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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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56809 22390634 1 SO4N6C26H38 AB4C6D26E38 -154.32 9.51 -9.08 -0.87 0
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56810 22390745 1 OF2N2H10C17 AB2C2D10E17 -40.33 2.83 -9.25 -1.19 0
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56812 22390903 1 NOBr2C13H17 ABC2D13E17 -42.26 4.68 -9.31 -0.87 0
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56813 22390984 1 O2N3C14H21 A2B3C14D21 -65.18 5.41 -8.76 -0.58 0
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56814 22391031 1 ClN2O3H29C31 AB2C3D29E31 -48.75 7.81 -8.34 -1.02 0
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56815 22391056 1 N3O5C18H19 A3B5C18D19 -127.57 4.53 -8.32 -0.66 0
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56816 22391108 1 FNO3C27H32 ABC3D27E32 -171.01 1.92 -8.91 -0.26 0
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56817 22391165 1 NSO2C21H23 ABC2D21E23 -7.17 2.94 -8.38 -0.22 0
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56818 22391168 1 O2N3C21H23 A2B3C21D23 16.17 2.62 -8.65 -0.55 0
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56819 22394174 1 SF2N3O4H17C22 AB2C3D4E17F22 -141.8 7.81 -8.86 -1.02 0
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56820 22394186 1 ClNO2S2C11H12 ABC2D2E11F12 -29.14 1.22 -8.96 -1.21 0
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56821 22394188 1 OSF3N4H11C16 ABC3D4E11F16 -81.98 2.26 -8.87 -1.29 0
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56822 22394189 1 NCl2C8H11 AB2C8D11 -35.71 0.94 -8.44 -0.13 0
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56823 22394225 1 N2O4F9C27H27 A2B4C9D27E27 -647.35 5.28 -9.65 -1.24 0
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56824 22394234 1 N2O6F9H25C28 A2B6C9D25E28 -694.92 1.7 -9.88 -1.3 0
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56825 22394235 1 N2O8C21H22 A2B8C21D22 -287.73 5.64 -8.81 -0.71 0
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56826 22394240 1 N2O5F9H23C26 A2B5C9D23E26 -639.66 6.96 -9.23 -1.26 0
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56827 22394241 2 NOC7H11 ABC7D11 -65.23 5.35 -8.76 0.5 0
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56828 22394256 1 N2O3F9H23C27 A2B3C9D23E27 -552.29 5.87 -9.36 -1.06 0
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56829 22394279 1 N2O4F9H25C27 A2B4C9D25E27 -627.99 7.48 -9.76 -1.35 0
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56830 22394291 2 NF3O3H10C11 AB3C3D10E11 -520.18 6.29 -8.79 -1.31 0
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56831 22394312 1 ClFNO3C17H23 ABCD3E17F23 -182.2 2.84 -8.68 -0.58 0
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56832 22394314 1 NCl2O2H13C17 AB2C2D13E17 -43.6 3.15 -9.0 -0.94 0
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56833 22394320 1 N2O2C9H18 A2B2C9D18 -111.78 4.64 -8.92 0.8 0
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56834 22394324 1 SN2O3C6H12 AB2C3D6E12 -123.21 4.37 -9.69 -0.5 0
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56835 22394325 1 O2N4C25H30 A2B4C25D30 -40.95 6.55 -8.56 -0.62 0
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56836 22394327 1 ClSO3N4H23C27 ABC3D4E23F27 40.15 3.97 -8.71 -1.44 0
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56837 22394336 1 BrClSH6C9 ABCD6E9 26.14 1.84 -9.03 -1.19 0
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56838 22394337 1 ClNO3H14C17 ABC3D14E17 -68.84 0.81 -9.05 -1.14 0
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56839 22394341 1 ClSO2N5H24C27 ABC2D5E24F27 88.11 3.53 -8.74 -1.42 0
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56840 22394342 1 NO4H17C18 AB4C17D18 -99.06 5.0 -8.6 -0.68 0
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56841 22394346 2 ON2C5H7 AB2C5D7 -55.57 3.18 -9.38 -0.45 0
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56842 22394347 1 SN2Cl3O3H9C17 AB2C3D3E9F17 -11.31 1.89 -9.05 -1.38 0
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56843 22394351 2 NC4H9 AB4C9 -19.99 1.93 -8.75 3.07 0
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56844 22394355 1 NCl2O2H11C16 AB2C2D11E16 -36.2 4.11 -9.12 -1.05 0
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56845 22394358 1 ClSO2N4C26H29 ABC2D4E26F29 27.13 3.64 -8.34 -1.17 0
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56846 22394362 2 NOC5H10 ABC5D10 -115.81 5.13 -8.8 0.81 0
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56847 22394363 1 ClSF3N4O4C28H28 ABC3D4E4F28G28 -202.78 5.59 -8.87 -1.69 0
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56848 22394366 1 O2N3C9H15 A2B3C9D15 -41.48 4.03 -9.42 0.06 0
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56849 22394367 1 ClSN2O5H15C18 ABC2D5E15F18 -157.13 8.58 -9.05 -1.5 0
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56850 22394396 1 SCl2N2O3H10C17 AB2C2D3E10F17 -1.14 1.01 -9.14 -1.42 0
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56851 22394397 1 ClSN2O5H13C18 ABC2D5E13F18 -73.29 5.01 -8.76 -1.28 0
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56852 22394400 2 NC4H9 AB4C9 -11.71 2.48 -8.86 2.57 0
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56853 22394401 1 NI2O3H7C10 AB2C3D7E10 -50.26 6.46 -8.89 -1.53 0
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56854 22394404 1 SCl3N4O4C27H27 AB3C4D4E27F27 -55.2 2.15 -8.62 -1.33 0
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56855 22394410 1 N2O3H14C17 A2B3C14D17 -59.9 6.47 -9.14 -1.11 0
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56856 22394421 1 ClFSN2O3H10C17 ABCD2E3F10G17 -34.69 1.81 -9.14 -1.35 0
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56857 22394438 1 ON2C9H18 AB2C9D18 -67.93 4.69 -8.53 1.13 0
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56858 22394441 1 O2N3C24H29 A2B3C24D29 -33.35 4.59 -8.32 -0.24 0
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56859 22394442 1 ClSN2O4H17C24 ABC2D4E17F24 -4.49 2.54 -8.68 -1.35 0
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56860 22394457 1 ClSO2N5C27H30 ABC2D5E27F30 47.76 4.17 -8.63 -1.16 0
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56861 22394463 1 ClFSN2O3H10C17 ABCD2E3F10G17 -37.58 1.81 -9.22 -1.42 0
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56862 22394481 1 ClSN2F3O4H10C18 ABC2D3E4F10G18 -194.9 1.99 -9.43 -1.53 0
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56863 22394482 1 O2N3C25H31 A2B3C25D31 -36.51 3.67 -8.47 -0.24 0
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56864 22394489 1 ClN4C9H13 AB4C9D13 25.47 5.94 -9.46 -0.57 0
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56865 22394498 1 ON4C10H16 AB4C10D16 -23.81 5.31 -9.27 0.6 0
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56866 22394556 1 NSO5C18H19 ABC5D18E19 -157.19 5.06 -9.68 -1.24 0
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56867 22394559 1 ClON2H11C14 ABC2D11E14 9.42 1.82 -8.72 -1.21 0
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56868 22394568 2 NOH4C6 ABC4D6 4.66 3.61 -9.11 -1.52 0
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56869 22394578 1 N3O3H13C15 A3B3C13D15 3.25 3.32 -8.8 -1.56 0
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56870 22394588 1 OSN2H8C12 ABC2D8E12 43.7 3.14 -9.04 -1.39 0
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56871 22394593 2 NOH4C6 ABC4D6 28.24 2.29 -9.07 -1.24 0
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56872 22394594 1 O2N3H11C17 A2B3C11D17 130.53 6.82 -9.12 -2.2 -1
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56873 22394595 1 NO2C8H10 AB2C8D10 -28.43 5.24 0.0 0.0 0
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56874 22394626 1 BrNOSH8C13 ABCDE8F13 40.99 2.95 -9.04 -1.18 0
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56875 22394633 1 ClFNH3O3C7 ABCD3E3F7 -56.78 2.81 -10.86 -1.95 0
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56876 22394661 1 BrSO2N5H16C17 ABC2D5E16F17 31.48 4.74 -8.35 -0.47 0
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56877 22394665 1 SO2N5H21C23 AB2C5D21E23 58.35 5.16 -8.31 -0.9 0
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56878 22394666 1 BrSO2N5H22C25 ABC2D5E22F25 51.24 6.56 -8.24 -0.99 0
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56879 22394670 1 ClSO2N5H18C19 ABC2D5E18F19 11.79 6.03 -8.22 -1.03 0
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56880 22394681 1 FSO2N5C24H24 ABC2D5E24F24 -16.29 8.27 -8.49 -1.36 0
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56881 22394682 1 FSO2N5C15H20 ABC2D5E15F20 -67.1 5.62 -8.71 -0.31 0
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56882 22394689 1 ClSO2N5C18H26 ABC2D5E18F26 -43.84 5.61 -8.49 -0.46 0
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56883 22394690 1 ClSO2N5C15H20 ABC2D5E15F20 -28.6 4.27 -8.46 -0.5 0
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56884 22394692 1 FSO2N5C17H22 ABC2D5E17F22 -44.43 6.3 -8.56 -0.42 0
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56885 22394702 1 ClSO3N5H24C26 ABC3D5E24F26 21.72 5.89 -8.46 -0.73 0
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56886 22394709 1 FSO2N5C12H14 ABC2D5E12F14 -53.93 4.56 -8.45 -0.42 0
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56887 22394734 1 NF3O4C22H26 AB3C4D22E26 -328.9 3.39 -9.59 -0.28 0
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56888 22394735 1 NF3O4C22H28 AB3C4D22E28 -354.3 1.62 -9.45 -0.76 0
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56889 22394743 1 ClNO4C21H26 ABC4D21E26 -179.43 2.2 -9.49 -0.08 0
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56890 22394748 2 CH2O2 AB2C2 -38.25 2.7 -10.24 -0.66 0
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56891 22394750 1 O4C7H14 A4B7C14 -69.43 3.03 -10.0 -0.09 0
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56892 22394753 1 NO3C10H15 AB3C10D15 -112.11 4.75 -8.55 0.06 0
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56893 22394755 1 NO4C12H23 AB4C12D23 -216.71 2.23 -9.85 -0.21 0
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56894 22394763 1 NO2C19H25 AB2C19D25 -69.46 1.07 -9.33 0.22 0
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56895 22394774 1 S2N4O6C19H24 A2B4C6D19E24 -188.94 7.93 -9.07 -1.19 0
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56896 22394784 1 N3S3O6C18H25 A3B3C6D18E25 -216.2 8.62 -8.8 -0.78 0
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56897 22394789 1 SN4O6C18H22 AB4C6D18E22 -179.36 6.65 -9.67 -0.76 0
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56898 22394797 1 NSO2C13H21 ABC2D13E21 -85.72 3.07 -8.78 0.22 0
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56899 22394798 1 S2N3O6C19H27 A2B3C6D19E27 -210.4 6.19 -9.35 -1.07 0
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56900 22394801 1 BrSN2O4C27H37 ABC2D4E27F37 -153.49 5.27 -8.26 -0.89 0
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56901 22394802 1 S2N4O5C19H24 A2B4C5D19E24 -111.15 7.04 -9.56 -1.05 0
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56902 22394803 1 SN4O6C20H26 AB4C6D20E26 -187.49 5.31 -9.51 -0.88 0
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56903 22394809 1 S2N3O6C18H25 A2B3C6D18E25 -214.99 4.08 -9.36 -1.15 0
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56904 22394812 1 S2N3O5C20H29 A2B3C5D20E29 -191.08 4.5 -9.23 -1.03 0
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56905 22394824 1 S2N5O5C17H21 A2B5C5D17E21 -128.16 8.13 -9.91 -1.33 0
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56906 22394825 1 S2N3O6C17H23 A2B3C6D17E23 -210.97 5.35 -9.5 -1.06 0
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56907 22394841 1 NO2C14H23 AB2C14D23 -92.9 2.98 -9.58 0.16 0
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56908 22394855 1 S2N3O7C18H25 A2B3C7D18E25 -256.06 4.74 -8.77 -0.51 0
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56909 22394856 1 SN3O7C20H29 AB3C7D20E29 -274.94 4.34 -8.94 -0.72 0