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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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43813 10321824 1 SN4O5C22H24 AB4C5D22E24 -130.65 8.01 -8.85 -0.95 0
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43814 10321825 1 SN4O5C22H24 AB4C5D22E24 -134.79 7.66 -9.58 -0.79 0
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43815 10321826 1 SN4O5C22H24 AB4C5D22E24 -104.71 6.12 -8.94 -1.79 0
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43816 10321827 1 SO2F3N4C21H27 AB2C3D4E21F27 -200.18 6.72 -8.36 -1.53 0
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43817 10321830 2 OSN2H8C12 ABC2D8E12 82.95 7.08 -9.0 -1.51 1
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43818 10321831 1 SO2N3H16C23 AB2C3D16E23 53.61 6.97 0.0 0.0 0
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43819 10321832 1 SN4O4C23H28 AB4C4D23E28 -108.82 7.36 -8.22 -0.65 0
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43820 10321834 3 O2C9H12 A2B9C12 -273.9 7.37 -10.03 -1.24 0
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43821 10321835 2 O2C15H16 A2B15C16 -154.26 5.9 -8.25 -1.05 0
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43822 10321836 2 O2C15H16 A2B15C16 -134.23 2.19 -9.08 -0.17 0
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43823 10321842 1 ON4C29H36 AB4C29D36 -5.61 4.53 -8.92 0.1 0
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43824 10321843 3 OC10H16 AB10C16 -203.86 3.53 -9.2 0.79 0
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43825 10321847 1 N2O2C29H48 A2B2C29D48 -144.34 6.49 -8.32 0.6 0
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43826 10321848 1 NCl3F3H15C22 AB3C3D15E22 -126.63 4.59 -8.9 -0.84 0
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43827 10321850 1 ClN4O5H21C22 AB4C5D21E22 -109.28 5.43 -8.48 -1.13 0
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43828 10321852 1 ClFSN4H14C25 ABCD4E14F25 125.37 3.64 -9.04 -1.61 0
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43829 10321853 1 ClON6H21C25 ABC6D21E25 96.65 2.13 -9.05 -1.22 0
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43830 10321854 1 ClSO2N4C23H25 ABC2D4E23F25 -10.69 3.82 -8.69 -1.09 1
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43831 10321858 1 NO4C19H24 AB4C19D24 -90.83 5.71 0.0 0.0 0
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43832 10321859 2 ClNO3C10H11 ABC3D10E11 -257.11 7.86 -9.01 -0.72 0
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43833 10321860 1 BrSN2O3H17C21 ABC2D3E17F21 -38.81 2.54 -8.81 -1.16 0
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43834 10321861 1 BrON4C23H29 ABC4D23E29 -5.27 4.75 -8.41 -0.35 0
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43835 10321862 1 BrON4C23H29 ABC4D23E29 -4.86 2.38 -8.48 -0.39 0
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43836 10321863 1 NF4O5C22H23 AB4C5D22E23 -391.1 5.87 -9.23 -0.98 0
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43837 10321864 1 N3O6H19C25 A3B6C19D25 -121.67 5.97 -8.64 -1.0 0
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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