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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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186802 77487348 1 FN2O2C25H27 AB2C2D25E27 -51.79 5.13 -8.34 -1.23 0
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186803 77487375 1 SF3O3N4H27C29 AB3C3D4E27F29 -179.99 4.79 -9.17 -0.86 0
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186804 77487790 1 N7C12H21 A7B12C21 64.05 6.18 -8.4 0.42 0
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186805 77487791 1 SO5N6C34H40 AB5C6D34E40 -118.96 3.6 -8.37 -1.4 0
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186806 77487831 1 ClFO2N6H20C21 ABC2D6E20F21 -27.74 9.18 -8.53 -0.83 0
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186807 77487989 1 IO4C13H23 AB4C13D23 -194.04 2.34 -9.75 -0.75 0
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186808 77488434 1 FO4C14H17 AB4C14D17 -216.53 1.67 -9.25 -0.5 0
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186809 77488435 1 FO5C16H19 AB5C16D19 -262.45 2.34 -9.15 -0.51 0
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186810 77488482 1 FSN6O7C47H59 ABC6D7E47F59 -265.95 6.95 -8.75 -1.02 0
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186811 77489462 1 FSiN2O5C26H35 ABC2D5E26F35 -288.25 7.01 -8.95 -0.16 0
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186812 77489466 1 ClSO2F3N3H15C17 ABC2D3E3F15G17 -202.25 4.46 -8.85 -0.89 0
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186813 77489467 1 ClO2F3N6H10C13 AB2C3D6E10F13 -138.77 3.85 -9.53 -0.92 0
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186814 77489779 1 N4O5C37H46 A4B5C37D46 -127.67 10.6 -8.79 -1.08 0
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186815 77490005 1 O4N5C21H27 A4B5C21D27 -122.89 7.7 -8.75 -0.71 0
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186816 77490217 1 O2N5C7H11 A2B5C7D11 -24.67 5.18 -10.3 -0.72 0
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186817 77490614 1 OSF3N5C22H26 ABC3D5E22F26 -143.43 4.05 -8.81 -1.24 0
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186818 77490825 1 F2N2O4C13H16 A2B2C4D13E16 -272.76 2.14 -9.38 -0.05 0
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186819 77490826 1 SN2O5C28H32 AB2C5D28E32 -200.32 7.24 -8.54 -0.51 0
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186820 77490912 1 ClOSN5C26H30 ABCD5E26F30 25.98 7.1 -8.71 -0.69 0
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186821 77490913 1 SO2N4C22H28 AB2C4D22E28 -19.84 3.59 -8.71 -0.56 0
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186822 77490955 1 ON2C10H10 AB2C10D10 57.78 10.65 -9.21 -2.08 0
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186823 77490956 1 NO4C6H13 AB4C6D13 -185.62 3.2 -9.96 1.02 0
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186824 77490957 1 N5O5C16H23 A5B5C16D23 -153.72 6.0 -9.79 -1.29 0
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186825 77490958 1 N2O2C29H38 A2B2C29D38 -32.64 2.75 -8.5 0.23 0
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186826 77490959 1 FOSN7C20H26 ABCD7E20F26 21.11 7.21 -8.78 -1.13 1
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186827 77490960 1 ON4C11H11 AB4C11D11 51.72 1.11 0.0 0.0 0
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186828 77490961 1 ClSO2N5C19H24 ABC2D5E19F24 -23.77 3.68 -8.74 -0.63 0
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186829 77490962 1 FN2O4C33H43 AB2C4D33E43 -159.3 2.35 -8.58 -0.19 0
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186830 77490963 1 FN2O3H23C27 AB2C3D23E27 -53.45 3.38 -9.5 -1.21 0
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186831 77490964 1 OSN5C22H29 ABC5D22E29 19.99 4.91 -8.86 -0.09 0
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186832 77490965 1 OSN6C22H30 ABC6D22E30 26.43 1.52 -8.38 -0.41 0
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186833 77491083 2 NOC16H21 ABC16D21 -17.75 1.93 -8.32 0.26 0
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186834 77491262 1 NO10C31H33 AB10C31D33 -364.05 5.17 -9.25 -0.83 0
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186835 77491402 1 N4O4C37H46 A4B4C37D46 -93.14 4.04 -8.25 -0.33 0
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186836 77491403 1 SF3N5C16H20 AB3C5D16E20 -105.36 5.15 -7.98 -0.73 0
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186837 77491404 1 BN4O4C19H27 AB4C4D19E27 -157.2 5.7 -9.19 -1.46 0
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186838 77491617 1 N4O7C33H44 A4B7C33D44 -263.14 7.37 -9.26 -0.12 0
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186839 77492011 2 SN4O4C21H30 AB4C4D21E30 -300.14 4.87 -8.4 -0.68 0
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186840 77492091 1 ClF3N4O4C23H26 AB3C4D4E23F26 -266.08 1.74 -9.38 -1.69 0
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186841 77492269 1 NO2C9H13 AB2C9D13 -91.46 3.85 -10.14 -0.07 0
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186842 77492270 1 F4N5H13C16 A4B5C13D16 -94.66 3.83 -9.3 -1.13 0
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186843 77492682 1 ClO3N4C24H25 AB3C4D24E25 -36.19 8.65 -9.46 -1.15 0
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186844 77492810 1 ClN3O3C9H10 AB3C3D9E10 -100.36 4.5 -9.59 -0.2 0
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186845 77492811 2 F2N2O2H11C12 A2B2C2D11E12 -288.07 6.19 -8.9 -1.57 0
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186846 77492812 1 O2N3C31H45 A2B3C31D45 -103.07 2.64 -8.35 0.08 0
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186847 77493237 1 F3N3O3C22H32 A3B3C3D22E32 -235.57 5.55 -9.72 -0.59 0
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186848 77493238 1 O3N5C22H31 A3B5C22D31 -7.54 3.58 -9.38 -0.53 0
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186849 77493740 1 N5O11C37H45 A5B11C37D45 -431.04 10.24 -9.33 -0.8 0
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186850 77493797 2 N2O4C7H9 A2B4C7D9 -297.44 3.23 -10.39 -1.0 0
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186851 77493866 1 FO2N8C29H37 AB2C8D29E37 -27.23 10.94 -7.98 -0.53 0