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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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25801 630967 1 SN4O4C14H20 AB4C4D14E20 -160.59 4.71 -8.94 -0.72 0
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25802 630968 1 O3C22H28 A3B22C28 -136.52 1.58 -8.77 0.26 0
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25803 630970 1 IH3F6C8 AB3C6D8 -282.05 2.07 -10.22 -1.72 0
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25804 630972 1 SN2O3H16C18 AB2C3D16E18 -63.32 3.19 -9.03 -0.8 0
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25805 630973 1 O3C22H28 A3B22C28 -141.26 4.19 -8.41 0.52 0
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25806 630976 1 SN2O3H16C18 AB2C3D16E18 -52.85 3.62 -9.12 -1.23 0
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25807 630987 2 NOH8C11 ABC8D11 82.69 8.65 -9.26 -1.49 0
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25808 630998 1 SiO2C21H28 AB2C21D28 -133.8 3.43 -8.47 0.0 0
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25809 630999 1 O2C23H32 A2B23C32 -109.59 2.79 -8.4 0.42 0
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25810 631009 2 O2H6C11 A2B6C11 8.28 2.64 -8.79 -1.8 0
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25811 631011 1 SiO2H16C22 AB2C16D22 -41.03 0.7 -8.47 -0.45 0
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25812 631014 2 ON2H6C10 AB2C6D10 77.67 3.76 -8.98 -1.65 0
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25813 631015 1 NO4C20H23 AB4C20D23 -111.85 3.69 -7.94 -0.22 0
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25814 631051 1 NO5C23H29 AB5C23D29 -194.8 9.2 -9.78 -0.4 0
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25815 631074 1 OF6H10C18 AB6C10D18 -310.36 5.87 -9.82 -1.82 0
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25816 631171 1 O6H18C19 A6B18C19 -158.68 3.33 -8.31 -0.81 0
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25817 631203 1 O3N5C17H21 A3B5C17D21 -61.18 5.6 -9.25 -0.49 0
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25818 631204 1 NO4F5C13H14 AB4C5D13E14 -381.4 5.7 -8.72 -0.42 0
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25819 631224 1 BrN3O4H10C16 AB3C4D10E16 21.12 2.77 -9.6 -1.97 0
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25820 631230 2 O2C12H17 A2B12C17 -160.15 3.97 -8.0 0.57 0
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25821 631231 1 NO2F3H12C19 AB2C3D12E19 -134.9 5.11 -8.95 -0.99 0
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25822 631284 1 ON2F5H13C16 AB2C5D13E16 -236.12 6.11 -9.43 -0.7 0
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25823 631294 1 O3C22H32 A3B22C32 -155.5 2.1 -8.44 0.29 0
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25824 631300 1 O4C21H28 A4B21C28 -193.92 4.14 -9.92 -0.23 0
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25825 631301 1 O5C20H24 A5B20C24 -168.49 6.91 -10.16 0.27 0
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25826 631302 1 SF3O5H7C14 AB3C5D7E14 -293.85 7.97 -9.59 -2.09 0
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25827 631303 2 OH9C14 AB9C14 39.55 2.06 -8.72 -1.03 0
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25828 631359 2 Si2O3C10H23 A2B3C10D23 -506.24 2.11 -9.57 0.44 0
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25829 631443 1 Br2O3H6C11 A2B3C6D11 -69.78 1.77 -9.83 -2.32 0
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25830 631444 2 BrOH5C6 ABC5D6 -29.95 0.37 -8.38 -0.96 0
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25831 631445 1 WO5C13H14 AB5C13D14 -5.27 8.08 -7.24 0.49 0
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25832 631492 1 N2S2O5C14H22 A2B2C5D14E22 -178.89 2.09 -9.66 -1.29 0
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25833 631521 1 FO3C21H29 AB3C21D29 -215.1 3.21 -9.95 -0.08 0
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25834 631522 1 F3N3O4C26H28 A3B3C4D26E28 -280.39 5.47 -8.57 -1.02 0
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25835 631525 2 ON2C10H10 AB2C10D10 34.0 5.2 -8.31 -1.31 0
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25836 631542 1 F3N6H15C16 A3B6C15D16 -73.93 2.24 -8.28 -0.79 0
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25837 631543 1 O4C21H32 A4B21C32 -213.83 5.7 -9.8 -0.08 0
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25838 631570 1 ON3F6H17C19 AB3C6D17E19 -287.87 12.49 -8.91 -0.91 0
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25839 631625 1 BrNO3C16H16 ABC3D16E16 -78.51 4.32 -9.16 -0.39 0
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25840 631645 1 O5N7C29H39 A5B7C29D39 -172.68 3.61 -9.08 -1.07 0
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25841 631655 1 ClO6H15C17 AB6C15D17 -179.41 10.45 -9.21 -0.84 0
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25842 631656 1 OSCl2N2H12C16 ABC2D2E12F16 14.94 4.2 -8.4 -0.7 0
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25843 631657 1 BrClOSH8C15 ABCDE8F15 23.38 3.45 -9.2 -1.32 0
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25844 631806 1 BrSO2N3H12C13 ABC2D3E12F13 -0.85 5.49 -9.06 -1.34 0
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25845 631811 2 BrClON3H9C14 ABCD3E9F14 114.51 7.39 -8.72 -1.52 0
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25846 631812 1 O3N5C18H19 A3B5C18D19 -65.15 3.67 -8.88 -0.99 -8
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25847 631813 1 CuN3O6C19H25 AB3C6D19E25 -185.77 8.97 0.0 0.0 0
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25848 631818 1 BNO2C21H44 ABC2D21E44 -236.55 2.5 -9.16 1.74 0
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25849 631819 1 SiF3N3O6C23H36 AB3C3D6E23F36 -460.18 5.13 -9.4 -0.29 0
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25850 631820 1 N2Si2O3C17H32 A2B2C3D17E32 -227.27 1.54 -9.96 0.1 0
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25851 631821 1 SiO2C23H32 AB2C23D32 -40.75 6.34 -8.88 -0.56 0
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25852 631822 1 SO2Si2N3C18H33 AB2C2D3E18F33 -143.76 3.03 -8.49 -0.24 0
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25853 631906 2 NOC11H15 ABC11D15 -52.66 1.64 -8.08 0.34 0
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25854 631990 1 B2N2O3C27H38 A2B2C3D27E38 -242.94 4.06 -8.9 -0.6 0
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25855 632026 1 O2N6H12C19 A2B6C12D19 78.6 6.04 -9.18 -2.02 0
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25856 632028 1 O6C23H26 A6B23C26 -189.52 7.62 -8.84 -0.49 0
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25857 632029 1 O3C23H32 A3B23C32 -130.19 3.78 -8.13 0.35 0
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25858 632039 1 N4C23H24 A4B23C24 106.95 4.19 -7.96 -0.52 0
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25859 632044 4 H5C7 A5B7 110.61 1.31 -8.68 -0.68 0
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25860 632051 1 Si2O3C25H42 A2B3C25D42 -260.5 1.98 -8.54 0.34 0
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25861 632059 1 N2O3H16C22 A2B3C16D22 51.02 6.79 -9.04 -1.63 0
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25862 632092 1 NPSi4O7C17H44 ABC4D7E17F44 -635.03 6.0 -8.49 -0.14 0
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25864 632103 1 NO6C23H29 AB6C23D29 -231.3 9.72 -9.78 -0.44 0
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25865 632166 1 N4O5C17H18 A4B5C17D18 -95.13 10.45 -9.41 -1.32 0
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25866 632167 1 O7H18C19 A7B18C19 -251.95 8.0 -9.26 -0.93 0
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25867 632168 1 NO5C25H39 AB5C25D39 -237.65 3.33 -9.68 0.8 0
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25868 632178 1 O4H18C23 A4B18C23 -59.77 2.61 -8.76 -1.73 0
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25869 632186 2 NH9C13 AB9C13 224.94 2.95 -7.66 -1.57 -6
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25870 632190 1 SiO2C18H30 AB2C18D30 -133.61 2.72 -8.7 0.04 0
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25871 632191 1 OPN2C32H37 ABC2D32E37 -23.16 2.38 -7.72 -0.39 0
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25872 632198 2 OH7C13 AB7C13 33.33 1.08 -9.06 -1.73 0
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25873 632200 1 NO6C19H21 AB6C19D21 -206.67 4.05 -8.61 -0.66 0
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25874 632209 1 BrN2O3H15C18 AB2C3D15E18 -48.0 2.92 -9.45 -0.96 0
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25875 632300 2 NO3C9H10 AB3C9D10 -193.26 4.61 -8.54 -0.49 0
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25876 632302 1 PSN2F3O4C23H24 ABC2D3E4F23G24 -328.71 9.77 -9.17 -1.29 0
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25877 632310 1 OH20C27 AB20C27 74.46 1.8 -8.25 -0.92 0
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25878 632399 1 O6H14C21 A6B14C21 -172.81 5.7 -8.8 -1.9 0
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25879 632416 1 SN2O4F9H11C18 AB2C4D9E11F18 -550.43 6.21 -9.28 -1.67 0
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25880 632417 1 BrNO3C17H18 ABC3D17E18 -94.34 6.27 -9.08 -0.5 0
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25881 632442 1 NO2C24H29 AB2C24D29 -79.69 3.34 -8.98 -0.04 -7
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25883 632483 1 IO3H9C15 AB3C9D15 -25.71 1.97 -9.18 -1.16 0
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25884 632615 3 BFOH4C6 ABCD4E6 -371.79 2.81 -9.81 -0.69 0
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25885 632637 1 O3N5C19H21 A3B5C19D21 -28.64 2.41 -8.11 0.03 0
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25886 632638 1 O7C24H26 A7B24C26 -216.0 4.9 -8.44 -0.65 0
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25887 632647 1 SiO2C24H34 AB2C24D34 -96.93 2.65 -8.47 0.41 0
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25888 632648 1 NF3O4H16C18 AB3C4D16E18 -273.07 6.89 -8.85 -0.32 0
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25889 632651 1 NOBr2H9C14 ABC2D9E14 19.6 7.13 -8.76 -1.07 0
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25890 632653 1 S2N3O5H13C14 A2B3C5D13E14 -77.07 9.89 -9.22 -1.76 0
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25891 632654 1 N3O3C21H25 A3B3C21D25 -79.11 2.57 -8.34 -0.7 0
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25892 632655 1 NO6H17C20 AB6C17D20 -160.38 3.18 -8.26 -1.11 0
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25893 632657 1 Br3Cl3H4C8 A3B3C4D8 13.75 0.53 -10.33 -1.77 0
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25894 632670 1 Cl3N4O4H9C14 A3B4C4D9E14 47.38 5.56 -9.72 -2.18 0
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25895 632671 1 BrO2N3H10C17 AB2C3D10E17 9.22 1.45 -9.67 -1.58 0
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25896 632672 1 NCl2Br3H4C10 AB2C3D4E10 40.33 2.63 -9.86 -1.81 0
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25897 632776 1 N2Br3H9C10 A2B3C9D10 53.06 3.45 -9.39 -0.86 0
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25898 632784 2 SiO2C10H12 AB2C10D12 -215.96 2.25 -9.35 -1.4 0
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25899 632792 1 NSiO2C22H31 ABC2D22E31 -95.96 0.81 -8.65 0.34 0
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25900 632794 1 N2O6C25H32 A2B6C25D32 -179.13 5.79 -8.11 -0.1 0
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25901 633044 1 N4H18C25 A4B18C25 190.75 7.74 -9.13 -0.36 0
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25902 633047 1 N2H22C27 A2B22C27 139.31 1.02 -8.76 -0.62 0