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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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43838 10321865 1 FN3O6C23H24 AB3C6D23E24 -195.96 5.67 -8.25 -0.89 0
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43839 10321866 1 FN3O4H20C26 AB3C4D20E26 -95.01 5.44 -8.77 -0.89 0
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43840 10321867 1 F2N3O4C24H25 A2B3C4D24E25 -208.41 7.11 -9.35 -1.03 0
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43841 10321868 1 F2N3O4C24H25 A2B3C4D24E25 -214.94 7.07 -9.74 -0.5 0
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43842 10321870 1 NO8C24H27 AB8C24D27 -296.13 3.43 -8.83 -2.15 0
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43843 10321871 1 N3O5H23C26 A3B5C23D26 -81.17 3.32 -8.85 -1.62 0
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43844 10321872 1 OF3N5C24H26 AB3C5D24E26 -171.34 5.18 -8.69 -0.79 0
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43845 10321873 1 N3O6C24H31 A3B6C24D31 -206.26 4.06 -8.16 -0.31 0
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43846 10321874 1 O2N7C25H27 A2B7C25D27 13.62 9.91 -8.13 -0.72 0
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43847 10321877 1 NO4C29H31 AB4C29D31 -105.57 2.54 -8.17 -0.05 0
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43848 10321878 1 N5O6C21H39 A5B6C21D39 -316.47 8.13 -9.46 0.03 0
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43849 10321879 1 NSO5C25H31 ABC5D25E31 -181.44 6.93 -9.64 -0.45 0
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43850 10321883 1 O2N3C29H35 A2B3C29D35 -69.52 4.07 -7.83 -0.1 0
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43851 10321885 1 NSO6C23H39 ABC6D23E39 -236.27 3.94 -9.15 -0.22 0
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43852 10321887 1 ClF2O2N5H18C22 AB2C2D5E18F22 -36.64 6.19 -8.8 -0.94 0
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43853 10321888 1 ClFO2N5C23H25 ABC2D5E23F25 -23.78 4.34 -8.74 -1.26 1
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43854 10321889 1 FO2N5C23H25 AB2C5D23E25 -15.25 3.76 0.0 0.0 0
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43855 10321890 1 ClFO2N3C25H29 ABC2D3E25F29 -76.84 4.87 -8.9 -0.65 0
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43856 10321891 1 ClSN3O5C20H28 ABC3D5E20F28 -206.6 5.38 -9.24 -0.26 0
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43857 10321892 1 Br2N2O5H10C15 A2B2C5D10E15 6.69 7.12 -10.73 -2.04 0
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43858 10321893 1 F3N4O6H9C20 A3B4C6D9E20 -63.9 1.62 -10.25 -3.1 0
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43859 10321895 1 BrNO3C24H28 ABC3D24E28 -68.12 12.48 -7.97 -0.96 1
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43860 10321896 1 NO3C24H28 AB3C24D28 -38.33 4.4 0.0 0.0 0
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43861 10321897 1 F4O4H18C25 A4B4C18D25 -256.59 3.18 -9.66 -1.59 0
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43862 10321898 1 N2F3O4H21C24 A2B3C4D21E24 -236.55 5.97 -9.52 -1.49 0
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43863 10321899 1 F3O3N4H21C23 A3B3C4D21E23 -188.03 8.53 -9.17 -0.88 0
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43864 10321900 1 SN2O10C18H22 AB2C10D18E22 -424.77 4.2 -9.02 -1.26 0
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43865 10321901 1 O2F3N6H21C22 A2B3C6D21E22 -126.94 5.0 -8.14 -1.12 0
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43867 10321903 1 N2C22H39 A2B22C39 -29.28 1.68 0.0 0.0 0
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43868 10321904 1 N2O8C23H26 A2B8C23D26 -279.26 4.41 -7.9 -0.22 0
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43869 10321906 1 N6O6C21H26 A6B6C21D26 -211.82 16.18 -8.53 -0.62 0
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43870 10321908 1 FN2O5H17C23 AB2C5D17E23 -142.71 4.38 -9.05 -1.28 0
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43871 10321910 1 SF2O3N4H20C22 AB2C3D4E20F22 -132.41 1.83 -8.96 -1.1 0
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43872 10321911 2 O3H13C14 A3B13C14 -157.78 5.87 -8.74 -0.37 0
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43873 10321913 2 N2O2C13H13 A2B2C13D13 -45.01 6.8 -9.17 -1.82 0
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43874 10321914 1 SO3N4H22C25 AB3C4D22E25 -3.3 7.94 -8.7 -1.28 0
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43875 10321915 1 SN2F3O3C22H29 AB2C3D3E22F29 -286.77 6.01 -9.16 -0.78 0
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43876 10321916 2 NO2C14H15 AB2C14D15 -101.3 7.16 -8.07 -0.06 0
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43877 10321919 1 O3N4C27H30 A3B4C27D30 -56.06 4.96 -9.32 -0.85 0
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43878 10321921 1 N6H26C29 A6B26C29 144.19 3.76 -7.88 -0.96 0
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43879 10321922 1 SO6C25H30 AB6C25D30 -208.44 4.46 -9.44 -0.65 0
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43880 10321924 1 SN2O3H26C27 AB2C3D26E27 -41.43 5.77 -8.99 -0.86 0
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43881 10321925 1 SN4O4C23H30 AB4C4D23E30 -52.62 3.45 -8.84 -0.39 0
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43882 10321926 1 FON8C23H35 ABC8D23E35 -8.3 2.2 -8.32 -0.14 0
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43883 10321927 1 N2O5C26H38 A2B5C26D38 -173.11 5.5 -8.12 0.31 0
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43884 10321928 2 ON2C14H17 AB2C14D17 -46.62 9.95 -8.4 -0.2 0
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43885 10321929 1 SO5C26H34 AB5C26D34 -184.29 5.05 -9.4 -0.84 0
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43886 10321930 1 O7C25H46 A7B25C46 -399.0 1.93 -10.44 0.51 0
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43887 10321932 1 O3C30H50 A3B30C50 -100.18 4.64 -5.91 -0.72 0
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43888 10321933 1 O2Cl3N3H14C22 A2B3C3D14E22 28.51 3.64 -9.18 -1.06 0
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43889 10321934 1 ClF6N6H9C18 AB6C6D9E18 -163.61 10.2 -8.95 -1.61 0
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43890 10321935 1 SO3C27H54 AB3C27D54 -242.28 3.72 -9.48 0.07 0
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43891 10321936 1 ClO3N4H19C25 AB3C4D19E25 1.5 2.89 -9.04 -0.99 0
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43892 10321940 1 ClON6H23C25 ABC6D23E25 95.35 3.21 -8.96 -1.3 0
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43893 10321941 1 ClSN2O4C23H23 ABC2D4E23F23 -101.42 6.63 -9.28 -1.46 0
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43894 10321944 1 ClSN2O3C24H27 ABC2D3E24F27 -81.38 3.72 -7.91 -1.05 0
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43895 10321945 1 SN2O3C24H26 AB2C3D24E26 -45.96 3.47 -7.96 -1.06 0
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43896 10321946 1 IN3O6H14C15 AB3C6D14E15 -190.77 8.69 -9.84 -1.78 0
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43897 10321950 1 BrSO3N4H15C19 ABC3D4E15F19 -9.92 7.27 -8.63 -1.05 0
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43898 10321951 1 Cl2O2N4C23H24 A2B2C4D23E24 -16.6 6.87 -8.67 -1.05 0
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43899 10321953 1 FNSO7H18C22 ABCD7E18F22 -263.24 7.0 -9.0 -1.02 0
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43900 10321954 1 N3O8C22H25 A3B8C22D25 -294.29 5.77 -8.43 -0.93 0
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43901 10321955 1 PSN5O6C17H26 ABC5D6E17F26 -261.07 4.74 -8.72 -0.6 0
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43902 10321956 1 SeO3C25H32 AB3C25D32 -84.02 4.99 -8.52 -0.4 0
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43903 10321957 1 NO6H25C27 AB6C25D27 -175.0 3.57 -9.14 -0.83 0
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43904 10321958 1 N3O7C23H29 A3B7C23D29 -266.38 3.38 -8.76 -0.36 0
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43905 10321961 1 NF3O3C26H28 AB3C3D26E28 -220.41 4.73 -9.24 -0.56 0
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43906 10321963 1 SF2O2N5C22H23 AB2C2D5E22F23 -66.3 5.17 -9.42 -0.63 0
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43907 10321965 1 OSF3N3C24H24 ABC3D3E24F24 -117.44 5.46 -8.91 -0.88 0
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43908 10321966 1 NO3H25C31 AB3C25D31 -9.29 3.66 -9.05 -0.64 0
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43909 10321969 1 O4N7C22H33 A4B7C22D33 -157.68 4.74 -9.45 0.04 0
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43910 10321971 1 NSO6C24H29 ABC6D24E29 -219.7 2.43 -9.28 -1.33 0
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43911 10321972 1 NSO6C24H29 ABC6D24E29 -221.43 8.03 -9.55 -0.09 0
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43912 10321973 1 SO4N5C22H29 AB4C5D22E29 -71.59 7.87 -7.81 -1.31 0
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43913 10321974 1 SO4N5C22H29 AB4C5D22E29 -76.21 2.87 -9.82 -1.29 0