0
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383895 134975932 1 OSN2C12H16 ABC2D12E16 9.48 5.27 -8.8 -0.42 0
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383896 134975933 2 OC6H13 AB6C13 -148.29 3.5 -10.11 2.33 0
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383897 134975934 1 LiOC10H21 ABC10D21 -60.29 4.82 -6.84 3.09 0
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383898 134975938 1 SO2C4H4 AB2C4D4 -22.12 1.5 -9.55 -0.58 0
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383899 134975939 1 OC16H20 AB16C20 -2.21 2.03 -9.34 0.21 0
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383900 134975940 1 OSiC16H26 ABC16D26 -83.08 0.33 -9.18 0.46 0