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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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430781 135170848 1 N3O4C28H41 A3B4C28D41 -170.74 3.84 -8.0 0.12 0
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430782 135170849 1 FO2N3C27H30 AB2C3D27E30 -62.35 1.59 -8.68 -0.84 0
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430783 135170850 1 FO2N3C27H28 AB2C3D27E28 -51.88 2.69 -8.89 -0.72 0
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430784 135170851 1 ClSN4O5C20H23 ABC4D5E20F23 -139.38 1.4 -8.64 -0.86 0
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430785 135170852 1 ON2Cl3F3H4C9 AB2C3D3E4F9 -170.55 1.86 -9.72 -1.39 0
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430786 135170853 2 NC8H13 AB8C13 3.21 2.65 -8.45 0.41 0
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430787 135170854 1 F3N4O4C29H35 A3B4C4D29E35 -304.76 3.87 -9.38 -1.05 0
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430788 135170855 1 O2F3N3C25H28 A2B3C3D25E28 -200.45 4.73 -9.18 -0.87 -1
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430789 135170856 1 SN3O3C24H32 AB3C3D24E32 -69.81 3.29 0.0 0.0 0
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430790 135170857 1 SN3O3C24H33 AB3C3D24E33 -89.05 4.02 -8.64 -0.13 0
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430791 135170858 1 ON4C26H32 AB4C26D32 29.51 2.57 -8.98 -0.5 0
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430792 135170859 1 ON4C26H32 AB4C26D32 29.13 2.12 -8.93 -0.52 0
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430793 135170860 1 ClSN3O4C20H22 ABC3D4E20F22 -82.42 1.89 -8.47 -0.74 0
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430794 135170861 1 O2N5C26H31 A2B5C26D31 34.19 5.56 -8.27 -0.32 0
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430795 135170862 1 O2N5C26H31 A2B5C26D31 30.3 4.21 -8.32 -0.4 0
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430796 135170863 1 ON7C16H21 AB7C16D21 63.27 3.15 -9.07 -1.11 0
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430797 135170864 1 O2N5C26H31 A2B5C26D31 22.26 2.04 -8.41 -0.47 0
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430798 135170865 1 OF2N3C24H27 AB2C3D24E27 -88.96 6.6 -8.87 -0.48 0
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430799 135170866 1 O3N5C17H25 A3B5C17D25 -20.88 6.96 -9.07 -1.14 0
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430800 135170867 1 OF2N3C24H27 AB2C3D24E27 -89.63 4.85 -8.82 -0.55 0
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430801 135170868 1 FO2N3C26H28 AB2C3D26E28 -57.72 5.49 -8.88 -0.52 0
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430802 135170869 1 ON3C26H31 AB3C26D31 -0.21 3.72 -8.72 -0.37 0
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430803 135170870 1 O2F3N3C23H30 A2B3C3D23E30 -230.37 3.14 -8.87 -0.58 0
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430804 135170871 1 ON2F3C17H19 AB2C3D17E19 -179.2 2.75 -8.83 -0.57 0
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430805 135170872 1 ON3C26H31 AB3C26D31 4.45 1.8 -8.5 -0.39 0
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430806 135170873 1 N2O4C25H26 A2B4C25D26 -108.62 0.97 -8.83 -0.73 0
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430807 135170874 1 ClSO3N4C19H23 ABC3D4E19F23 -75.75 6.94 -8.68 -0.84 0
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430808 135170875 1 ON3C24H29 AB3C24D29 7.81 5.84 -8.68 -0.15 0
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430809 135170876 2 NC4H9 AB4C9 -23.87 1.78 -8.78 3.06 0
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430810 135170877 1 O2N3C20H25 A2B3C20D25 -20.25 4.79 -8.82 -0.48 0
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430811 135170878 1 O2N3C20H25 A2B3C20D25 -21.3 2.94 -8.87 -0.56 0
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430812 135170879 1 ON5C23H29 AB5C23D29 27.27 8.29 -8.8 -0.34 0
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430813 135170880 1 ON3C25H33 AB3C25D33 -10.23 2.37 -8.58 0.36 0
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430814 135170881 1 ClSN4O4C16H17 ABC4D4E16F17 -92.29 1.51 -8.76 -0.89 0
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430815 135170882 1 ClSO3N4H19C21 ABC3D4E19F21 -21.24 3.83 -8.7 -0.94 0
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430816 135170883 1 S2F3O4N5H20C21 A2B3C4D5E20F21 -234.12 4.84 -8.64 -1.42 0
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430817 135170884 1 FON4C23H27 ABC4D23E27 -31.19 6.45 -9.22 -0.65 0
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430818 135170885 1 OF3N4C23H25 AB3C4D23E25 -139.99 5.21 -8.91 -0.4 0
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430819 135170886 1 OF3N4C23H25 AB3C4D23E25 -122.7 1.08 -8.98 -0.64 0
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430820 135170887 1 OF3N4C23H25 AB3C4D23E25 -139.75 3.36 -8.89 -0.38 0
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430821 135170888 1 ClSN3O4C17H18 ABC3D4E17F18 -99.88 4.25 -8.62 -0.82 0
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430822 135170889 1 ON4C23H28 AB4C23D28 20.12 7.16 -8.86 -0.66 0
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430823 135170890 1 ON4C23H26 AB4C23D26 33.74 0.93 -8.64 -0.36 0
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430824 135170891 1 OF3N4C23H25 AB3C4D23E25 -141.78 1.86 -8.96 -0.7 0
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430825 135170892 1 NPSO3H6C7 ABCD3E6F7 -103.51 4.81 -9.37 -1.14 0
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430826 135170893 1 O2N3C24H27 A2B3C24D27 -37.28 3.2 -8.76 -0.46 0
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430827 135170894 1 OF3N4C23H25 AB3C4D23E25 -141.16 5.21 -8.91 -0.67 0
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430828 135170895 1 O2N3C24H27 A2B3C24D27 -38.18 6.24 -8.74 -0.4 0
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430829 135170896 1 ClSO2N4H19C20 ABC2D4E19F20 22.9 2.08 -8.58 -0.81 0
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430830 135170897 1 ClON3C24H28 ABC3D24E28 -1.19 4.25 -8.46 -0.25 0
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430831 135170898 1 ClON3C24H26 ABC3D24E26 13.51 4.58 -8.74 -0.45 0
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430832 135170899 1 ClSN4O4C21H25 ABC4D4E21F25 -97.72 4.57 -8.52 -0.67 0
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430833 135170900 1 ClSN3O4C19H20 ABC3D4E19F20 -81.3 3.23 -8.58 -0.82 0
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430834 135170901 1 ON3F4C24H25 AB3C4D24E25 -196.31 7.66 -8.96 -0.71 0
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430835 135170902 1 ON3F4C24H25 AB3C4D24E25 -199.34 4.23 -8.88 -0.59 0
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430836 135170903 1 ON3F4C24H25 AB3C4D24E25 -198.48 3.96 -8.86 -0.61 0
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430837 135170904 2 ON2C14H15 AB2C14D15 8.42 5.44 -8.96 -0.91 0
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430838 135170905 2 ON2C14H15 AB2C14D15 12.16 6.39 -9.07 -0.8 0
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430839 135170906 1 FO2N3C26H28 AB2C3D26E28 -58.32 3.56 -8.7 -0.63 0
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430840 135170907 1 FO2N3C26H28 AB2C3D26E28 -57.68 1.06 -8.82 -0.52 0
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430841 135170908 1 ON3C26H31 AB3C26D31 23.43 4.3 -8.64 -0.32 0
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430842 135170909 2 NOC4H5 ABC4D5 -54.73 5.39 -9.01 -0.54 0
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430843 135170910 1 ON3F4C24H25 AB3C4D24E25 -199.4 4.91 -8.86 -0.56 0
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430844 135170911 1 O3N4H32C33 A3B4C32D33 35.19 3.38 -8.57 -0.75 0
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430845 135170912 1 ON6C24H28 AB6C24D28 82.7 7.54 -8.78 -0.36 0
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430846 135170913 1 ON4C24H28 AB4C24D28 22.12 3.53 -8.28 -0.38 0
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430847 135170914 1 ON5C24H27 AB5C24D27 48.14 7.71 -9.43 -0.93 0
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430848 135170915 1 O2N3C26H31 A2B3C26D31 -15.06 4.9 -8.74 -0.35 0
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430849 135170916 1 FN3O3C13H14 AB3C3D13E14 -122.4 2.87 -8.38 -0.62 0
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430850 135170917 1 ON3C24H29 AB3C24D29 5.33 4.33 -8.67 -0.31 0
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430851 135170918 1 ON5C24H27 AB5C24D27 45.63 5.53 -9.12 -1.27 0
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430852 135170919 1 ON3C24H27 AB3C24D27 22.01 2.42 -8.52 -0.4 0
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430853 135170920 1 O2N4C25H28 A2B4C25D28 -2.44 3.94 -8.67 -0.6 0
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430854 135170921 1 N3O4C27H33 A3B4C27D33 -120.41 1.59 -8.29 -0.91 0
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430855 135170922 1 FNO2C12H16 ABC2D12E16 -105.47 2.8 -8.3 0.06 0
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430856 135170923 1 N5O5C43H53 A5B5C43D53 -178.98 3.04 -8.26 -0.4 0
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430857 135170924 1 ON3C26H31 AB3C26D31 -1.94 3.86 -8.68 -0.3 0
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430858 135170925 1 O2N5C21H27 A2B5C21D27 -12.28 1.53 -8.79 -0.45 0
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430859 135170926 1 O2N5C21H27 A2B5C21D27 -13.6 1.49 -8.74 -0.44 0
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430860 135170927 1 SO2N6C23H26 AB2C6D23E26 -3.11 10.95 -8.18 -1.14 0
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430861 135170928 1 FON4C23H27 ABC4D23E27 -31.36 2.73 -9.09 -0.55 0
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430862 135170929 1 FON4C23H27 ABC4D23E27 -33.25 3.76 -9.14 -0.65 0
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430863 135170930 1 NOC6H7 ABC6D7 9.67 2.0 -9.13 -0.64 0
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430864 135170931 1 ON4C23H28 AB4C23D28 16.21 0.75 -8.86 -0.6 0
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430865 135170932 1 OF3N4C23H25 AB3C4D23E25 -141.42 0.77 -8.93 -0.67 0
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430866 135170933 1 FON3C24H28 ABC3D24E28 -43.65 2.99 -8.72 -0.35 0
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430867 135170934 1 ON4C22H26 AB4C22D26 17.1 2.77 -8.18 -0.78 0
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430868 135170935 1 ON4C22H26 AB4C22D26 17.46 4.99 -8.31 -0.73 0
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430869 135170936 1 IN2C8H9 AB2C8D9 86.34 1.76 -8.47 -1.7 0
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430870 135170937 2 NOC12H18 ABC12D18 -44.6 1.8 -8.17 -0.12 0
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430871 135170938 1 FON3C24H28 ABC3D24E28 -41.16 6.07 -8.54 -0.1 0
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430872 135170939 1 N2O2C23H36 A2B2C23D36 -64.68 3.69 -8.13 -0.11 0
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430873 135170940 1 ON3C24H29 AB3C24D29 2.95 5.1 -8.71 -0.18 0
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430874 135170941 1 FON4C23H35 ABC4D23E35 -65.53 3.93 -8.55 0.16 0
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430875 135170942 1 FON4C23H27 ABC4D23E27 -29.83 5.05 -9.09 -0.43 0
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430876 135170943 1 FON4C23H27 ABC4D23E27 -31.01 1.65 -9.05 -0.76 0
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430877 135170944 1 OF2N4C23H26 AB2C4D23E26 -59.28 5.68 -9.15 -0.79 0
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430878 135170945 1 FON5C24H26 ABC5D24E26 -0.14 5.92 -9.07 -0.83 0
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430879 135170946 1 FON5C24H26 ABC5D24E26 -0.67 7.15 -9.16 -0.92 0
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430880 135170947 1 FON4C25H27 ABC4D25E27 -11.77 6.65 -9.14 -0.87 0