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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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231868 87574821 1 ClO2H3F6C10 AB2C3D6E10 -352.3 3.25 -10.81 -2.08 0
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231869 87574824 1 SO6C11H22 AB6C11D22 -283.43 3.1 -9.05 0.44 1
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231870 87574825 1 NO2C6H16 AB2C6D16 -47.97 4.57 0.0 0.0 0
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231871 87574826 1 Cl2S2F3O8N9C50H60 A2B2C3D8E9F50G60 -393.95 3.13 -9.26 -1.06 0
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231872 87574827 1 ClO2H3F6C10 AB2C3D6E10 -350.98 1.0 -10.66 -2.16 0
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231873 87574828 1 NSO2H13C14 ABC2D13E14 -26.72 4.51 -8.32 -1.25 0
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231874 87574834 2 S2C8H9 A2B8C9 44.46 4.28 -8.97 -1.11 0
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231875 87574835 1 NS2O3C5H11 AB2C3D5E11 -145.06 5.04 -8.77 -1.11 0
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231876 87574836 1 OS2C3H6 AB2C3D6 -45.41 2.44 -8.92 -1.51 0
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231877 87574837 1 SN2O2C14H14 AB2C2D14E14 -32.43 4.67 -8.42 -1.16 0
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231878 87574838 1 ClO2F3N4H18C25 AB2C3D4E18F25 -62.01 6.28 -9.24 -1.73 0
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231879 87574842 1 ON3C32H37 AB3C32D37 40.22 1.64 -8.24 -0.01 0
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231880 87574843 1 NO6C20H23 AB6C20D23 -122.72 3.85 -9.21 -0.89 0
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231881 87574845 1 FSO4N6C27H31 ABC4D6E27F31 -128.33 4.16 -9.19 -1.17 0
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231882 87574849 1 NOTeH7C9 ABCD7E9 -3.48 4.47 -7.94 -0.78 0
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231883 87574850 1 SN2O2C8H20 AB2C2D8E20 -109.67 3.73 -9.96 0.05 0
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231884 87574851 1 SSiN2O10C38H54 ABC2D10E38F54 -420.43 8.19 -7.61 -0.41 0
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231885 87574852 1 PSC2O3H7 ABC2D3E7 -134.68 4.65 -9.86 -0.1 0
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231887 87574854 1 NO2C9H15 AB2C9D15 -92.15 2.36 -10.15 -0.74 0
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231888 87574855 1 SSeO3H6C8 ABC3D6E8 -85.94 4.68 -8.98 -1.17 0
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231889 87574856 2 NOC8H8 ABC8D8 7.53 6.44 -8.56 -1.17 0
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231890 87574858 1 SN2O2C15H24 AB2C2D15E24 -61.54 6.49 -8.54 -0.08 0
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231891 87574859 1 O5C23H42 A5B23C42 -131.23 2.69 -9.67 -1.27 0
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231892 87574860 1 O3C23H42 A3B23C42 -188.57 0.32 -9.54 0.3 0
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231893 87574861 2 O2C6H11 A2B6C11 -133.11 1.61 -9.44 -0.97 0
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231894 87574862 1 OTeC11H12 ABC11D12 -13.85 2.6 -7.9 -0.46 0
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231895 87574863 1 SN2O2C14H32 AB2C2D14E32 -136.4 4.31 -9.55 0.08 0
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231896 87574864 1 FTeH5C8 ABC5D8 -4.63 1.88 -8.39 -0.71 0
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231897 87574865 2 O3C26H49 A3B26C49 -431.88 4.74 -10.02 0.16 0
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231898 87574866 1 SiO2C14H27 AB2C14D27 -146.32 1.15 0.0 0.0 0
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231899 87574867 1 NO2C5H11 AB2C5D11 -70.25 3.33 -10.07 0.7 0
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231900 87574868 1 BrO3N4F5H12C17 AB3C4D5E12F17 -296.63 2.33 -9.34 -1.37 1
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231901 87574869 1 NO2C12H26 AB2C12D26 -109.36 4.5 0.0 0.0 0
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231902 87574870 2 C6O6H7 A6B6C7 -511.95 4.65 -11.11 -1.59 0
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231903 87574871 1 S2O5F6H32C33 A2B5C6D32E33 -456.82 7.01 -8.65 -0.46 0
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231904 87574872 1 ON2C8H10 AB2C8D10 3.94 5.45 -10.18 -0.5 0
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231906 87574877 2 SiO4C11H24 AB4C11D24 -466.86 3.59 -8.94 1.1 0
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231907 87574882 2 PO2C8H16 AB2C8D16 -234.03 4.15 -9.09 0.49 0
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231908 87574883 1 NSO2H13C14 ABC2D13E14 -28.72 3.6 -8.32 -1.26 0
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231909 87574887 2 OC7H14 AB7C14 -147.11 2.98 -10.07 0.75 0
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231910 87574891 1 NCl3O3C18H18 AB3C3D18E18 -106.18 5.88 -9.24 -0.59 -1
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231911 87574895 1 GeNOSCl4C10H16 ABCDE4F10G16 2.0 3.97 0.0 0.0 0
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231912 87574898 1 O5C15H26 A5B15C26 -90.58 2.08 -9.88 -1.32 0
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231913 87574899 2 O2C4H7 A2B4C7 -102.67 1.82 -9.82 -1.02 0
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231914 87574904 1 SO5C6H12 AB5C6D12 -206.35 4.09 -10.39 0.06 0
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231915 87574905 1 ON3C25H31 AB3C25D31 -10.12 4.1 -9.15 -0.04 0
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231916 87574906 1 ON3C30H39 AB3C30D39 -0.04 3.67 -8.96 -0.21 0
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231917 87574907 1 SO3C14H28 AB3C14D28 -194.74 7.0 -8.93 0.1 0
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231918 87574909 1 SN4O5C16H30 AB4C5D16E30 -252.55 8.92 -9.14 -0.06 0
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231919 87574910 1 NS4O27C57H83 AB4C27D57E83 -1264.45 3.01 -8.41 0.04 0
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231920 87574912 1 BrH9C13 AB9C13 102.41 2.34 -9.26 -0.5 0
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231921 87574914 1 SO6C7H10 AB6C7D10 -235.92 2.34 -11.72 -0.27 0
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231922 87574915 1 N3S3O27C56H83 A3B3C27D56E83 -1225.23 5.31 -8.76 0.0 0
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231923 87574916 1 NSi2F3C7H16 AB2C3D7E16 -195.59 4.26 -7.49 -0.64 0
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231924 87574917 1 NCl2O3C19H21 AB2C3D19E21 -109.07 4.96 -9.02 -0.26 0
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231925 87574922 1 FSN6O8C24H33 ABC6D8E24F33 -296.64 12.33 -8.31 -1.07 0
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231926 87574934 1 SN2O4F6H10C20 AB2C4D6E10F20 -375.43 6.98 -9.57 -1.64 0
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231927 87574935 1 SO2N6H20C21 AB2C6D20E21 53.27 4.48 -8.43 -1.07 0
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231928 87574937 1 O3N4H16C17 A3B4C16D17 0.32 4.8 -8.2 -1.25 0
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231929 87574938 1 SF3O3N4H15C21 AB3C3D4E15F21 -139.4 3.91 -8.96 -1.44 0
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231930 87574940 1 SN5O6H25C30 AB5C6D25E30 -25.37 5.11 -8.99 -1.16 0
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231931 87574941 1 BrSCl2F3N3O3H25C35 ABC2D3E3F3G25H35 -169.07 7.15 -9.4 -1.56 0
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231932 87574942 1 ClN2F4C23H23 AB2C4D23E23 -161.57 5.69 -9.43 -0.96 0
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231933 87574944 1 ClO2N5C20H26 AB2C5D20E26 -32.55 6.94 -8.35 -0.18 0
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231934 87574947 1 SiO2C14H27 AB2C14D27 -156.05 0.81 0.0 0.0 0
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231935 87574951 1 N3C16H19 A3B16C19 72.31 3.68 -8.82 0.01 0
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231936 87574952 2 O2C6H7 A2B6C7 -143.63 6.25 -9.26 -0.71 0
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231937 87574953 1 SiO2C19H41 AB2C19D41 -202.74 1.23 0.0 0.0 0
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231938 87574957 1 ClO2N6H15C20 AB2C6D15E20 45.38 4.11 -9.71 -1.27 0
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231939 87574959 1 OCl2N2H20C22 AB2C2D20E22 33.83 4.51 -8.34 -0.55 0
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231940 87574960 1 NS4O27C57H83 AB4C27D57E83 -1258.91 5.68 -8.78 -0.22 0
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231941 87574966 1 S3N9O11H47C50 A3B9C11D47E50 -220.14 12.61 -9.19 -1.52 0
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231942 87574968 1 Br3N4O10C19H27 A3B4C10D19E27 -434.75 10.94 -10.09 -1.82 0
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231943 87574969 1 Br3N4O10C19H27 A3B4C10D19E27 -447.31 7.98 -10.05 -1.76 0
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231946 87574973 1 BrNSSiO5C21H32 ABCDE5F21G32 -223.38 8.64 -9.21 -0.04 0